A0A096NHN5_PAPAN Loading...

IRF4-binding protein

AlphaFold DB (A0A2K6E656), UniProt , Accession A0A096NHN5, Species PAPAN (Papio anubis, Olive baboon), Gene DEF6, Length 718 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.8	Very low	39.5	Very low	238 Å²	238	157.7 Å²	157.7	100%	1.172	81%	0.812	S	S	*	*				0	102	0	-72	-56.6	-158	0	0	108.7
2	P	52.8	Low	39.2	Very low	114 Å²	114	154.9 Å²	154.9	74%	0.74	81%	0.807	S	S	*	*			trans	-98.3	170.7	172.5	38.8	-32.9	0	0	0	111.6
3	Q	38.3	Very low	39.8	Very low	201 Å²	201	151.5 Å²	151.5	94%	0.939	80%	0.8	S	S	*	*			trans	-152.2	101.9	145.7	-119.4	162.2	48.5	0	0	113.5
4	E	51	Low	39.3	Very low	162 Å²	162	148.6 Å²	148.6	76%	0.757	79%	0.791	S	S	*	*			trans	-49.7	174.2	141.7	-80.1	-99.7	160.3	0	0	111.9
5	P	59.4	Low	38.9	Very low	126 Å²	126	148.9 Å²	148.9	82%	0.818	79%	0.792	S	S	*	*			cis	-133.5	-172.1	19.9	41	-22	0	0	0	114
6	G	31.8	Very low	38.5	Very low	68 Å²	68	152.1 Å²	152.1	70%	0.701	79%	0.79	S	S	*	*			cis	-180	-173.2	-1.8	0	0	0	0	0	107.9
7	G	35.4	Very low	38	Very low	61 Å²	61	150.8 Å²	150.8	63%	0.629	78%	0.779	S	S	*	*			cis	148.7	153.5	7.2	0	0	0	0	0	109.3
8	Y	33.1	Very low	37.6	Very low	217 Å²	217	151.1 Å²	151.1	85%	0.851	78%	0.781	S	S	*	*			trans	74.4	140	-179.3	-53	-70	0	0	0	117.1
9	R	32.9	Very low	37.3	Very low	203 Å²	203	150 Å²	150	77%	0.766	78%	0.782	S	S	*	*			cis	-167.1	147	-21.9	-134.6	-176.9	-170.3	171	0.9	110.2
10	T	32.8	Very low	38	Very low	107 Å²	107	147.6 Å²	147.6	66%	0.656	78%	0.776	S	S	*	*			trans	31	142	144.1	51.3	0	0	0	0	121.3
11	R	31.3	Very low	37.7	Very low	238 Å²	238	145.6 Å²	145.6	90%	0.898	77%	0.774	S	S	*	*			cis	-166.4	161	29.2	-130.7	166.7	-166.1	-175.6	2.7	112
12	V	36	Very low	37.6	Very low	124 Å²	124	138.4 Å²	138.4	75%	0.752	75%	0.747	S	S	*	*			trans	-84.4	146.6	169.7	170.7	0	0	0	0	107.9
13	P	46.2	Very low	36.7	Very low	110 Å²	110	141.8 Å²	141.8	71%	0.714	75%	0.752	S	S	*	*				-158.6	147.2	72.8	44.4	-21.9	0	0	0	122.6
14	T	34	Very low	36.5	Very low	111 Å²	111	136.8 Å²	136.8	68%	0.681	75%	0.745	S	S	*	*			trans	46.7	136.7	134.5	66.4	0	0	0	0	125.7
15	L	33.4	Very low	35.5	Very low	154 Å²	154	132.8 Å²	132.8	81%	0.806	75%	0.748	S	S	*	*			trans	86	145.6	132	-85.2	165.9	0	0	0	122.1
16	R	31.6	Very low	34.1	Very low	200 Å²	200	133.6 Å²	133.6	76%	0.755	76%	0.756	S	S	*	*			trans	72.6	147.9	155.4	-81.4	-169.1	147	161.2	-10.1	118.5
17	E	30.3	Very low	34	Very low	130 Å²	130	133.2 Å²	133.2	61%	0.607	75%	0.753	S	S	*	*			cis	-165.3	-176.9	-17.7	-153.8	158.3	-127.4	0	0	109.1
18	L	30.1	Very low	33.9	Very low	155 Å²	155	135.2 Å²	135.2	81%	0.812	76%	0.763	S	S	*	*			trans	83.1	149.6	158	-65.3	163	0	0	0	121.4
19	V	31.7	Very low	33.7	Very low	131 Å²	131	129.4 Å²	129.4	79%	0.794	75%	0.754	S	S	*	*			trans	-140.3	-165	-179.7	-133.2	0	0	0	0	104.5
20	P	51.3	Low	33.8	Very low	102 Å²	102	126.7 Å²	126.7	66%	0.662	75%	0.75	S	S	*	*			cis	-132.4	-155.8	-26.3	32.6	-9.8	0	0	0	112.6
21	S	32.5	Very low	33.6	Very low	105 Å²	105	129 Å²	129	73%	0.734	75%	0.753	S	S	*	*			trans	72.9	154	148.9	34.8	0	0	0	0	119.8
22	S	34.6	Very low	33.4	Very low	88 Å²	88	121.8 Å²	121.8	62%	0.615	74%	0.739	S	S	*	*			cis	-172.3	169	-10.4	47.5	0	0	0	0	112.1
23	H	33.5	Very low	33.1	Very low	184 Å²	184	124.6 Å²	124.6	85%	0.852	74%	0.743	S	S	*	*			trans	69.1	160.8	154	-66.9	-44.1	0	0	0	118.7
24	A	33.7	Very low	32.3	Very low	96 Å²	96	124 Å²	124	79%	0.793	74%	0.742	S	S	*	*			cis	-168.4	166.3	-27.4	0	0	0	0	0	110.1
25	G	29.3	Very low	32.2	Very low	78 Å²	78	125.7 Å²	125.7	80%	0.804	75%	0.747	S	S	*	*			trans	171.4	138.6	169	0	0	0	0	0	113.1
26	S	30.9	Very low	32	Very low	143 Å²	143	128 Å²	128	100%	1	75%	0.745	S	S	*	*			trans	-161	160.6	-175.2	-168.2	0	0	0	0	113.8
27	G	28.9	Very low	32	Very low	61 Å²	61	126.8 Å²	126.8	63%	0.629	75%	0.748	S	S	*	*			trans	152.3	126.6	177.1	0	0	0	0	0	109.9
28	A	33.4	Very low	32	Very low	102 Å²	102	124.1 Å²	124.1	84%	0.843	76%	0.756	S	S	*	*			cis	69.7	136.9	42.2	0	0	0	0	0	112.6
29	S	29.6	Very low	31.9	Very low	95 Å²	95	122.1 Å²	122.1	66%	0.664	76%	0.755	S	S	*	*			cis	-167.2	170.4	0.3	-124.9	0	0	0	0	108.6
30	E	33.8	Very low	31.7	Very low	146 Å²	146	120.7 Å²	120.7	68%	0.682	75%	0.749	S	S	*	*			cis	-171.5	-168.9	0.9	-141.2	167.5	91.2	0	0	111.8
31	H	29.9	Very low	30.7	Very low	155 Å²	155	124.2 Å²	124.2	72%	0.718	76%	0.757	S	S	*	*			trans	69	153.6	154	-88.4	63	0	0	0	119
32	C	27.5	Very low	30.5	Very low	88 Å²	88	128.1 Å²	128.1	60%	0.595	76%	0.763	S	S	*	*			cis	-164.4	148.7	-28.8	-144.5	0	0	0	0	112.8
33	Q	29.6	Very low	30.2	Very low	182 Å²	182	127.6 Å²	127.6	85%	0.85	77%	0.771	S	S	*	*			trans	50.6	128.8	156	-70.4	175.6	22.9	0	0	124.2
34	S	29.8	Very low	30	Very low	98 Å²	98	123.7 Å²	123.7	69%	0.685	77%	0.771	S	S	*	*				130.7	110.5	119.4	-164.8	0	0	0	0	117.4
35	N	30	Very low	29.7	Very low	146 Å²	146	125 Å²	125	78%	0.781	78%	0.775	S	S	*	*			trans	53.4	146.9	146.7	-72.7	-63.8	0	0	0	121
36	R	30	Very low	29.5	Very low	203 Å²	203	132.7 Å²	132.7	77%	0.766	78%	0.779	S	S	*	*			cis	-157.9	148.4	20.4	-137.7	178.8	-161	-171.2	7.9	111.3
37	Q	30.7	Very low	29.4	Very low	174 Å²	174	130.2 Å²	130.2	81%	0.813	76%	0.762	S	S	*	*			trans	46.9	116.5	150.2	-72.7	164.7	-41.8	0	0	121
38	G	30.3	Very low	29.3	Very low	75 Å²	75	135.5 Å²	135.5	77%	0.773	77%	0.77	S	S	*	*			trans	-179	102.8	163.3	0	0	0	0	0	114
39	S	29.3	Very low	29	Very low	113 Å²	113	139.1 Å²	139.1	79%	0.79	77%	0.77	S	S	*	*			trans	-51.8	129.8	175.4	-173	0	0	0	0	111.6
40	C	27.5	Very low	29	Very low	101 Å²	101	139.2 Å²	139.2	68%	0.682	78%	0.776	S	S	*	*				46.2	129.7	80.6	-56.1	0	0	0	0	112.9
41	Q	29.1	Very low	28.7	Very low	175 Å²	175	136.4 Å²	136.4	82%	0.818	79%	0.786	S	S	*	*			cis	-134.9	144.5	23.6	-69.2	175.4	-11.7	0	0	110.6
42	H	29.3	Very low	28.5	Very low	188 Å²	188	132.6 Å²	132.6	87%	0.87	79%	0.789	S	S	*	*				42.8	135.8	95.3	-60.1	39.2	0	0	0	114.6
43	G	28.5	Very low	28.5	Very low	76 Å²	76	133.3 Å²	133.3	78%	0.784	80%	0.801	S	S	*	*			cis	169.8	-177	2	0	0	0	0	0	107.9
44	A	28.2	Very low	28.4	Very low	103 Å²	103	133.2 Å²	133.2	85%	0.851	81%	0.805	S	S	*	*			cis	-161.6	147.4	-13.1	0	0	0	0	0	107.7
45	S	27.3	Very low	28.2	Very low	124 Å²	124	132.7 Å²	132.7	87%	0.867	81%	0.807	S	S	*	*			trans	-99.4	121.3	-170.8	-50.3	0	0	0	0	114.3
46	R	26.7	Very low	28.1	Very low	239 Å²	239	131 Å²	131	90%	0.902	81%	0.805	S	S	*	*			trans	-153.1	133.8	153.5	-79.5	-158.7	174.9	-173.3	-2.6	108.2
47	S	27.4	Very low	28	Very low	91 Å²	91	127.7 Å²	127.7	64%	0.636	81%	0.809	S	S	*	*			cis	101.8	96	24.8	76.1	0	0	0	0	113.9
48	E	26.7	Very low	27.7	Very low	172 Å²	172	127.1 Å²	127.1	80%	0.804	81%	0.806	S	S	*	*			trans	-172.9	129.6	144.4	-101.8	154.1	172.4	0	0	107.4
49	Q	28.7	Very low	27.6	Very low	178 Å²	178	129.7 Å²	129.7	83%	0.832	81%	0.81	S	S	*	*				60.5	145	87.7	-64.1	-168.8	39.4	0	0	114.8
50	A	27.9	Very low	27.5	Very low	97 Å²	97	132.3 Å²	132.3	80%	0.802	81%	0.814	S	S	*	*			cis	-168.4	151.1	-24.8	0	0	0	0	0	107.4
51	G	27.7	Very low	27.5	Very low	86 Å²	86	131.7 Å²	131.7	89%	0.887	81%	0.81	S	S	*	*			trans	168.1	83.6	177.7	0	0	0	0	0	114.1
52	G	26.8	Very low	27.4	Very low	76 Å²	76	126.9 Å²	126.9	78%	0.784	81%	0.807	S	S	*	*			trans	-102.3	143	178.2	0	0	0	0	0	112.9
53	A	26.5	Very low	27.7	Very low	103 Å²	103	122 Å²	122	85%	0.851	79%	0.787	S	S	*	*			trans	-115	125.6	159.5	0	0	0	0	0	108.1
54	L	28.6	Very low	27.9	Very low	179 Å²	179	123.5 Å²	123.5	94%	0.937	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-82	125.6	-177.2	-76.6	81.8	0	0	0	111
55	A	25.7	Very low	28	Very low	87 Å²	87	123.8 Å²	123.8	72%	0.719	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-102.6	148.3	154.8	0	0	0	0	0	108.9
56	P	27.4	Very low	28.4	Very low	112 Å²	112	129.1 Å²	129.1	73%	0.727	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-69.8	145.7	-174.5	28.4	-35.2	0	0	0	112.2	Q58	P56-Q58 PolarHBondContact O-N 3.29Å
57	P	26.8	Very low	28.8	Very low	133 Å²	133	122.4 Å²	122.4	86%	0.864	76%	0.762	S	S	*	*			trans	-73.4	97.1	179.1	30.3	-34.4	0	0	0	110.9
58	Q	26.2	Very low	29.1	Very low	161 Å²	161	126.4 Å²	126.4	75%	0.752	77%	0.77	S	S	*	*			trans	-70.6	146.3	162.4	-69.1	-161.1	-1.8	0	0	110.4	P56 L60	P56-Q58 PolarHBondContact O-N 3.29Å; Q58-L60 PolarHBondContact O-N 3.19Å
59	P	27	Very low	29.7	Very low	130 Å²	130	121.3 Å²	121.3	84%	0.844	75%	0.746	S	S	*	*			trans	-73.3	86.8	-176.4	30	-35.4	0	0	0	111.2	C61	P59-C61 PolarHBondContact O-N 3.36Å
60	L	27.5	Very low	30.2	Very low	167 Å²	167	117 Å²	117	87%	0.874	73%	0.728	S	S	*	*			trans	-64.4	91.4	173.8	-75.7	173.1	0	0	0	110.8	Q58 G62	Q58-L60 PolarHBondContact O-N 3.19Å; L60-G62 PolarHBondContact O-N 3.33Å; L60-G62 VanDerWaalsContact O-N 3.16Å
61	C	27.3	Very low	30.1	Very low	89 Å²	89	120.5 Å²	120.5	60%	0.601	73%	0.725	S	S	*	*			trans	-61.5	115	168.1	-172.3	0	0	0	0	109.1	P59 L63	P59-C61 PolarHBondContact O-N 3.36Å; C61-L63 PolarHBondContact O-N 3Å
62	G	26.9	Very low	30.3	Very low	73 Å²	73	120.3 Å²	120.3	75%	0.753	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	9.7	-169.4	0	0	0	0	0	117.1	L60	L60-G62 PolarHBondContact O-N 3.33Å; L60-G62 VanDerWaalsContact O-N 3.16Å
63	L	35.9	Very low	30.3	Very low	86 Å²	86	124.3 Å²	124.3	45%	0.45	71%	0.712	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.8	-25	-178.3	-80.3	164.7	0	0	0	114.3	C61 K109	C61-L63 PolarHBondContact O-N 3Å; L63-K109 HydrophobicContact CD1-CB 4.3Å; L63-K109 HydrophobicContact CD1-CD 4.31Å; L63-K109 HydrophobicContact CD2-CB 4.43Å; L63-K109 WeakPolarHBondContact CD2-O 3.45Å
64	C	32.9	Very low	30.7	Very low	108 Å²	108	126.6 Å²	126.6	73%	0.73	71%	0.709	S	S	*	*	S	Bend	trans	-77.7	-36.5	-174.5	-69.4	0	0	0	0	113.8	R66	C64-R66 VanDerWaalsContact C-N 3.34Å; C64-R66 PolarHBondContact O-N 2.97Å
65	S	29.6	Very low	30.7	Very low	108 Å²	108	120.8 Å²	120.8	76%	0.755	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	5.5	-160.4	-47.7	0	0	0	0	116.4
66	R	35.4	Very low	31	Very low	237 Å²	237	124 Å²	124	89%	0.894	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.3	9	179.3	-74.7	-165	173	-160.8	-2.3	115.8	C64 H68	C64-R66 VanDerWaalsContact C-N 3.34Å; C64-R66 PolarHBondContact O-N 2.97Å; R66-H68 PolarHBondContact O-N 3.48Å
67	L	35.3	Very low	31.4	Very low	97 Å²	97	129.9 Å²	129.9	51%	0.508	71%	0.71	S	S	.	*			trans	-77.1	77.2	170.9	-77.7	171.6	0	0	0	111	F69	L67-F69 HydrophobicContact CD2-CD2 3.8Å; L67-F69 HydrophobicContact CD2-CE2 4.39Å; L67-F69 HydrophobicContact CD2-CG 4.29Å; L67-F69 PolarHBondContact O-N 3.43Å
68	H	34.4	Very low	31.9	Very low	175 Å²	175	128.1 Å²	128.1	81%	0.81	71%	0.707	S	S	*	*			trans	-72.2	32.2	165.2	-132.8	-95.2	0	0	0	111.9	R66	R66-H68 PolarHBondContact O-N 3.48Å
69	F	38.5	Very low	32.4	Very low	66 Å²	66	125.1 Å²	125.1	29%	0.289	71%	0.709	S	S	.	*			trans	-73.4	126.1	176.5	-103.3	-114.3	0	0	0	109	L67 S152 M156	L67-F69 HydrophobicContact CD2-CD2 3.8Å; L67-F69 HydrophobicContact CD2-CE2 4.39Å; L67-F69 HydrophobicContact CD2-CG 4.29Å; L67-F69 PolarHBondContact O-N 3.43Å; F69-S152 WeakPolarHBondContact CE2-OG 3.5Å; F69-M156 HydrophobicContact CD1-CE 4.43Å; F69-M156 HydrophobicContact CE1-CE 3.94Å; F69-M156 HydrophobicContact CE1-CG 3.79Å; F69-M156 HydrophobicContact CE1-SD 4.04Å; F69-M156 HydrophobicContact CZ-CG 3.74Å
70	L	39	Very low	33	Very low	86 Å²	86	123.3 Å²	123.3	45%	0.45	70%	0.698	S	S	.	*			trans	69.7	62.1	170.5	-58.4	147.7	0	0	0	115.9	L95 Y220	L70-L95 HydrophobicContact CD2-CD2 4Å; L70-Y220 HydrophobicContact CD1-CD2 3.19Å; L70-Y220 HydrophobicContact CD1-CE2 3.26Å; L70-Y220 HydrophobicContact CD1-CG 4.23Å
71	K	26	Very low	34.1	Very low	171 Å²	171	119.3 Å²	119.3	74%	0.743	68%	0.684	S	S	*	*				-101.2	113.9	122.7	-78.3	-175.2	177.1	178.3	0	108.7
72	P	32.8	Very low	35.3	Very low	82 Å²	82	124.1 Å²	124.1	53%	0.532	69%	0.69	S	S	.	*			trans	-67.5	131.8	150.8	30.1	-30.2	0	0	0	107.3	L74	P72-L74 PolarHBondContact O-N 3.19Å
73	D	27.6	Very low	36.6	Very low	161 Å²	161	124.2 Å²	124.2	86%	0.861	68%	0.683	S	S	*	*			trans	-69	93.9	177.7	-81.1	-48.2	0	0	0	110.6	G75	D73-G75 PolarHBondContact O-N 3.45Å
74	L	33.7	Very low	37.7	Very low	151 Å²	151	121.4 Å²	121.4	79%	0.791	68%	0.675	S	S	*	*			trans	-75.4	64.8	171.7	-70.9	171.1	0	0	0	110.2	P72 V76	P72-L74 PolarHBondContact O-N 3.19Å; L74-V76 PolarHBondContact O-N 2.93Å
75	G	27.9	Very low	39.1	Very low	57 Å²	57	118.5 Å²	118.5	59%	0.588	66%	0.658	S	S	*	*			trans	-54.3	127.6	159.3	0	0	0	0	0	108.8	D73 R77	D73-G75 PolarHBondContact O-N 3.45Å; G75-R77 PolarHBondContact O-N 3.28Å
76	V	32.8	Very low	40.8	Very low	154 Å²	154	114.5 Å²	114.5	93%	0.933	63%	0.631	S	S	*	*	S	Bend	trans	-55.5	106.1	-165.2	-178.4	0	0	0	0	111.2	L74	L74-V76 PolarHBondContact O-N 2.93Å
77	R	35.6	Very low	42.4	Very low	235 Å²	235	105 Å²	105	89%	0.887	60%	0.603	S	S	*	*			trans	-129.9	150.9	174	-82.2	-173.6	163.4	-168.8	-4.9	109.5	G75	G75-R77 PolarHBondContact O-N 3.28Å
78	A	37.7	Very low	44.2	Very low	97 Å²	97	104.9 Å²	104.9	80%	0.802	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-56.4	154.6	-177.1	0	0	0	0	0	112.4
79	A	36	Very low	46.2	Very low	97 Å²	97	98.6 Å²	98.6	80%	0.802	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-49.9	129.9	-179.1	0	0	0	0	0	111.1
80	P	40.9	Very low	48.3	Very low	92 Å²	92	96.4 Å²	96.4	60%	0.597	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-63.6	145.2	-174.2	26.1	-34.6	0	0	0	110.8	A85	P80-A85 HydrophobicContact CG-CB 4.49Å
81	S	49.2	Very low	50.5	Low	84 Å²	84	95.4 Å²	95.4	59%	0.587	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-57.3	154.5	171.4	70.2	0	0	0	0	110.6	A83 G84 A85	S81-A83 PolarHBondContact O-N 2.87Å; S81-G84 WeakPolarHBondContact O-CA 3.46Å; S81-G84 PolarHBondContact O-N 3.33Å; S81-G84 PolarHBondContact OG-N 3.38Å; S81-A85 PolarHBondContact O-N 3.27Å
82	R	53.2	Low	53.2	Low	190 Å²	190	92.8 Å²	92.8	72%	0.717	55%	0.549	S	S	*	.	H	α-helix	trans	-54	-29.6	180	-178.8	170.1	157.2	-142.7	-11	113.1	S86 G404	R82-S86 PolarHBondContact O-N 2.7Å; R82-G404 VanDerWaalsContact NH2-C 3.34Å; R82-G404 PolarHBondContact NH2-O 2.89Å
83	A	55.1	Low	55.7	Low	75 Å²	75	91.3 Å²	91.3	62%	0.62	54%	0.535	S	S	*	.	H	α-helix	trans	-70.4	-47.9	170.9	0	0	0	0	0	112.7	S81 A85 S86 A87	S81-A83 PolarHBondContact O-N 2.87Å; A83-A85 VanDerWaalsContact C-N 3.31Å; A83-A85 PolarHBondContact O-N 3.18Å; A83-S86 WeakPolarHBondContact O-CB 3.5Å; A83-S86 PolarHBondContact O-N 2.78Å; A83-S86 VanDerWaalsContact O-N 3.13Å; A83-A87 PolarHBondContact O-N 2.98Å
84	G	59.1	Low	58.6	Low	27 Å²	27	83.7 Å²	83.7	28%	0.278	49%	0.494	S	S	.	.	H	α-helix	trans	-62.1	-36	176.3	0	0	0	0	0	113.3	S81 A87 M88	S81-G84 WeakPolarHBondContact O-CA 3.46Å; S81-G84 PolarHBondContact O-N 3.33Å; S81-G84 PolarHBondContact OG-N 3.38Å; G84-A87 PolarHBondContact O-N 3.34Å; G84-M88 WeakPolarHBondContact O-CB 3.49Å; G84-M88 VanDerWaalsContact O-CG 3.27Å; G84-M88 WeakPolarHBondContact O-CG 3.46Å; G84-M88 PolarHBondContact O-N 2.97Å
85	A	60.9	Low	61.2	Low	46 Å²	46	77.3 Å²	77.3	38%	0.38	46%	0.461	S	S	.	.	H	α-helix	trans	-62.6	-42.2	172.1	0	0	0	0	0	112.1	P80 S81 A83 M88 A89	P80-A85 HydrophobicContact CG-CB 4.49Å; S81-A85 PolarHBondContact O-N 3.27Å; A83-A85 VanDerWaalsContact C-N 3.31Å; A83-A85 PolarHBondContact O-N 3.18Å; A85-M88 PolarHBondContact O-N 3.47Å; A85-A89 PolarHBondContact O-N 3.48Å
86	S	65.3	Low	64.1	Low	25 Å²	25	75 Å²	75	18%	0.175	44%	0.435	C	S	.	.	H	α-helix	trans	-62.6	-46.9	175.5	-157.2	0	0	0	0	111.9	R82 A83 M88 A89 L90 E169 K406	R82-S86 PolarHBondContact O-N 2.7Å; A83-S86 WeakPolarHBondContact O-CB 3.5Å; A83-S86 PolarHBondContact O-N 2.78Å; A83-S86 VanDerWaalsContact O-N 3.13Å; S86-M88 VanDerWaalsContact C-N 3.34Å; S86-M88 PolarHBondContact O-N 3.24Å; S86-A89 WeakPolarHBondContact O-CB 3.38Å; S86-A89 PolarHBondContact O-N 3.39Å; S86-A89 VanDerWaalsContact O-N 3.16Å; S86-L90 PolarHBondContact O-N 3.07Å; S86-E169 PolarHBondContact OG-OE2 3.24Å; S86-K406 PolarHBondContact OG-NZ 2.68Å
87	A	68.5	Low	66.8	Low	37 Å²	37	67.8 Å²	67.8	31%	0.306	39%	0.391	S	S	.	.	H	α-helix	trans	-60.5	-42.5	176.9	0	0	0	0	0	111.9	A83 G84 A89 L90 R91	A83-A87 PolarHBondContact O-N 2.98Å; G84-A87 PolarHBondContact O-N 3.34Å; A87-A89 VanDerWaalsContact C-N 3.32Å; A87-A89 PolarHBondContact O-N 3.16Å; A87-L90 PolarHBondContact O-N 3.49Å; A87-R91 WeakPolarHBondContact O-CG 3.33Å; A87-R91 PolarHBondContact O-N 3.4Å
88	M	74.8	Confident	69.3	Low	94 Å²	94	56.7 Å²	56.7	46%	0.463	35%	0.349	S	S	.	.	H	α-helix	trans	-66.6	-29.7	176.3	-71.5	-69.4	-80	0	0	113.3	G84 A85 S86 K92	G84-M88 WeakPolarHBondContact O-CB 3.49Å; G84-M88 VanDerWaalsContact O-CG 3.27Å; G84-M88 WeakPolarHBondContact O-CG 3.46Å; G84-M88 PolarHBondContact O-N 2.97Å; A85-M88 PolarHBondContact O-N 3.47Å; S86-M88 VanDerWaalsContact C-N 3.34Å; S86-M88 PolarHBondContact O-N 3.24Å; M88-K92 WeakPolarHBondContact O-CG 3.44Å; M88-K92 PolarHBondContact O-N 3.05Å
89	A	76.3	Confident	71.7	Confident	43 Å²	43	54.6 Å²	54.6	36%	0.355	32%	0.32	S	S	.	.	H	α-helix	trans	-70.7	-48.8	171.5	0	0	0	0	0	111.5	A85 S86 A87 R91 K92 E93	A85-A89 PolarHBondContact O-N 3.48Å; S86-A89 WeakPolarHBondContact O-CB 3.38Å; S86-A89 PolarHBondContact O-N 3.39Å; S86-A89 VanDerWaalsContact O-N 3.16Å; A87-A89 VanDerWaalsContact C-N 3.32Å; A87-A89 PolarHBondContact O-N 3.16Å; A89-R91 VanDerWaalsContact C-N 3.34Å; A89-R91 PolarHBondContact O-N 2.72Å; A89-K92 WeakPolarHBondContact O-CB 3.35Å; A89-K92 PolarHBondContact O-N 3.17Å; A89-K92 VanDerWaalsContact O-N 3.11Å; A89-E93 PolarHBondContact O-N 3.13Å
90	L	81.8	Confident	74	Confident	20 Å²	20	50.2 Å²	50.2	11%	0.105	28%	0.283	C	S	.	.	H	α-helix	trans	-55.9	-46.7	178	-176.6	65.5	0	0	0	112	S86 A87 K92 E93 L94 V167 E169 F172	S86-L90 PolarHBondContact O-N 3.07Å; A87-L90 PolarHBondContact O-N 3.49Å; L90-K92 VanDerWaalsContact C-N 3.32Å; L90-K92 PolarHBondContact O-N 3.44Å; L90-E93 PolarHBondContact O-N 3.37Å; L90-L94 HydrophobicContact CD1-CD1 4.47Å; L90-L94 HydrophobicContact CD1-CG 4.49Å; L90-L94 HydrophobicContact CG-CD1 4.15Å; L90-L94 WeakPolarHBondContact O-CG 3.42Å; L90-L94 PolarHBondContact O-N 3.14Å; L90-V167 HydrophobicContact CD2-CG1 3.89Å; L90-E169 HydrophobicContact CD2-CB 3.88Å; L90-E169 HydrophobicContact CD2-CG 4Å; L90-F172 HydrophobicContact CD1-CZ 4.28Å
91	R	84.4	Confident	76.2	Confident	65 Å²	65	45.8 Å²	45.8	25%	0.245	26%	0.255	C	S	.	.	H	α-helix	trans	-58.9	-40.3	177.2	-68.6	170.8	-173	-155.5	2.4	112.7	A87 A89 L95 L164 D165	A87-R91 WeakPolarHBondContact O-CG 3.33Å; A87-R91 PolarHBondContact O-N 3.4Å; A89-R91 VanDerWaalsContact C-N 3.34Å; A89-R91 PolarHBondContact O-N 2.72Å; R91-L95 VanDerWaalsContact O-CB 3.3Å; R91-L95 WeakPolarHBondContact O-CB 3.11Å; R91-L95 PolarHBondContact O-N 3.09Å; R91-L164 HydrophobicContact CG-CB 4.19Å; R91-L164 PolarHBondContact NE-O 3.42Å; R91-L164 VanDerWaalsContact NE-O 3.14Å; R91-D165 IonicContact CZ-OD1 2.66Å; R91-D165 IonicContact NH1-OD1 2.73Å; R91-D165 PolarHBondContact NH1-OD1 2.96Å; R91-D165 IonicContact NH2-OD1 3.98Å; R91-D165 PolarHBondContact NH2-OD1 2.94Å
92	K	83.8	Confident	77.8	Confident	117 Å²	117	42.8 Å²	42.8	51%	0.509	23%	0.231	S	C	.	.	H	α-helix	trans	-65.8	-41.4	175.7	-75.1	176	177.4	-173.8	0	112	M88 A89 L90 L95 K96	M88-K92 WeakPolarHBondContact O-CG 3.44Å; M88-K92 PolarHBondContact O-N 3.05Å; A89-K92 WeakPolarHBondContact O-CB 3.35Å; A89-K92 PolarHBondContact O-N 3.17Å; A89-K92 VanDerWaalsContact O-N 3.11Å; L90-K92 VanDerWaalsContact C-N 3.32Å; L90-K92 PolarHBondContact O-N 3.44Å; K92-L95 PolarHBondContact O-N 3.29Å; K92-K96 PolarHBondContact O-N 2.78Å
93	E	85.9	Confident	79.1	Confident	51 Å²	51	36 Å²	36	24%	0.238	21%	0.211	C	C	.	.	H	α-helix	trans	-62.9	-47.9	177.6	-72.2	175.2	-143.7	0	0	111.5	A89 L90 L95 K96 K410	A89-E93 PolarHBondContact O-N 3.13Å; L90-E93 PolarHBondContact O-N 3.37Å; E93-L95 VanDerWaalsContact C-N 3.35Å; E93-L95 PolarHBondContact O-N 3.2Å; E93-K96 PolarHBondContact O-N 3.17Å; E93-K410 WeakPolarHBondContact OE1-CE 3.43Å; E93-K410 IonicContact OE1-NZ 3.1Å; E93-K410 PolarHBondContact OE1-NZ 3.4Å; E93-K410 IonicContact OE2-NZ 3.88Å; E93-K410 PolarHBondContact OE2-NZ 3.22Å
94	L	88	Confident	80.5	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.5	-39.4	177.5	-61.9	173.7	0	0	0	112.1	L90 K96 S97 I98 L129 L164 V167 F172 F177	L90-L94 HydrophobicContact CD1-CD1 4.47Å; L90-L94 HydrophobicContact CD1-CG 4.49Å; L90-L94 HydrophobicContact CG-CD1 4.15Å; L90-L94 WeakPolarHBondContact O-CG 3.42Å; L90-L94 PolarHBondContact O-N 3.14Å; L94-K96 PolarHBondContact O-N 2.99Å; L94-S97 PolarHBondContact O-N 3.48Å; L94-I98 HydrophobicContact CB-CD1 4.27Å; L94-I98 WeakPolarHBondContact O-CD1 3.48Å; L94-I98 WeakPolarHBondContact O-CG1 3.5Å; L94-I98 PolarHBondContact O-N 3.49Å; L94-L129 HydrophobicContact CD1-CD2 4.43Å; L94-L129 HydrophobicContact CD2-CD2 4.42Å; L94-L164 HydrophobicContact CB-CD2 4.03Å; L94-L164 HydrophobicContact CD1-CD2 4.22Å; L94-V167 HydrophobicContact CD1-CB 4.34Å; L94-V167 HydrophobicContact CD1-CG1 3.94Å; L94-V167 HydrophobicContact CD1-CG2 4.03Å; L94-F172 HydrophobicContact CD1-CZ 4.28Å; L94-F172 HydrophobicContact CD2-CE2 4Å; L94-F172 HydrophobicContact CD2-CZ 3.92Å; L94-F177 HydrophobicContact CB-CE1 4.27Å; L94-F177 HydrophobicContact CB-CE2 4.5Å; L94-F177 HydrophobicContact CB-CZ 3.8Å; L94-F177 HydrophobicContact CD2-CD1 3.66Å; L94-F177 HydrophobicContact CD2-CD2 4.29Å; L94-F177 HydrophobicContact CD2-CE1 3.31Å; L94-F177 HydrophobicContact CD2-CE2 3.95Å; L94-F177 HydrophobicContact CD2-CG 4.15Å; L94-F177 HydrophobicContact CD2-CZ 3.46Å; L94-F177 VanDerWaalsContact CD2-CZ 3.46Å; L94-F177 HydrophobicContact CG-CE1 4.37Å; L94-F177 HydrophobicContact CG-CZ 4.21Å
95	L	88.1	Confident	81.6	Confident	17 Å²	17	32.5 Å²	32.5	9%	0.089	18%	0.175	C	C	.	.	H	α-helix	trans	-61.2	-29	-179.6	-173.4	63.8	0	0	0	112.9	L70 R91 K92 E93 W99 M156 L159 L164	L70-L95 HydrophobicContact CD2-CD2 4Å; R91-L95 VanDerWaalsContact O-CB 3.3Å; R91-L95 WeakPolarHBondContact O-CB 3.11Å; R91-L95 PolarHBondContact O-N 3.09Å; K92-L95 PolarHBondContact O-N 3.29Å; E93-L95 VanDerWaalsContact C-N 3.35Å; E93-L95 PolarHBondContact O-N 3.2Å; L95-W99 VanDerWaalsContact O-CB 3.29Å; L95-W99 WeakPolarHBondContact O-CB 3.49Å; L95-W99 PolarHBondContact O-N 3.45Å; L95-M156 HydrophobicContact CD1-CE 4.01Å; L95-M156 HydrophobicContact CD1-SD 4.09Å; L95-M156 HydrophobicContact CD2-CE 4.23Å; L95-L159 HydrophobicContact CD1-CD2 3.99Å; L95-L164 HydrophobicContact CD1-CD1 4.46Å
96	K	89.4	Confident	82.4	Confident	10 Å²	10	31.2 Å²	31.2	4%	0.043	16%	0.162	C	C	.	.	H	α-helix	trans	-64.2	-50.1	176.3	-65.7	-167.6	-176.8	-164.5	0	111.8	K92 E93 L94 W99 Y100 N213 S216 E217 D218 Y220 L222	K92-K96 PolarHBondContact O-N 2.78Å; E93-K96 PolarHBondContact O-N 3.17Å; L94-K96 PolarHBondContact O-N 2.99Å; K96-W99 PolarHBondContact O-N 3.14Å; K96-Y100 WeakPolarHBondContact O-CD2 3.37Å; K96-Y100 PolarHBondContact O-N 3.02Å; K96-N213 WeakPolarHBondContact CD-O 3.28Å; K96-S216 WeakPolarHBondContact CD-OG 3.32Å; K96-S216 PolarHBondContact NZ-O 3.4Å; K96-S216 PolarHBondContact NZ-OG 3.11Å; K96-E217 PolarHBondContact NZ-O 3.39Å; K96-D218 VanDerWaalsContact CE-OD1 3.23Å; K96-D218 WeakPolarHBondContact CE-OD1 3.44Å; K96-D218 IonicContact NZ-OD1 2.67Å; K96-D218 PolarHBondContact NZ-OD1 3.08Å; K96-Y220 WeakPolarHBondContact CG-OH 3.39Å; K96-Y220 PolarHBondContact N-OH 3.32Å; K96-L222 HydrophobicContact CB-CD1 3.69Å; K96-L222 HydrophobicContact CD-CD1 4.18Å; K96-L222 HydrophobicContact CD-CD2 3.88Å; K96-L222 HydrophobicContact CG-CD1 3.85Å; K96-L222 HydrophobicContact CG-CD2 3.98Å
97	S	89	Confident	82.7	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.007	19%	0.185	C	C	.	.	H	α-helix	trans	-64.6	-41.3	177.5	-59.5	0	0	0	0	111.5	L94 W99 Y100 A101 D178 C181 N213	L94-S97 PolarHBondContact O-N 3.48Å; S97-W99 PolarHBondContact O-N 3.05Å; S97-Y100 PolarHBondContact O-N 3.22Å; S97-A101 PolarHBondContact O-N 2.96Å; S97-D178 WeakPolarHBondContact CB-OD1 3.43Å; S97-D178 PolarHBondContact OG-OD1 2.98Å; S97-C181 WeakPolarHBondContact O-CB 3.42Å; S97-N213 PolarHBondContact OG-ND2 3.47Å
98	I	87.8	Confident	82.6	Confident	2 Å²	2	41 Å²	41	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-66.7	-35.3	177.3	-65.3	157	0	0	0	112.1	L94 Y100 A101 F102 L125 L159 L164 F177	L94-I98 HydrophobicContact CB-CD1 4.27Å; L94-I98 WeakPolarHBondContact O-CD1 3.48Å; L94-I98 WeakPolarHBondContact O-CG1 3.5Å; L94-I98 PolarHBondContact O-N 3.49Å; I98-Y100 VanDerWaalsContact C-N 3.34Å; I98-Y100 PolarHBondContact O-N 3.34Å; I98-A101 PolarHBondContact O-N 3.26Å; I98-F102 WeakPolarHBondContact O-CB 3.46Å; I98-F102 PolarHBondContact O-N 3.24Å; I98-L125 HydrophobicContact CD1-CD1 4.45Å; I98-L125 HydrophobicContact CD1-CD2 4.36Å; I98-L125 HydrophobicContact CG1-CD1 4.32Å; I98-L125 HydrophobicContact CG1-CD2 4.08Å; I98-L159 HydrophobicContact CD1-CD1 4.33Å; I98-L159 HydrophobicContact CG2-CD1 4.32Å; I98-L159 HydrophobicContact CG2-CD2 3.75Å; I98-L164 HydrophobicContact CD1-CD2 4.17Å; I98-F177 HydrophobicContact CD1-CE2 3.98Å; I98-F177 HydrophobicContact CD1-CZ 3.95Å; I98-F177 HydrophobicContact CG1-CE2 3.93Å; I98-F177 HydrophobicContact CG1-CZ 3.8Å
99	W	87.3	Confident	82.3	Confident	53 Å²	53	43.5 Å²	43.5	20%	0.201	21%	0.214	C	C	.	.	H	α-helix	trans	-64	-37.4	176.3	176.8	80.9	0	0	0	112.5	L95 K96 S97 F102 T103 Y220 P221 L222	L95-W99 VanDerWaalsContact O-CB 3.29Å; L95-W99 WeakPolarHBondContact O-CB 3.49Å; L95-W99 PolarHBondContact O-N 3.45Å; K96-W99 PolarHBondContact O-N 3.14Å; S97-W99 PolarHBondContact O-N 3.05Å; W99-F102 PolarHBondContact O-N 2.96Å; W99-T103 HydrophobicContact CD2-CG2 4.12Å; W99-T103 HydrophobicContact CG-CG2 4.45Å; W99-T103 HydrophobicContact CZ2-CG2 3.89Å; W99-T103 WeakPolarHBondContact O-CB 3.48Å; W99-T103 WeakPolarHBondContact O-CG2 3.36Å; W99-T103 PolarHBondContact O-N 3.14Å; W99-T103 PolarHBondContact O-OG1 2.98Å; W99-Y220 HydrophobicContact CB-CD1 4.17Å; W99-Y220 HydrophobicContact CB-CE1 3.56Å; W99-Y220 AromaticContact CD1-CD1 3.69Å; W99-Y220 AromaticContact CD1-CE1 3.94Å; W99-Y220 AromaticContact CD2-CD1 3.43Å; W99-Y220 HydrophobicContact CD2-CD1 3.43Å; W99-Y220 VanDerWaalsContact CD2-CD1 3.43Å; W99-Y220 AromaticContact CD2-CE1 3.69Å; W99-Y220 HydrophobicContact CD2-CE1 3.69Å; W99-Y220 AromaticContact CE2-CD1 3.61Å; W99-Y220 AromaticContact CE3-CD1 3.95Å; W99-Y220 HydrophobicContact CE3-CD1 3.95Å; W99-Y220 HydrophobicContact CE3-CE1 4.1Å; W99-Y220 AromaticContact CG-CD1 3.51Å; W99-Y220 HydrophobicContact CG-CD1 3.51Å; W99-Y220 AromaticContact CG-CE1 3.43Å; W99-Y220 HydrophobicContact CG-CE1 3.43Å; W99-Y220 VanDerWaalsContact CG-CE1 3.43Å; W99-Y220 HydrophobicContact CZ2-CD1 4.26Å; W99-Y220 AromaticContact NE1-CD1 3.75Å; W99-P221 HydrophobicContact CH2-CB 3.68Å; W99-P221 HydrophobicContact CZ2-CB 3.97Å; W99-L222 HydrophobicContact CE3-CD1 3.82Å; W99-L222 HydrophobicContact CE3-CG 4.11Å; W99-L222 HydrophobicContact CZ3-CB 4.15Å; W99-L222 HydrophobicContact CZ3-CD1 4.19Å; W99-L222 HydrophobicContact CZ3-CG 4.15Å
100	Y	86.2	Confident	81.8	Confident	5 Å²	5	44.1 Å²	44.1	2%	0.02	22%	0.216	C	C	.	.	H	α-helix	trans	-63.8	-44.7	171.3	-81.8	-63.2	0	0	0	111.8	K96 S97 I98 F102 T103 A104 T185 W209 F212 N213 L222 V268 W269	K96-Y100 WeakPolarHBondContact O-CD2 3.37Å; K96-Y100 PolarHBondContact O-N 3.02Å; S97-Y100 PolarHBondContact O-N 3.22Å; I98-Y100 VanDerWaalsContact C-N 3.34Å; I98-Y100 PolarHBondContact O-N 3.34Å; Y100-F102 PolarHBondContact O-N 3.24Å; Y100-T103 PolarHBondContact O-N 3.4Å; Y100-T103 PolarHBondContact O-OG1 3.05Å; Y100-A104 WeakPolarHBondContact O-CB 3.41Å; Y100-A104 PolarHBondContact O-N 3.13Å; Y100-T185 VanDerWaalsContact C-OG1 3.22Å; Y100-T185 HydrophobicContact CD1-CG2 4.15Å; Y100-T185 HydrophobicContact CG-CG2 4.44Å; Y100-T185 PolarHBondContact O-OG1 3.27Å; Y100-W209 AromaticContact CD2-CE2 3.94Å; Y100-W209 AromaticContact CD2-CZ2 3.79Å; Y100-W209 HydrophobicContact CD2-CZ2 3.79Å; Y100-W209 AromaticContact CD2-NE1 3.56Å; Y100-W209 AromaticContact CE2-NE1 3.87Å; Y100-W209 HydrophobicContact CG-CZ2 4.09Å; Y100-W209 AromaticContact CG-NE1 3.76Å; Y100-F212 WeakPolarHBondContact OH-CE1 3.48Å; Y100-N213 WeakPolarHBondContact CE2-OD1 3.26Å; Y100-L222 HydrophobicContact CD2-CD1 4.19Å; Y100-L222 HydrophobicContact CE2-CB 4.43Å; Y100-L222 HydrophobicContact CE2-CD1 3.56Å; Y100-V268 HydrophobicContact CD1-CG1 4.49Å; Y100-V268 HydrophobicContact CE1-CG1 3.51Å; Y100-V268 WeakPolarHBondContact OH-CG1 3.49Å; Y100-W269 HydrophobicContact CD1-CZ2 4.12Å; Y100-W269 HydrophobicContact CE1-CZ2 4.19Å
101	A	85.4	Confident	81.1	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.9	-42.6	175	0	0	0	0	0	112.1	S97 I98 A104 L105 L121 C181 L184 T185	S97-A101 PolarHBondContact O-N 2.96Å; I98-A101 PolarHBondContact O-N 3.26Å; A101-A104 PolarHBondContact O-N 3.38Å; A101-L105 WeakPolarHBondContact O-CG 3.34Å; A101-L105 PolarHBondContact O-N 3Å; A101-L121 HydrophobicContact CB-CD1 4.22Å; A101-C181 HydrophobicContact CB-CB 4.47Å; A101-L184 HydrophobicContact CB-CB 4.48Å; A101-L184 HydrophobicContact CB-CD1 4.08Å; A101-T185 PolarHBondContact N-OG1 3.01Å
102	F	82.9	Confident	80.4	Confident	21 Å²	21	46.1 Å²	46.1	9%	0.092	23%	0.232	C	C	.	.	H	α-helix	trans	-65.6	-47.3	177.3	-174.3	-81.9	0	0	0	112.3	I98 W99 Y100 A104 L105 D106 V113 L118 Y155	I98-F102 WeakPolarHBondContact O-CB 3.46Å; I98-F102 PolarHBondContact O-N 3.24Å; W99-F102 PolarHBondContact O-N 2.96Å; Y100-F102 PolarHBondContact O-N 3.24Å; F102-A104 PolarHBondContact O-N 3.19Å; F102-L105 WeakPolarHBondContact O-CA 3.4Å; F102-L105 PolarHBondContact O-N 3.33Å; F102-D106 PolarHBondContact O-N 3.22Å; F102-V113 HydrophobicContact CD1-CG2 4.42Å; F102-V113 HydrophobicContact CD2-CG2 4.32Å; F102-V113 HydrophobicContact CE1-CG2 3.93Å; F102-V113 HydrophobicContact CE2-CB 4.37Å; F102-V113 HydrophobicContact CE2-CG2 3.83Å; F102-V113 HydrophobicContact CZ-CB 4.4Å; F102-V113 HydrophobicContact CZ-CG2 3.6Å; F102-L118 HydrophobicContact CD2-CD2 3.85Å; F102-L118 HydrophobicContact CE2-CD2 3.75Å; F102-Y155 AromaticContact CD2-CD1 3.78Å; F102-Y155 HydrophobicContact CD2-CD1 3.78Å; F102-Y155 HydrophobicContact CD2-CE1 4.25Å; F102-Y155 AromaticContact CE2-CD1 3.85Å; F102-Y155 HydrophobicContact CE2-CD1 3.85Å; F102-Y155 HydrophobicContact CE2-CG 4.35Å
103	T	82.1	Confident	80	Confident	47 Å²	47	40.7 Å²	40.7	29%	0.288	21%	0.209	S	C	.	.	H	α-helix	trans	-69.3	-21.2	179.2	50.9	0	0	0	0	113.1	W99 Y100	W99-T103 HydrophobicContact CD2-CG2 4.12Å; W99-T103 HydrophobicContact CG-CG2 4.45Å; W99-T103 HydrophobicContact CZ2-CG2 3.89Å; W99-T103 WeakPolarHBondContact O-CB 3.48Å; W99-T103 WeakPolarHBondContact O-CG2 3.36Å; W99-T103 PolarHBondContact O-N 3.14Å; W99-T103 PolarHBondContact O-OG1 2.98Å; Y100-T103 PolarHBondContact O-N 3.4Å; Y100-T103 PolarHBondContact O-OG1 3.05Å
104	A	83.1	Confident	79.6	Confident	3 Å²	3	40.1 Å²	40.1	3%	0.025	21%	0.21	C	C	.	.	H	α-helix	trans	-73.8	-27.7	166.8	0	0	0	0	0	112.8	Y100 A101 F102 T185 K188	Y100-A104 WeakPolarHBondContact O-CB 3.41Å; Y100-A104 PolarHBondContact O-N 3.13Å; A101-A104 PolarHBondContact O-N 3.38Å; F102-A104 PolarHBondContact O-N 3.19Å; A104-T185 HydrophobicContact CB-CG2 4.17Å; A104-K188 WeakPolarHBondContact O-CD 3.47Å; A104-K188 WeakPolarHBondContact O-CE 3.27Å; A104-K188 PolarHBondContact O-NZ 3.34Å
105	L	81.9	Confident	79	Confident	25 Å²	25	41.7 Å²	41.7	13%	0.131	22%	0.217	C	C	.	.	H	α-helix	trans	-80.9	-31	175.7	-64.7	171.6	0	0	0	112.6	A101 F102 V107 V113 Q117 L121	A101-L105 WeakPolarHBondContact O-CG 3.34Å; A101-L105 PolarHBondContact O-N 3Å; F102-L105 WeakPolarHBondContact O-CA 3.4Å; F102-L105 PolarHBondContact O-N 3.33Å; L105-V107 VanDerWaalsContact C-N 3.28Å; L105-V107 PolarHBondContact O-N 3.28Å; L105-V113 HydrophobicContact CB-CG1 3.62Å; L105-V113 HydrophobicContact CB-CG2 4.06Å; L105-V113 HydrophobicContact CD1-CG1 4.32Å; L105-Q117 HydrophobicContact CD1-CB 4.31Å; L105-Q117 HydrophobicContact CD2-CB 4.22Å; L105-Q117 HydrophobicContact CD2-CG 4.35Å; L105-L121 HydrophobicContact CD1-CB 4.34Å; L105-L121 HydrophobicContact CD1-CD2 3.99Å
106	D	79.2	Confident	78.6	Confident	19 Å²	19	44.6 Å²	44.6	10%	0.102	24%	0.239	C	C	.	.			trans	-71.8	74.3	172.3	-175.7	6.3	0	0	0	112.1	F102 E108 K109 S110 G111 V113	F102-D106 PolarHBondContact O-N 3.22Å; D106-E108 VanDerWaalsContact C-N 3.26Å; D106-E108 PolarHBondContact O-N 3.01Å; D106-K109 PolarHBondContact O-N 3.11Å; D106-K109 VanDerWaalsContact OD1-CA 3.26Å; D106-K109 WeakPolarHBondContact OD1-CA 3.35Å; D106-K109 PolarHBondContact OD1-N 3.03Å; D106-K109 WeakPolarHBondContact OD2-CA 3.34Å; D106-S110 PolarHBondContact OD1-N 3.01Å; D106-S110 PolarHBondContact OD2-N 2.99Å; D106-G111 VanDerWaalsContact OD2-CA 3.22Å; D106-G111 WeakPolarHBondContact OD2-CA 3.43Å; D106-G111 PolarHBondContact OD2-N 3.02Å; D106-V113 HydrophobicContact CB-CG2 4.04Å
107	V	70.4	Confident	78.2	Confident	109 Å²	109	47.7 Å²	47.7	66%	0.661	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-32.9	-176.4	173.4	0	0	0	0	112.8	L105	L105-V107 VanDerWaalsContact C-N 3.28Å; L105-V107 PolarHBondContact O-N 3.28Å
108	E	67.4	Low	77.9	Confident	158 Å²	158	47.6 Å²	47.6	74%	0.738	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-12.3	-178.4	-63.8	178.9	164.3	0	0	113	D106 S110	D106-E108 VanDerWaalsContact C-N 3.26Å; D106-E108 PolarHBondContact O-N 3.01Å; E108-S110 PolarHBondContact O-N 3.26Å; E108-S110 PolarHBondContact OE2-OG 3.15Å
109	K	68.9	Low	77.6	Confident	147 Å²	147	50.7 Å²	50.7	64%	0.639	27%	0.267	S	S	*	.	S	Bend	trans	55.4	30.7	-163.6	-51.6	176.5	-176.2	175.7	0	111.6	L63 D106 G111	L63-K109 HydrophobicContact CD1-CB 4.3Å; L63-K109 HydrophobicContact CD1-CD 4.31Å; L63-K109 HydrophobicContact CD2-CB 4.43Å; L63-K109 WeakPolarHBondContact CD2-O 3.45Å; D106-K109 PolarHBondContact O-N 3.11Å; D106-K109 VanDerWaalsContact OD1-CA 3.26Å; D106-K109 WeakPolarHBondContact OD1-CA 3.35Å; D106-K109 PolarHBondContact OD1-N 3.03Å; D106-K109 WeakPolarHBondContact OD2-CA 3.34Å; K109-G111 VanDerWaalsContact C-N 3.3Å
110	S	65.5	Low	77.5	Confident	56 Å²	56	52.3 Å²	52.3	39%	0.392	28%	0.282	S	S	.	.	S	Bend	trans	-87.7	-0.9	-177.1	66	0	0	0	0	112.7	D106 E108 K112	D106-S110 PolarHBondContact OD1-N 3.01Å; D106-S110 PolarHBondContact OD2-N 2.99Å; E108-S110 PolarHBondContact O-N 3.26Å; E108-S110 PolarHBondContact OE2-OG 3.15Å; S110-K112 VanDerWaalsContact C-N 3.28Å
111	G	65.6	Low	77.5	Confident	23 Å²	23	52.2 Å²	52.2	24%	0.237	28%	0.282	C	S	.	.	S	Bend	trans	75.9	15.8	-175	0	0	0	0	0	113.1	D106 K109 S151 S152	D106-G111 VanDerWaalsContact OD2-CA 3.22Å; D106-G111 WeakPolarHBondContact OD2-CA 3.43Å; D106-G111 PolarHBondContact OD2-N 3.02Å; K109-G111 VanDerWaalsContact C-N 3.3Å; G111-S151 CarbonylContact O-C 3.46Å; G111-S151 WeakPolarHBondContact O-CA 3.38Å; G111-S152 PolarHBondContact O-N 3.32Å
112	K	69.9	Low	77.5	Confident	104 Å²	104	52.2 Å²	52.2	45%	0.452	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	144.2	-173.6	-53.6	-175.3	-172	178.6	0	111.2	S110 P149 V150	S110-K112 VanDerWaalsContact C-N 3.28Å; K112-P149 HydrophobicContact CB-CB 4.17Å; K112-P149 HydrophobicContact CB-CG 4.3Å; K112-P149 HydrophobicContact CD-CG 4.08Å; K112-V150 WeakPolarHBondContact CA-O 3.43Å
113	V	76.2	Confident	77.6	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.024	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	148.8	178.8	-178.6	0	0	0	0	109	F102 L105 D106 Q117 L118 P149 V150	F102-V113 HydrophobicContact CD1-CG2 4.42Å; F102-V113 HydrophobicContact CD2-CG2 4.32Å; F102-V113 HydrophobicContact CE1-CG2 3.93Å; F102-V113 HydrophobicContact CE2-CB 4.37Å; F102-V113 HydrophobicContact CE2-CG2 3.83Å; F102-V113 HydrophobicContact CZ-CB 4.4Å; F102-V113 HydrophobicContact CZ-CG2 3.6Å; L105-V113 HydrophobicContact CB-CG1 3.62Å; L105-V113 HydrophobicContact CB-CG2 4.06Å; L105-V113 HydrophobicContact CD1-CG1 4.32Å; D106-V113 HydrophobicContact CB-CG2 4.04Å; V113-Q117 HydrophobicContact CG1-CB 3.87Å; V113-L118 HydrophobicContact CB-CD1 4.14Å; V113-L118 HydrophobicContact CB-CD2 3.94Å; V113-L118 HydrophobicContact CB-CG 3.94Å; V113-L118 HydrophobicContact CG1-CD1 4.48Å; V113-L118 HydrophobicContact CG1-CD2 3.77Å; V113-L118 HydrophobicContact CG1-CG 3.76Å; V113-P149 CarbonylContact O-C 3.58Å; V113-V150 PolarHBondContact N-O 3.22Å; V113-V150 PolarHBondContact O-N 3.07Å
114	S	78.3	Confident	77.8	Confident	38 Å²	38	55.5 Å²	55.5	27%	0.266	30%	0.296	S	S	.	.			trans	-65.8	142.9	179.1	76.4	0	0	0	0	111.7	S116 Q117 L118	S114-S116 PolarHBondContact O-N 3.24Å; S114-S116 PolarHBondContact OG-OG 3.16Å; S114-Q117 PolarHBondContact O-N 3.12Å; S114-Q117 VanDerWaalsContact O-N 3.08Å; S114-Q117 VanDerWaalsContact OG-CG 3.3Å; S114-Q117 WeakPolarHBondContact OG-CG 3.49Å; S114-Q117 PolarHBondContact OG-N 3.25Å; S114-L118 PolarHBondContact O-N 3.1Å; S114-L118 VanDerWaalsContact O-N 3.1Å
115	K	75.4	Confident	78	Confident	33 Å²	33	55.3 Å²	55.3	14%	0.143	29%	0.294	C	S	.	.	H	α-helix	trans	-50	-42.9	174.4	-74.3	-179.2	171.7	-179.8	0	111.7	Q117 L118 K119 F142 R143 D146 V150	K115-Q117 PolarHBondContact O-N 3.04Å; K115-L118 PolarHBondContact O-N 3.04Å; K115-K119 WeakPolarHBondContact O-CB 3.38Å; K115-K119 PolarHBondContact O-N 3.29Å; K115-F142 HydrophobicContact CB-CD1 4.37Å; K115-R143 PolarHBondContact NZ-O 3.4Å; K115-D146 WeakPolarHBondContact CE-O 3.48Å; K115-D146 PolarHBondContact NZ-O 3.1Å; K115-V150 HydrophobicContact CD-CG2 4.49Å; K115-V150 HydrophobicContact CG-CG2 3.67Å
116	S	78.2	Confident	78.2	Confident	78 Å²	78	54.7 Å²	54.7	55%	0.545	29%	0.29	S	S	.	.	H	α-helix	trans	-59.5	-43.5	178	51.5	0	0	0	0	113.9	S114 V120	S114-S116 PolarHBondContact O-N 3.24Å; S114-S116 PolarHBondContact OG-OG 3.16Å; S116-V120 WeakPolarHBondContact O-CG2 3.42Å; S116-V120 PolarHBondContact O-N 3.15Å; S116-V120 VanDerWaalsContact O-N 3.15Å
117	Q	81.5	Confident	78.6	Confident	75 Å²	75	57.1 Å²	57.1	35%	0.35	31%	0.306	S	S	.	.	H	α-helix	trans	-70.2	-38.2	177.7	-73	173.2	11.2	0	0	111.7	L105 V113 S114 K115 V120 L121	L105-Q117 HydrophobicContact CD1-CB 4.31Å; L105-Q117 HydrophobicContact CD2-CB 4.22Å; L105-Q117 HydrophobicContact CD2-CG 4.35Å; V113-Q117 HydrophobicContact CG1-CB 3.87Å; S114-Q117 PolarHBondContact O-N 3.12Å; S114-Q117 VanDerWaalsContact O-N 3.08Å; S114-Q117 VanDerWaalsContact OG-CG 3.3Å; S114-Q117 WeakPolarHBondContact OG-CG 3.49Å; S114-Q117 PolarHBondContact OG-N 3.25Å; K115-Q117 PolarHBondContact O-N 3.04Å; Q117-V120 PolarHBondContact O-N 3.32Å; Q117-L121 WeakPolarHBondContact O-CB 3.48Å; Q117-L121 PolarHBondContact O-N 3.46Å
118	L	82.3	Confident	79.4	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-70.1	-35.1	176.1	-64.4	177.7	0	0	0	112.9	F102 V113 S114 K115 S122 F142 V150 Y155	F102-L118 HydrophobicContact CD2-CD2 3.85Å; F102-L118 HydrophobicContact CE2-CD2 3.75Å; V113-L118 HydrophobicContact CB-CD1 4.14Å; V113-L118 HydrophobicContact CB-CD2 3.94Å; V113-L118 HydrophobicContact CB-CG 3.94Å; V113-L118 HydrophobicContact CG1-CD1 4.48Å; V113-L118 HydrophobicContact CG1-CD2 3.77Å; V113-L118 HydrophobicContact CG1-CG 3.76Å; S114-L118 PolarHBondContact O-N 3.1Å; S114-L118 VanDerWaalsContact O-N 3.1Å; K115-L118 PolarHBondContact O-N 3.04Å; L118-S122 VanDerWaalsContact O-CB 3.26Å; L118-S122 WeakPolarHBondContact O-CB 3.38Å; L118-S122 PolarHBondContact O-N 2.83Å; L118-S122 PolarHBondContact O-OG 3.02Å; L118-F142 HydrophobicContact CB-CE1 3.83Å; L118-F142 HydrophobicContact CB-CZ 4.1Å; L118-V150 HydrophobicContact CD1-CB 3.87Å; L118-V150 HydrophobicContact CD1-CG1 3.9Å; L118-Y155 HydrophobicContact CB-CD2 4.19Å; L118-Y155 HydrophobicContact CB-CE2 4.14Å; L118-Y155 HydrophobicContact CD1-CD2 3.99Å; L118-Y155 HydrophobicContact CD1-CG 4Å; L118-Y155 HydrophobicContact CD2-CD1 3.98Å; L118-Y155 HydrophobicContact CD2-CD2 4.21Å; L118-Y155 HydrophobicContact CD2-CE1 4.07Å; L118-Y155 HydrophobicContact CD2-CE2 4.31Å; L118-Y155 HydrophobicContact CD2-CG 4.04Å; L118-Y155 HydrophobicContact CG-CD2 4.36Å
119	K	81.9	Confident	80.3	Confident	67 Å²	67	46.1 Å²	46.1	29%	0.291	25%	0.25	S	C	.	.	H	α-helix	trans	-61.7	-47.3	172.2	-177.6	-177.7	174.4	-175.8	0	111	K115 S122 H123 L138 E139 F142	K115-K119 WeakPolarHBondContact O-CB 3.38Å; K115-K119 PolarHBondContact O-N 3.29Å; K119-S122 PolarHBondContact O-N 3.5Å; K119-H123 WeakPolarHBondContact O-CB 3.23Å; K119-H123 PolarHBondContact O-N 3.48Å; K119-L138 HydrophobicContact CG-CG 4.41Å; K119-E139 IonicContact NZ-OE1 2.84Å; K119-E139 PolarHBondContact NZ-OE1 3.09Å; K119-F142 HydrophobicContact CB-CD2 4.17Å; K119-F142 HydrophobicContact CB-CG 4.22Å; K119-F142 HydrophobicContact CG-CD2 4.37Å
120	V	84.9	Confident	81	Confident	86 Å²	86	45.4 Å²	45.4	52%	0.521	25%	0.248	S	C	.	.	H	α-helix	trans	-64.3	-45	176.9	172	0	0	0	0	111.8	S116 Q117 S122 H123 N124	S116-V120 WeakPolarHBondContact O-CG2 3.42Å; S116-V120 PolarHBondContact O-N 3.15Å; S116-V120 VanDerWaalsContact O-N 3.15Å; Q117-V120 PolarHBondContact O-N 3.32Å; V120-S122 VanDerWaalsContact C-N 3.33Å; V120-S122 PolarHBondContact O-N 3.19Å; V120-H123 PolarHBondContact O-N 3.03Å; V120-N124 PolarHBondContact O-N 3.06Å; V120-N124 PolarHBondContact O-OD1 3.12Å
121	L	86.3	Confident	81.9	Confident	4 Å²	4	43.2 Å²	43.2	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-58.5	-46.6	174.4	177.3	60.9	0	0	0	111	A101 L105 Q117 N124 L125 Y155 L184	A101-L121 HydrophobicContact CB-CD1 4.22Å; L105-L121 HydrophobicContact CD1-CB 4.34Å; L105-L121 HydrophobicContact CD1-CD2 3.99Å; Q117-L121 WeakPolarHBondContact O-CB 3.48Å; Q117-L121 PolarHBondContact O-N 3.46Å; L121-N124 PolarHBondContact O-N 3.26Å; L121-L125 HydrophobicContact CD1-CD1 4.15Å; L121-L125 HydrophobicContact CD1-CG 4.19Å; L121-L125 HydrophobicContact CG-CD1 3.97Å; L121-L125 HydrophobicContact CG-CG 4.44Å; L121-L125 WeakPolarHBondContact O-CB 3.24Å; L121-L125 VanDerWaalsContact O-CG 3.27Å; L121-L125 WeakPolarHBondContact O-CG 3.38Å; L121-L125 PolarHBondContact O-N 3.11Å; L121-Y155 HydrophobicContact CD2-CE1 4.42Å; L121-L184 HydrophobicContact CD1-CD1 3.75Å
122	S	85.3	Confident	82.3	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.5	-47.1	-179.7	-56.8	0	0	0	0	111.9	L118 K119 V120 N124 L125 Y126 Y155	L118-S122 VanDerWaalsContact O-CB 3.26Å; L118-S122 WeakPolarHBondContact O-CB 3.38Å; L118-S122 PolarHBondContact O-N 2.83Å; L118-S122 PolarHBondContact O-OG 3.02Å; K119-S122 PolarHBondContact O-N 3.5Å; V120-S122 VanDerWaalsContact C-N 3.33Å; V120-S122 PolarHBondContact O-N 3.19Å; S122-N124 PolarHBondContact O-N 3.02Å; S122-L125 WeakPolarHBondContact O-CB 3.46Å; S122-L125 PolarHBondContact O-N 2.99Å; S122-Y126 WeakPolarHBondContact O-CD2 3.5Å; S122-Y126 PolarHBondContact O-N 3.46Å; S122-Y155 WeakPolarHBondContact OG-CE2 3.46Å; S122-Y155 PolarHBondContact OG-OH 3.17Å
123	H	85.5	Confident	82.3	Confident	84 Å²	84	45.3 Å²	45.3	39%	0.389	25%	0.247	S	C	.	.	H	α-helix	trans	-54.8	-50.1	175	177.3	-88.4	0	0	0	111.5	K119 V120 L125 Y126 T127 H133 L138	K119-H123 WeakPolarHBondContact O-CB 3.23Å; K119-H123 PolarHBondContact O-N 3.48Å; V120-H123 PolarHBondContact O-N 3.03Å; H123-L125 VanDerWaalsContact C-N 3.31Å; H123-L125 PolarHBondContact O-N 3.09Å; H123-Y126 PolarHBondContact O-N 3.18Å; H123-T127 PolarHBondContact O-N 3.18Å; H123-T127 PolarHBondContact O-OG1 3.28Å; H123-H133 AromaticContact CD2-CE1 3.97Å; H123-H133 AromaticContact CD2-NE2 3.53Å; H123-L138 HydrophobicContact CB-CD2 3.99Å
124	N	87.1	Confident	82.1	Confident	52 Å²	52	49.3 Å²	49.3	28%	0.278	27%	0.269	S	S	.	.	H	α-helix	trans	-65	-35.2	-179.7	-64	-7.8	0	0	0	112.1	V120 L121 S122 T127 V128 L180	V120-N124 PolarHBondContact O-N 3.06Å; V120-N124 PolarHBondContact O-OD1 3.12Å; L121-N124 PolarHBondContact O-N 3.26Å; S122-N124 PolarHBondContact O-N 3.02Å; N124-T127 PolarHBondContact O-N 3.24Å; N124-V128 WeakPolarHBondContact O-CG2 3.18Å; N124-V128 PolarHBondContact O-N 2.71Å; N124-L180 HydrophobicContact CB-CD1 4.06Å; N124-L180 HydrophobicContact CB-CD2 3.79Å
125	L	87.2	Confident	81.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.8	-46	172	-73	172.5	0	0	0	111.8	I98 L121 S122 H123 T127 V128 L129 L159 I163 F177 L180	I98-L125 HydrophobicContact CD1-CD1 4.45Å; I98-L125 HydrophobicContact CD1-CD2 4.36Å; I98-L125 HydrophobicContact CG1-CD1 4.32Å; I98-L125 HydrophobicContact CG1-CD2 4.08Å; L121-L125 HydrophobicContact CD1-CD1 4.15Å; L121-L125 HydrophobicContact CD1-CG 4.19Å; L121-L125 HydrophobicContact CG-CD1 3.97Å; L121-L125 HydrophobicContact CG-CG 4.44Å; L121-L125 WeakPolarHBondContact O-CB 3.24Å; L121-L125 VanDerWaalsContact O-CG 3.27Å; L121-L125 WeakPolarHBondContact O-CG 3.38Å; L121-L125 PolarHBondContact O-N 3.11Å; S122-L125 WeakPolarHBondContact O-CB 3.46Å; S122-L125 PolarHBondContact O-N 2.99Å; H123-L125 VanDerWaalsContact C-N 3.31Å; H123-L125 PolarHBondContact O-N 3.09Å; L125-T127 VanDerWaalsContact C-N 3.32Å; L125-T127 PolarHBondContact O-N 3.36Å; L125-V128 PolarHBondContact O-N 3.04Å; L125-L129 HydrophobicContact CB-CD1 4.33Å; L125-L129 HydrophobicContact CD2-CD1 4.44Å; L125-L129 WeakPolarHBondContact O-CB 3.19Å; L125-L129 WeakPolarHBondContact O-CD1 3.1Å; L125-L129 VanDerWaalsContact O-CG 3.23Å; L125-L129 WeakPolarHBondContact O-CG 3.44Å; L125-L129 PolarHBondContact O-N 2.69Å; L125-L159 HydrophobicContact CD1-CD1 4.17Å; L125-I163 HydrophobicContact CB-CD1 4.14Å; L125-I163 HydrophobicContact CD1-CD1 4.2Å; L125-F177 HydrophobicContact CD2-CD2 4.02Å; L125-F177 HydrophobicContact CD2-CE2 3.65Å; L125-L180 HydrophobicContact CD2-CD2 4.4Å
126	Y	85.6	Confident	81.1	Confident	11 Å²	11	54.1 Å²	54.1	4%	0.043	30%	0.3	C	S	.	.	H	α-helix	trans	-58.2	-44.3	173.8	-71.7	-70.5	0	0	0	111.6	S122 H123 H130 I131 H133 L138 Y158 Y162 I163	S122-Y126 WeakPolarHBondContact O-CD2 3.5Å; S122-Y126 PolarHBondContact O-N 3.46Å; H123-Y126 PolarHBondContact O-N 3.18Å; Y126-H130 PolarHBondContact O-N 3.48Å; Y126-I131 HydrophobicContact CD1-CB 3.84Å; Y126-I131 HydrophobicContact CD1-CD1 4.35Å; Y126-I131 HydrophobicContact CD1-CG2 3.69Å; Y126-I131 HydrophobicContact CE1-CG2 4.03Å; Y126-I131 PolarHBondContact O-N 3.47Å; Y126-H133 WeakPolarHBondContact CB-ND1 3.42Å; Y126-H133 HydrophobicContact CD1-CB 3.59Å; Y126-H133 HydrophobicContact CD2-CB 4.17Å; Y126-H133 AromaticContact CD2-CD2 3.85Å; Y126-H133 AromaticContact CD2-CG 3.9Å; Y126-H133 HydrophobicContact CE1-CB 3.95Å; Y126-H133 HydrophobicContact CE2-CB 4.5Å; Y126-H133 HydrophobicContact CG-CB 3.75Å; Y126-H133 AromaticContact CG-CG 3.63Å; Y126-H133 AromaticContact CG-ND1 3.83Å; Y126-L138 HydrophobicContact CE2-CD1 4.21Å; Y126-Y158 WeakPolarHBondContact CE2-OH 3.41Å; Y126-Y158 PolarHBondContact OH-OH 3.34Å; Y126-Y162 VanDerWaalsContact OH-CB 3.32Å; Y126-Y162 WeakPolarHBondContact OH-CB 3.45Å; Y126-I163 HydrophobicContact CD1-CG1 4.3Å; Y126-I163 HydrophobicContact CE1-CG1 3.72Å; Y126-I163 HydrophobicContact CE2-CD1 4.12Å; Y126-I163 HydrophobicContact CE2-CG1 4.08Å
127	T	86.6	Confident	80.5	Confident	70 Å²	70	52.3 Å²	52.3	43%	0.429	29%	0.29	S	S	.	.	H	α-helix	trans	-61	-50.9	179.7	-52.8	0	0	0	0	112.3	H123 N124 L125 H130	H123-T127 PolarHBondContact O-N 3.18Å; H123-T127 PolarHBondContact O-OG1 3.28Å; N124-T127 PolarHBondContact O-N 3.24Å; L125-T127 VanDerWaalsContact C-N 3.32Å; L125-T127 PolarHBondContact O-N 3.36Å; T127-H130 PolarHBondContact O-N 3.12Å; T127-H130 PolarHBondContact O-ND1 3.3Å
128	V	87.1	Confident	79.9	Confident	35 Å²	35	49.1 Å²	49.1	21%	0.212	28%	0.275	C	S	.	.	H	α-helix	trans	-79.9	-26.5	-173.6	-179.6	0	0	0	0	112.7	N124 L125 H130 F172 H176 F177 L180	N124-V128 WeakPolarHBondContact O-CG2 3.18Å; N124-V128 PolarHBondContact O-N 2.71Å; L125-V128 PolarHBondContact O-N 3.04Å; V128-H130 VanDerWaalsContact C-N 3.26Å; V128-F172 WeakPolarHBondContact O-CB 3.47Å; V128-H176 HydrophobicContact CG1-CB 4.01Å; V128-F177 HydrophobicContact CG1-CB 3.93Å; V128-L180 HydrophobicContact CB-CD2 4.41Å; V128-L180 HydrophobicContact CG2-CD2 4.05Å
129	L	86.4	Confident	79.2	Confident	2 Å²	2	54 Å²	54	1%	0.01	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	1.4	171.8	-61.9	167.8	0	0	0	112.9	L94 L125 I131 I163 V167 F172 F177	L94-L129 HydrophobicContact CD1-CD2 4.43Å; L94-L129 HydrophobicContact CD2-CD2 4.42Å; L125-L129 HydrophobicContact CB-CD1 4.33Å; L125-L129 HydrophobicContact CD2-CD1 4.44Å; L125-L129 WeakPolarHBondContact O-CB 3.19Å; L125-L129 WeakPolarHBondContact O-CD1 3.1Å; L125-L129 VanDerWaalsContact O-CG 3.23Å; L125-L129 WeakPolarHBondContact O-CG 3.44Å; L125-L129 PolarHBondContact O-N 2.69Å; L129-I131 HydrophobicContact CB-CD1 3.79Å; L129-I131 HydrophobicContact CB-CG1 3.83Å; L129-I131 HydrophobicContact CD1-CD1 4.05Å; L129-I131 PolarHBondContact O-N 3.16Å; L129-I131 VanDerWaalsContact O-N 3.14Å; L129-I163 HydrophobicContact CD1-CG2 3.62Å; L129-V167 HydrophobicContact CD1-CG2 3.95Å; L129-V167 HydrophobicContact CD2-CG2 4.4Å; L129-F172 HydrophobicContact CD2-CD1 4.2Å; L129-F172 HydrophobicContact CD2-CD2 3.64Å; L129-F172 HydrophobicContact CD2-CE1 4.26Å; L129-F172 HydrophobicContact CD2-CE2 3.67Å; L129-F172 HydrophobicContact CD2-CG 3.92Å; L129-F172 HydrophobicContact CD2-CZ 4Å; L129-F177 HydrophobicContact CD1-CD2 4.48Å; L129-F177 HydrophobicContact CD1-CE2 4.48Å; L129-F177 HydrophobicContact CD2-CD2 3.69Å; L129-F177 HydrophobicContact CD2-CE2 4.2Å; L129-F177 HydrophobicContact CD2-CG 4.26Å; L129-F177 HydrophobicContact CG-CD2 4.14Å
130	H	84.2	Confident	78.3	Confident	131 Å²	131	55.8 Å²	55.8	61%	0.606	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	30.8	-176.3	-64.6	-44.2	0	0	0	114.8	Y126 T127 V128 A171	Y126-H130 PolarHBondContact O-N 3.48Å; T127-H130 PolarHBondContact O-N 3.12Å; T127-H130 PolarHBondContact O-ND1 3.3Å; V128-H130 VanDerWaalsContact C-N 3.26Å; H130-A171 PolarHBondContact CD2-O 2.99Å
131	I	84.3	Confident	77.4	Confident	10 Å²	10	55.7 Å²	55.7	5%	0.051	30%	0.301	C	S	.	.			trans	-79.9	125.2	178.9	-60.2	167.7	0	0	0	108.7	Y126 L129 H133 I163 K166 V167	Y126-I131 HydrophobicContact CD1-CB 3.84Å; Y126-I131 HydrophobicContact CD1-CD1 4.35Å; Y126-I131 HydrophobicContact CD1-CG2 3.69Å; Y126-I131 HydrophobicContact CE1-CG2 4.03Å; Y126-I131 PolarHBondContact O-N 3.47Å; L129-I131 HydrophobicContact CB-CD1 3.79Å; L129-I131 HydrophobicContact CB-CG1 3.83Å; L129-I131 HydrophobicContact CD1-CD1 4.05Å; L129-I131 PolarHBondContact O-N 3.16Å; L129-I131 VanDerWaalsContact O-N 3.14Å; I131-H133 PolarHBondContact O-N 3.08Å; I131-I163 HydrophobicContact CD1-CB 4.48Å; I131-I163 HydrophobicContact CD1-CG2 3.95Å; I131-K166 HydrophobicContact CD1-CB 4.45Å; I131-K166 HydrophobicContact CG2-CB 3.91Å; I131-K166 HydrophobicContact CG2-CD 3.9Å; I131-V167 HydrophobicContact CD1-CG2 3.94Å
132	P	74.5	Confident	76.6	Confident	115 Å²	115	56.5 Å²	56.5	75%	0.747	31%	0.305	S	S	*	.			trans	-64.9	121.3	173.8	26.7	-33.2	0	0	0	110.1
133	H	70.1	Confident	75.6	Confident	57 Å²	57	62.3 Å²	62.3	26%	0.264	33%	0.326	S	S	.	.			trans	-135.4	147.4	179.2	82.1	-73.6	0	0	0	110.9	H123 Y126 I131	H123-H133 AromaticContact CD2-CE1 3.97Å; H123-H133 AromaticContact CD2-NE2 3.53Å; Y126-H133 WeakPolarHBondContact CB-ND1 3.42Å; Y126-H133 HydrophobicContact CD1-CB 3.59Å; Y126-H133 HydrophobicContact CD2-CB 4.17Å; Y126-H133 AromaticContact CD2-CD2 3.85Å; Y126-H133 AromaticContact CD2-CG 3.9Å; Y126-H133 HydrophobicContact CE1-CB 3.95Å; Y126-H133 HydrophobicContact CE2-CB 4.5Å; Y126-H133 HydrophobicContact CG-CB 3.75Å; Y126-H133 AromaticContact CG-CG 3.63Å; Y126-H133 AromaticContact CG-ND1 3.83Å; I131-H133 PolarHBondContact O-N 3.08Å
134	D	70.7	Confident	74.2	Confident	88 Å²	88	64.8 Å²	64.8	47%	0.471	34%	0.343	S	S	.	.			trans	-94.3	124.3	172.1	173.9	4.2	0	0	0	108.2	V136 A137 L138	D134-V136 PolarHBondContact O-N 3.49Å; D134-V136 WeakPolarHBondContact OD1-CB 3.48Å; D134-V136 PolarHBondContact OD1-N 3.17Å; D134-A137 HydrophobicContact CB-CB 3.97Å; D134-A137 PolarHBondContact O-N 3.1Å; D134-L138 PolarHBondContact O-N 3.32Å
135	P	67.4	Low	72.9	Confident	80 Å²	80	69 Å²	69	52%	0.519	37%	0.365	S	S	.	.	H	α-helix	trans	-60.5	-32.1	175.9	25.5	-34.5	0	0	0	112.4	L138 E139	P135-L138 WeakPolarHBondContact O-CB 3.49Å; P135-L138 PolarHBondContact O-N 3.39Å; P135-E139 WeakPolarHBondContact O-CG 3.36Å; P135-E139 PolarHBondContact O-N 2.64Å
136	V	65.7	Low	71.3	Confident	92 Å²	92	75.1 Å²	75.1	56%	0.558	40%	0.398	S	S	*	.	H	α-helix	trans	-66.4	-43.2	178.2	-174.9	0	0	0	0	110.5	D134 L138 E139 E140	D134-V136 PolarHBondContact O-N 3.49Å; D134-V136 WeakPolarHBondContact OD1-CB 3.48Å; D134-V136 PolarHBondContact OD1-N 3.17Å; V136-L138 VanDerWaalsContact C-N 3.31Å; V136-L138 PolarHBondContact O-N 3.12Å; V136-E139 PolarHBondContact O-N 3.1Å; V136-E140 PolarHBondContact O-N 3.45Å
137	A	66.6	Low	69.7	Low	39 Å²	39	83.1 Å²	83.1	32%	0.322	44%	0.441	S	S	.	.	H	α-helix	trans	-65.9	-32.4	174.3	0	0	0	0	0	112.6	D134 H141	D134-A137 HydrophobicContact CB-CB 3.97Å; D134-A137 PolarHBondContact O-N 3.1Å; A137-H141 PolarHBondContact O-N 3.39Å; A137-H141 PolarHBondContact O-ND1 3.36Å
138	L	68.6	Low	68.4	Low	8 Å²	8	81.7 Å²	81.7	4%	0.042	44%	0.441	C	S	.	.	H	α-helix	trans	-66.9	-39.7	171.7	176.2	61.5	0	0	0	111.4	K119 H123 Y126 D134 P135 V136 H141 F142 Y158	K119-L138 HydrophobicContact CG-CG 4.41Å; H123-L138 HydrophobicContact CB-CD2 3.99Å; Y126-L138 HydrophobicContact CE2-CD1 4.21Å; D134-L138 PolarHBondContact O-N 3.32Å; P135-L138 WeakPolarHBondContact O-CB 3.49Å; P135-L138 PolarHBondContact O-N 3.39Å; V136-L138 VanDerWaalsContact C-N 3.31Å; V136-L138 PolarHBondContact O-N 3.12Å; L138-H141 PolarHBondContact O-N 3.39Å; L138-F142 HydrophobicContact CD1-CD2 3.83Å; L138-F142 HydrophobicContact CD1-CE2 3.78Å; L138-F142 WeakPolarHBondContact O-CD2 3.47Å; L138-Y158 VanDerWaalsContact CD1-OH 3.24Å; L138-Y158 WeakPolarHBondContact CD1-OH 3.31Å
139	E	67.3	Low	67	Low	104 Å²	104	83.7 Å²	83.7	49%	0.486	45%	0.454	S	S	.	.	H	α-helix	trans	-70.5	-37.9	177.3	-68.8	-166.4	143.1	0	0	112.7	K119 P135 V136 H141 F142 R143	K119-E139 IonicContact NZ-OE1 2.84Å; K119-E139 PolarHBondContact NZ-OE1 3.09Å; P135-E139 WeakPolarHBondContact O-CG 3.36Å; P135-E139 PolarHBondContact O-N 2.64Å; V136-E139 PolarHBondContact O-N 3.1Å; E139-H141 VanDerWaalsContact C-N 3.28Å; E139-H141 PolarHBondContact O-N 3.44Å; E139-F142 CarbonylContact O-C 3.6Å; E139-F142 PolarHBondContact O-N 3.27Å; E139-F142 VanDerWaalsContact O-N 3.09Å; E139-R143 PolarHBondContact O-N 3.28Å; E139-R143 VanDerWaalsContact O-N 3.12Å
140	E	63.4	Low	65.9	Low	104 Å²	104	85.2 Å²	85.2	49%	0.486	46%	0.463	S	S	.	.	H	α-helix	trans	-59.4	-36.1	173.9	-177.5	151.1	-107.4	0	0	112.9	V136 F142 R143	V136-E140 PolarHBondContact O-N 3.45Å; E140-F142 VanDerWaalsContact C-N 3.29Å; E140-F142 PolarHBondContact O-N 3.16Å; E140-R143 IonicContact OE1-CZ 3.14Å; E140-R143 IonicContact OE1-NH1 3.19Å; E140-R143 PolarHBondContact OE1-NH1 2.64Å; E140-R143 IonicContact OE1-NH2 3.75Å; E140-R143 PolarHBondContact OE1-NH2 3.11Å
141	H	66.3	Low	64.7	Low	83 Å²	83	81.1 Å²	81.1	38%	0.384	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-9.4	177	-76.7	81.1	0	0	0	114.8	A137 L138 E139 Y158 Y162	A137-H141 PolarHBondContact O-N 3.39Å; A137-H141 PolarHBondContact O-ND1 3.36Å; L138-H141 PolarHBondContact O-N 3.39Å; E139-H141 VanDerWaalsContact C-N 3.28Å; E139-H141 PolarHBondContact O-N 3.44Å; H141-Y158 HydrophobicContact CB-CD2 4.12Å; H141-Y158 HydrophobicContact CB-CE2 3.66Å; H141-Y158 AromaticContact CD2-CD2 3.83Å; H141-Y158 AromaticContact CD2-CE2 3.83Å; H141-Y158 AromaticContact CG-CE2 3.72Å; H141-Y162 AromaticContact CD2-CE2 3.65Å; H141-Y162 AromaticContact CD2-CZ 4Å; H141-Y162 AromaticContact CE1-CZ 3.9Å; H141-Y162 AromaticContact NE2-CE2 3.31Å; H141-Y162 VanDerWaalsContact NE2-CE2 3.31Å; H141-Y162 WeakPolarHBondContact NE2-CE2 3.43Å; H141-Y162 AromaticContact NE2-CZ 3.15Å; H141-Y162 PolarHBondContact NE2-OH 3.28Å
142	F	68.4	Low	63.3	Low	22 Å²	22	81.6 Å²	81.6	10%	0.096	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.9	23.1	-179.1	-74.7	-75.3	0	0	0	112.8	K115 L118 K119 L138 E139 E140 Y155 Y158	K115-F142 HydrophobicContact CB-CD1 4.37Å; L118-F142 HydrophobicContact CB-CE1 3.83Å; L118-F142 HydrophobicContact CB-CZ 4.1Å; K119-F142 HydrophobicContact CB-CD2 4.17Å; K119-F142 HydrophobicContact CB-CG 4.22Å; K119-F142 HydrophobicContact CG-CD2 4.37Å; L138-F142 HydrophobicContact CD1-CD2 3.83Å; L138-F142 HydrophobicContact CD1-CE2 3.78Å; L138-F142 WeakPolarHBondContact O-CD2 3.47Å; E139-F142 CarbonylContact O-C 3.6Å; E139-F142 PolarHBondContact O-N 3.27Å; E139-F142 VanDerWaalsContact O-N 3.09Å; E140-F142 VanDerWaalsContact C-N 3.29Å; E140-F142 PolarHBondContact O-N 3.16Å; F142-Y155 HydrophobicContact CZ-CD2 4.25Å; F142-Y155 HydrophobicContact CZ-CE2 4.08Å; F142-Y158 HydrophobicContact CE2-CE1 4.14Å; F142-Y158 HydrophobicContact CE2-CE2 4.41Å; F142-Y158 HydrophobicContact CZ-CD1 4.49Å; F142-Y158 HydrophobicContact CZ-CE1 4.4Å
143	R	63.9	Low	62.6	Low	121 Å²	121	83.7 Å²	83.7	46%	0.457	45%	0.454	S	S	.	.			trans	-56	154.2	176.1	-74.2	-173	-179.9	131.3	12.3	112.5	K115 E139 E140 D145	K115-R143 PolarHBondContact NZ-O 3.4Å; E139-R143 PolarHBondContact O-N 3.28Å; E139-R143 VanDerWaalsContact O-N 3.12Å; E140-R143 IonicContact OE1-CZ 3.14Å; E140-R143 IonicContact OE1-NH1 3.19Å; E140-R143 PolarHBondContact OE1-NH1 2.64Å; E140-R143 IonicContact OE1-NH2 3.75Å; E140-R143 PolarHBondContact OE1-NH2 3.11Å; R143-D145 VanDerWaalsContact CB-OD2 3.25Å; R143-D145 WeakPolarHBondContact CB-OD2 3.49Å; R143-D145 WeakPolarHBondContact CD-OD2 3.49Å; R143-D145 PolarHBondContact O-N 3.32Å
144	D	57.5	Low	62.4	Low	137 Å²	137	83 Å²	83	73%	0.733	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	0.9	-174.8	-61.8	-54.2	0	0	0	113.7	D146	D144-D146 PolarHBondContact O-N 3.05Å
145	D	58.2	Low	62.6	Low	139 Å²	139	79 Å²	79	74%	0.743	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-4.3	-178.3	-52.6	-53.4	0	0	0	115.6	R143	R143-D145 VanDerWaalsContact CB-OD2 3.25Å; R143-D145 WeakPolarHBondContact CB-OD2 3.49Å; R143-D145 WeakPolarHBondContact CD-OD2 3.49Å; R143-D145 PolarHBondContact O-N 3.32Å
146	D	55.4	Low	63	Low	129 Å²	129	76.8 Å²	76.8	69%	0.69	42%	0.423	S	S	*	.	S	Bend	trans	-125.4	108.8	173.9	-96	-46	0	0	0	108.8	K115 D144 G148	K115-D146 WeakPolarHBondContact CE-O 3.48Å; K115-D146 PolarHBondContact NZ-O 3.1Å; D144-D146 PolarHBondContact O-N 3.05Å; D146-G148 PolarHBondContact O-N 3.21Å
147	D	51.9	Low	63.6	Low	180 Å²	180	76.2 Å²	76.2	96%	0.963	42%	0.422	S	S	*	.			trans	-80.7	83.9	-173	-128.8	-31	0	0	0	111.8
148	G	57.6	Low	64.2	Low	40 Å²	40	75.4 Å²	75.4	41%	0.412	41%	0.41	S	S	.	.	S	Bend	trans	174.3	161.9	174	0	0	0	0	0	117.1	D146 V150	D146-G148 PolarHBondContact O-N 3.21Å; G148-V150 PolarHBondContact O-N 2.61Å
149	P	57.6	Low	64.9	Low	77 Å²	77	75.1 Å²	75.1	50%	0.5	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-70.1	128.7	172.1	29.7	-33.4	0	0	0	110.3	K112 V113 S151	K112-P149 HydrophobicContact CB-CB 4.17Å; K112-P149 HydrophobicContact CB-CG 4.3Å; K112-P149 HydrophobicContact CD-CG 4.08Å; V113-P149 CarbonylContact O-C 3.58Å; P149-S151 PolarHBondContact O-N 2.89Å
150	V	63.3	Low	65.6	Low	33 Å²	33	73 Å²	73	20%	0.2	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	128.4	-174.7	166.8	0	0	0	0	109.8	K112 V113 K115 L118 G148	K112-V150 WeakPolarHBondContact CA-O 3.43Å; V113-V150 PolarHBondContact N-O 3.22Å; V113-V150 PolarHBondContact O-N 3.07Å; K115-V150 HydrophobicContact CD-CG2 4.49Å; K115-V150 HydrophobicContact CG-CG2 3.67Å; L118-V150 HydrophobicContact CD1-CB 3.87Å; L118-V150 HydrophobicContact CD1-CG1 3.9Å; G148-V150 PolarHBondContact O-N 2.61Å
151	S	60.4	Low	66.5	Low	46 Å²	46	73.8 Å²	73.8	32%	0.322	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	155.7	174.3	69.2	0	0	0	0	111.3	G111 P149 Q153 G154 Y155	G111-S151 CarbonylContact O-C 3.46Å; G111-S151 WeakPolarHBondContact O-CA 3.38Å; P149-S151 PolarHBondContact O-N 2.89Å; S151-Q153 PolarHBondContact O-N 3.08Å; S151-Q153 VanDerWaalsContact O-N 3.08Å; S151-G154 PolarHBondContact O-N 3.43Å; S151-G154 PolarHBondContact OG-N 3.37Å; S151-Y155 PolarHBondContact O-N 3.38Å
152	S	54.2	Low	67.1	Low	20 Å²	20	72.4 Å²	72.4	14%	0.14	39%	0.394	C	S	.	.	H	α-helix	trans	-55.1	-26.1	173.1	66.7	0	0	0	0	112.9	F69 G111 M156	F69-S152 WeakPolarHBondContact CE2-OG 3.5Å; G111-S152 PolarHBondContact O-N 3.32Å; S152-M156 WeakPolarHBondContact O-CB 3.39Å; S152-M156 WeakPolarHBondContact O-CG 3.48Å; S152-M156 PolarHBondContact O-N 3.2Å
153	Q	59.3	Low	67.8	Low	158 Å²	158	71.3 Å²	71.3	74%	0.738	39%	0.39	S	S	*	.	H	α-helix	trans	-71.5	-27.4	174	-167.7	173.8	5.3	0	0	113.7	S151 P157	S151-Q153 PolarHBondContact O-N 3.08Å; S151-Q153 VanDerWaalsContact O-N 3.08Å; Q153-P157 WeakPolarHBondContact O-CD 3.47Å; Q153-P157 WeakPolarHBondContact O-CG 3.4Å
154	G	66.5	Low	68.8	Low	42 Å²	42	65.6 Å²	65.6	43%	0.433	37%	0.368	S	S	.	.	H	α-helix	trans	-86.8	-35.7	175.9	0	0	0	0	0	113.9	S151 P157	S151-G154 PolarHBondContact O-N 3.43Å; S151-G154 PolarHBondContact OG-N 3.37Å; G154-P157 WeakPolarHBondContact O-CD 3.39Å
155	Y	75.4	Confident	70	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.016	36%	0.355	C	S	.	.	H	α-helix	trans	-74.1	-33.8	178.7	-173.5	-119.4	0	0	0	113.3	F102 L118 L121 S122 F142 S151 Y158 L159	F102-Y155 AromaticContact CD2-CD1 3.78Å; F102-Y155 HydrophobicContact CD2-CD1 3.78Å; F102-Y155 HydrophobicContact CD2-CE1 4.25Å; F102-Y155 AromaticContact CE2-CD1 3.85Å; F102-Y155 HydrophobicContact CE2-CD1 3.85Å; F102-Y155 HydrophobicContact CE2-CG 4.35Å; L118-Y155 HydrophobicContact CB-CD2 4.19Å; L118-Y155 HydrophobicContact CB-CE2 4.14Å; L118-Y155 HydrophobicContact CD1-CD2 3.99Å; L118-Y155 HydrophobicContact CD1-CG 4Å; L118-Y155 HydrophobicContact CD2-CD1 3.98Å; L118-Y155 HydrophobicContact CD2-CD2 4.21Å; L118-Y155 HydrophobicContact CD2-CE1 4.07Å; L118-Y155 HydrophobicContact CD2-CE2 4.31Å; L118-Y155 HydrophobicContact CD2-CG 4.04Å; L118-Y155 HydrophobicContact CG-CD2 4.36Å; L121-Y155 HydrophobicContact CD2-CE1 4.42Å; S122-Y155 WeakPolarHBondContact OG-CE2 3.46Å; S122-Y155 PolarHBondContact OG-OH 3.17Å; F142-Y155 HydrophobicContact CZ-CD2 4.25Å; F142-Y155 HydrophobicContact CZ-CE2 4.08Å; S151-Y155 PolarHBondContact O-N 3.38Å; Y155-Y158 HydrophobicContact CD2-CD1 4.25Å; Y155-Y158 AromaticContact CE2-CD1 3.88Å; Y155-Y158 HydrophobicContact CE2-CD1 3.88Å; Y155-Y158 HydrophobicContact CE2-CE1 4.4Å; Y155-Y158 WeakPolarHBondContact O-CB 3.31Å; Y155-Y158 PolarHBondContact O-N 3.39Å; Y155-L159 HydrophobicContact CE1-CB 4.32Å; Y155-L159 HydrophobicContact CE1-CD1 4.37Å; Y155-L159 HydrophobicContact CE1-CD2 4.34Å; Y155-L159 WeakPolarHBondContact O-CB 3.46Å; Y155-L159 PolarHBondContact O-N 3.02Å
156	M	75.5	Confident	71.2	Confident	35 Å²	35	61.4 Å²	61.4	17%	0.172	34%	0.341	C	S	.	.	H	α-helix	trans	-62.3	-42.9	-177	-77.8	-71.1	-74	0	0	114.4	F69 L95 S152 Y158 L159 N160	F69-M156 HydrophobicContact CD1-CE 4.43Å; F69-M156 HydrophobicContact CE1-CE 3.94Å; F69-M156 HydrophobicContact CE1-CG 3.79Å; F69-M156 HydrophobicContact CE1-SD 4.04Å; F69-M156 HydrophobicContact CZ-CG 3.74Å; L95-M156 HydrophobicContact CD1-CE 4.01Å; L95-M156 HydrophobicContact CD1-SD 4.09Å; L95-M156 HydrophobicContact CD2-CE 4.23Å; S152-M156 WeakPolarHBondContact O-CB 3.39Å; S152-M156 WeakPolarHBondContact O-CG 3.48Å; S152-M156 PolarHBondContact O-N 3.2Å; M156-Y158 VanDerWaalsContact C-N 3.33Å; M156-Y158 PolarHBondContact O-N 3.07Å; M156-L159 PolarHBondContact O-N 3.02Å; M156-L159 HydrophobicContact SD-CD2 4.05Å; M156-N160 PolarHBondContact O-N 3.45Å; M156-N160 PolarHBondContact O-ND2 3.02Å
157	P	77.4	Confident	72.6	Confident	80 Å²	80	56.3 Å²	56.3	52%	0.519	31%	0.314	S	S	.	.	H	α-helix	trans	-58.3	-41.4	171.8	-27.5	35.5	0	0	0	113.4	Q153 G154 K161	Q153-P157 WeakPolarHBondContact O-CD 3.47Å; Q153-P157 WeakPolarHBondContact O-CG 3.4Å; G154-P157 WeakPolarHBondContact O-CD 3.39Å; P157-K161 VanDerWaalsContact O-CB 3.3Å; P157-K161 WeakPolarHBondContact O-CB 3.4Å; P157-K161 PolarHBondContact O-N 3.38Å
158	Y	80.8	Confident	73.9	Confident	21 Å²	21	54.8 Å²	54.8	8%	0.082	30%	0.301	C	S	.	.	H	α-helix	trans	-62.9	-51.4	175.9	175.7	-87.5	0	0	0	111.4	Y126 L138 H141 F142 Y155 M156 N160 K161 Y162 I163	Y126-Y158 WeakPolarHBondContact CE2-OH 3.41Å; Y126-Y158 PolarHBondContact OH-OH 3.34Å; L138-Y158 VanDerWaalsContact CD1-OH 3.24Å; L138-Y158 WeakPolarHBondContact CD1-OH 3.31Å; H141-Y158 HydrophobicContact CB-CD2 4.12Å; H141-Y158 HydrophobicContact CB-CE2 3.66Å; H141-Y158 AromaticContact CD2-CD2 3.83Å; H141-Y158 AromaticContact CD2-CE2 3.83Å; H141-Y158 AromaticContact CG-CE2 3.72Å; F142-Y158 HydrophobicContact CE2-CE1 4.14Å; F142-Y158 HydrophobicContact CE2-CE2 4.41Å; F142-Y158 HydrophobicContact CZ-CD1 4.49Å; F142-Y158 HydrophobicContact CZ-CE1 4.4Å; Y155-Y158 HydrophobicContact CD2-CD1 4.25Å; Y155-Y158 AromaticContact CE2-CD1 3.88Å; Y155-Y158 HydrophobicContact CE2-CD1 3.88Å; Y155-Y158 HydrophobicContact CE2-CE1 4.4Å; Y155-Y158 WeakPolarHBondContact O-CB 3.31Å; Y155-Y158 PolarHBondContact O-N 3.39Å; M156-Y158 VanDerWaalsContact C-N 3.33Å; M156-Y158 PolarHBondContact O-N 3.07Å; Y158-N160 VanDerWaalsContact C-N 3.29Å; Y158-N160 PolarHBondContact O-N 3.38Å; Y158-K161 PolarHBondContact O-N 3.46Å; Y158-Y162 AromaticContact CD2-CD2 3.37Å; Y158-Y162 HydrophobicContact CD2-CD2 3.37Å; Y158-Y162 AromaticContact CD2-CE2 3.82Å; Y158-Y162 HydrophobicContact CD2-CE2 3.82Å; Y158-Y162 HydrophobicContact CD2-CG 4.37Å; Y158-Y162 AromaticContact CE2-CD2 3.6Å; Y158-Y162 HydrophobicContact CE2-CD2 3.6Å; Y158-Y162 HydrophobicContact CE2-CE2 4.19Å; Y158-Y162 HydrophobicContact CE2-CG 4.22Å; Y158-Y162 AromaticContact CG-CD2 4Å; Y158-Y162 HydrophobicContact CG-CD2 4Å; Y158-Y162 PolarHBondContact O-N 3.06Å; Y158-I163 HydrophobicContact CE1-CD1 4.23Å
159	L	82.9	Confident	74.7	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.01	30%	0.304	C	S	.	.	I	π-helix	trans	-57.4	-42	179.7	-179.2	68.1	0	0	0	111.8	L95 I98 L125 Y155 M156 I163 L164	L95-L159 HydrophobicContact CD1-CD2 3.99Å; I98-L159 HydrophobicContact CD1-CD1 4.33Å; I98-L159 HydrophobicContact CG2-CD1 4.32Å; I98-L159 HydrophobicContact CG2-CD2 3.75Å; L125-L159 HydrophobicContact CD1-CD1 4.17Å; Y155-L159 HydrophobicContact CE1-CB 4.32Å; Y155-L159 HydrophobicContact CE1-CD1 4.37Å; Y155-L159 HydrophobicContact CE1-CD2 4.34Å; Y155-L159 WeakPolarHBondContact O-CB 3.46Å; Y155-L159 PolarHBondContact O-N 3.02Å; M156-L159 PolarHBondContact O-N 3.02Å; M156-L159 HydrophobicContact SD-CD2 4.05Å; L159-I163 HydrophobicContact CD1-CB 4.19Å; L159-I163 HydrophobicContact CD1-CD1 3.97Å; L159-I163 HydrophobicContact CD1-CG2 4.34Å; L159-I163 WeakPolarHBondContact O-CB 3.46Å; L159-I163 PolarHBondContact O-N 2.73Å; L159-L164 HydrophobicContact CD2-CD1 4.32Å; L159-L164 HydrophobicContact CG-CD1 4.03Å; L159-L164 HydrophobicContact CG-CG 4.25Å; L159-L164 PolarHBondContact O-N 2.96Å
160	N	82.4	Confident	75.5	Confident	59 Å²	59	57.4 Å²	57.4	32%	0.316	32%	0.315	S	S	.	.	I	π-helix	trans	-65.9	-56.6	175.8	-78.8	-82.3	0	0	0	111.3	M156 Y158 Y162 L164 D165	M156-N160 PolarHBondContact O-N 3.45Å; M156-N160 PolarHBondContact O-ND2 3.02Å; Y158-N160 VanDerWaalsContact C-N 3.29Å; Y158-N160 PolarHBondContact O-N 3.38Å; N160-Y162 PolarHBondContact O-N 3.3Å; N160-L164 PolarHBondContact O-N 3.28Å; N160-D165 VanDerWaalsContact O-CB 3.3Å; N160-D165 WeakPolarHBondContact O-CB 3.31Å; N160-D165 PolarHBondContact O-N 3.36Å
161	K	80.6	Confident	76.3	Confident	121 Å²	121	58.2 Å²	58.2	53%	0.526	33%	0.325	S	S	.	.	I	π-helix	trans	-69.1	-33.9	-170.2	-174.8	-176.4	173.1	-160.3	0	114.8	P157 Y158 D165	P157-K161 VanDerWaalsContact O-CB 3.3Å; P157-K161 WeakPolarHBondContact O-CB 3.4Å; P157-K161 PolarHBondContact O-N 3.38Å; Y158-K161 PolarHBondContact O-N 3.46Å; K161-D165 WeakPolarHBondContact CA-OD2 3.46Å
162	Y	80.3	Confident	77.5	Confident	54 Å²	54	57 Å²	57	21%	0.212	31%	0.314	C	S	.	.	I	π-helix	trans	-111.7	-23	-169.6	-60.1	-68	0	0	0	114.8	Y126 H141 Y158 N160 K166	Y126-Y162 VanDerWaalsContact OH-CB 3.32Å; Y126-Y162 WeakPolarHBondContact OH-CB 3.45Å; H141-Y162 AromaticContact CD2-CE2 3.65Å; H141-Y162 AromaticContact CD2-CZ 4Å; H141-Y162 AromaticContact CE1-CZ 3.9Å; H141-Y162 AromaticContact NE2-CE2 3.31Å; H141-Y162 VanDerWaalsContact NE2-CE2 3.31Å; H141-Y162 WeakPolarHBondContact NE2-CE2 3.43Å; H141-Y162 AromaticContact NE2-CZ 3.15Å; H141-Y162 PolarHBondContact NE2-OH 3.28Å; Y158-Y162 AromaticContact CD2-CD2 3.37Å; Y158-Y162 HydrophobicContact CD2-CD2 3.37Å; Y158-Y162 AromaticContact CD2-CE2 3.82Å; Y158-Y162 HydrophobicContact CD2-CE2 3.82Å; Y158-Y162 HydrophobicContact CD2-CG 4.37Å; Y158-Y162 AromaticContact CE2-CD2 3.6Å; Y158-Y162 HydrophobicContact CE2-CD2 3.6Å; Y158-Y162 HydrophobicContact CE2-CE2 4.19Å; Y158-Y162 HydrophobicContact CE2-CG 4.22Å; Y158-Y162 AromaticContact CG-CD2 4Å; Y158-Y162 HydrophobicContact CG-CD2 4Å; Y158-Y162 PolarHBondContact O-N 3.06Å; N160-Y162 PolarHBondContact O-N 3.3Å; Y162-K166 VanDerWaalsContact O-CD 3.31Å; Y162-K166 WeakPolarHBondContact O-CD 3.4Å
163	I	83.4	Confident	78.9	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.331	C	S	.	.	I	π-helix	trans	-107.4	-69.9	176.3	-63.5	171.4	0	0	0	109.3	L125 Y126 L129 I131 Y158 L159 D165 K166 V167	L125-I163 HydrophobicContact CB-CD1 4.14Å; L125-I163 HydrophobicContact CD1-CD1 4.2Å; Y126-I163 HydrophobicContact CD1-CG1 4.3Å; Y126-I163 HydrophobicContact CE1-CG1 3.72Å; Y126-I163 HydrophobicContact CE2-CD1 4.12Å; Y126-I163 HydrophobicContact CE2-CG1 4.08Å; L129-I163 HydrophobicContact CD1-CG2 3.62Å; I131-I163 HydrophobicContact CD1-CB 4.48Å; I131-I163 HydrophobicContact CD1-CG2 3.95Å; Y158-I163 HydrophobicContact CE1-CD1 4.23Å; L159-I163 HydrophobicContact CD1-CB 4.19Å; L159-I163 HydrophobicContact CD1-CD1 3.97Å; L159-I163 HydrophobicContact CD1-CG2 4.34Å; L159-I163 WeakPolarHBondContact O-CB 3.46Å; L159-I163 PolarHBondContact O-N 2.73Å; I163-D165 VanDerWaalsContact C-N 3.29Å; I163-D165 PolarHBondContact O-N 3.31Å; I163-K166 WeakPolarHBondContact O-CA 3.46Å; I163-K166 PolarHBondContact O-N 3.47Å; I163-V167 WeakPolarHBondContact O-CG2 3.17Å; I163-V167 PolarHBondContact O-N 2.99Å
164	L	83.9	Confident	80.1	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.005	31%	0.309	C	S	.	.	I	π-helix	trans	-65.7	-26.4	-171.6	-61.8	174.3	0	0	0	114.1	R91 L94 L95 I98 L159 N160 K166	R91-L164 HydrophobicContact CG-CB 4.19Å; R91-L164 PolarHBondContact NE-O 3.42Å; R91-L164 VanDerWaalsContact NE-O 3.14Å; L94-L164 HydrophobicContact CB-CD2 4.03Å; L94-L164 HydrophobicContact CD1-CD2 4.22Å; L95-L164 HydrophobicContact CD1-CD1 4.46Å; I98-L164 HydrophobicContact CD1-CD2 4.17Å; L159-L164 HydrophobicContact CD2-CD1 4.32Å; L159-L164 HydrophobicContact CG-CD1 4.03Å; L159-L164 HydrophobicContact CG-CG 4.25Å; L159-L164 PolarHBondContact O-N 2.96Å; N160-L164 PolarHBondContact O-N 3.28Å; L164-K166 VanDerWaalsContact C-N 3.3Å
165	D	82.7	Confident	81.1	Confident	84 Å²	84	56.8 Å²	56.8	45%	0.449	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-22.8	171.3	-92.8	-41.3	0	0	0	113.5	R91 N160 K161 I163	R91-D165 IonicContact CZ-OD1 2.66Å; R91-D165 IonicContact NH1-OD1 2.73Å; R91-D165 PolarHBondContact NH1-OD1 2.96Å; R91-D165 IonicContact NH2-OD1 3.98Å; R91-D165 PolarHBondContact NH2-OD1 2.94Å; N160-D165 VanDerWaalsContact O-CB 3.3Å; N160-D165 WeakPolarHBondContact O-CB 3.31Å; N160-D165 PolarHBondContact O-N 3.36Å; K161-D165 WeakPolarHBondContact CA-OD2 3.46Å; I163-D165 VanDerWaalsContact C-N 3.29Å; I163-D165 PolarHBondContact O-N 3.31Å
166	K	83.5	Confident	81.7	Confident	104 Å²	104	61.8 Å²	61.8	45%	0.452	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-1.8	-177.4	-61	-167.7	-174	177	0	114.8	I131 Y162 I163 L164 E168	I131-K166 HydrophobicContact CD1-CB 4.45Å; I131-K166 HydrophobicContact CG2-CB 3.91Å; I131-K166 HydrophobicContact CG2-CD 3.9Å; Y162-K166 VanDerWaalsContact O-CD 3.31Å; Y162-K166 WeakPolarHBondContact O-CD 3.4Å; I163-K166 WeakPolarHBondContact O-CA 3.46Å; I163-K166 PolarHBondContact O-N 3.47Å; L164-K166 VanDerWaalsContact C-N 3.3Å; K166-E168 PolarHBondContact O-N 3.39Å
167	V	84.3	Confident	82.4	Confident	21 Å²	21	60.1 Å²	60.1	13%	0.127	32%	0.319	C	S	.	.			trans	-74.4	121.9	177.9	-178.9	0	0	0	0	110.5	L90 L94 L129 I131 I163 F172	L90-V167 HydrophobicContact CD2-CG1 3.89Å; L94-V167 HydrophobicContact CD1-CB 4.34Å; L94-V167 HydrophobicContact CD1-CG1 3.94Å; L94-V167 HydrophobicContact CD1-CG2 4.03Å; L129-V167 HydrophobicContact CD1-CG2 3.95Å; L129-V167 HydrophobicContact CD2-CG2 4.4Å; I131-V167 HydrophobicContact CD1-CG2 3.94Å; I163-V167 WeakPolarHBondContact O-CG2 3.17Å; I163-V167 PolarHBondContact O-N 2.99Å; V167-F172 HydrophobicContact CG1-CD1 3.95Å; V167-F172 HydrophobicContact CG1-CE1 3.34Å; V167-F172 HydrophobicContact CG1-CZ 4.07Å
168	E	79.4	Confident	83	Confident	148 Å²	148	56.4 Å²	56.4	69%	0.692	30%	0.295	S	S	*	.			trans	-96.8	138.6	170	-64	-169	166.5	0	0	111.7	K166 G170 A171	K166-E168 PolarHBondContact O-N 3.39Å; E168-G170 PolarHBondContact O-N 3.47Å; E168-A171 HydrophobicContact CB-CB 4.05Å; E168-A171 PolarHBondContact O-N 3.21Å
169	E	74.8	Confident	83.4	Confident	101 Å²	101	59.5 Å²	59.5	47%	0.472	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	110.8	-174.4	-161.9	-175.5	140.1	0	0	110.8	S86 L90 K406	S86-E169 PolarHBondContact OG-OE2 3.24Å; L90-E169 HydrophobicContact CD2-CB 3.88Å; L90-E169 HydrophobicContact CD2-CG 4Å; E169-K406 WeakPolarHBondContact OE1-CD 3.31Å; E169-K406 IonicContact OE1-NZ 3.54Å; E169-K406 PolarHBondContact OE1-NZ 3.29Å; E169-K406 IonicContact OE2-NZ 3.14Å; E169-K406 PolarHBondContact OE2-NZ 3.24Å
170	G	74.3	Confident	83.7	Confident	71 Å²	71	60.7 Å²	60.7	73%	0.732	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.6	-2.8	-176.1	0	0	0	0	0	114.9	E168 F172	E168-G170 PolarHBondContact O-N 3.47Å; G170-F172 PolarHBondContact O-N 3.04Å
171	A	81.4	Confident	84	Confident	50 Å²	50	57.9 Å²	57.9	41%	0.413	30%	0.301	S	S	.	.	S	Bend	trans	-73.1	-14.4	172.7	0	0	0	0	0	113.5	H130 E168	H130-A171 PolarHBondContact CD2-O 2.99Å; E168-A171 HydrophobicContact CB-CB 4.05Å; E168-A171 PolarHBondContact O-N 3.21Å
172	F	84.6	Confident	84.5	Confident	21 Å²	21	52.3 Å²	52.3	9%	0.092	28%	0.277	C	S	.	.	S	Bend	trans	-140.3	160.7	-175	70.6	-78.1	0	0	0	111.9	L90 L94 V128 L129 V167 G170 K174 F177	L90-F172 HydrophobicContact CD1-CZ 4.28Å; L94-F172 HydrophobicContact CD1-CZ 4.28Å; L94-F172 HydrophobicContact CD2-CE2 4Å; L94-F172 HydrophobicContact CD2-CZ 3.92Å; V128-F172 WeakPolarHBondContact O-CB 3.47Å; L129-F172 HydrophobicContact CD2-CD1 4.2Å; L129-F172 HydrophobicContact CD2-CD2 3.64Å; L129-F172 HydrophobicContact CD2-CE1 4.26Å; L129-F172 HydrophobicContact CD2-CE2 3.67Å; L129-F172 HydrophobicContact CD2-CG 3.92Å; L129-F172 HydrophobicContact CD2-CZ 4Å; V167-F172 HydrophobicContact CG1-CD1 3.95Å; V167-F172 HydrophobicContact CG1-CE1 3.34Å; V167-F172 HydrophobicContact CG1-CZ 4.07Å; G170-F172 PolarHBondContact O-N 3.04Å; F172-K174 HydrophobicContact CE2-CB 4.3Å; F172-F177 HydrophobicContact CD2-CB 4.45Å; F172-F177 HydrophobicContact CE2-CB 4.47Å
173	V	82.9	Confident	84.8	Confident	81 Å²	81	53.2 Å²	53.2	49%	0.491	29%	0.288	S	S	.	.			trans	-95.9	109.9	176.8	179.7	0	0	0	0	109.7	E175 H176	V173-E175 HydrophobicContact CG1-CB 4.32Å; V173-E175 PolarHBondContact O-N 3.09Å; V173-E175 VanDerWaalsContact O-N 3.16Å; V173-H176 WeakPolarHBondContact CB-ND1 3.45Å; V173-H176 VanDerWaalsContact CG1-ND1 3.34Å; V173-H176 WeakPolarHBondContact CG1-ND1 3.43Å; V173-H176 PolarHBondContact O-N 3.28Å
174	K	85.6	Confident	84.8	Confident	65 Å²	65	55.9 Å²	55.9	28%	0.283	30%	0.302	S	S	.	.	H	α-helix	trans	-54.1	-35.4	-175.4	-173.3	177.4	-177.9	-66.9	0	114.1	F172 F177 D178	F172-K174 HydrophobicContact CE2-CB 4.3Å; K174-F177 WeakPolarHBondContact O-CB 3.39Å; K174-F177 PolarHBondContact O-N 3.33Å; K174-D178 IonicContact NZ-OD1 3.38Å; K174-D178 IonicContact NZ-OD2 2.76Å; K174-D178 PolarHBondContact NZ-OD2 2.92Å; K174-D178 PolarHBondContact O-N 3.01Å
175	E	86.9	Confident	84.9	Confident	69 Å²	69	55.9 Å²	55.9	32%	0.322	30%	0.302	S	S	.	.	H	α-helix	trans	-61.4	-44.9	-178.1	-168.3	161.1	176.3	0	0	112.6	V173 F177 D178 E179 F206 Q302	V173-E175 HydrophobicContact CG1-CB 4.32Å; V173-E175 PolarHBondContact O-N 3.09Å; V173-E175 VanDerWaalsContact O-N 3.16Å; E175-F177 VanDerWaalsContact C-N 3.32Å; E175-F177 PolarHBondContact O-N 3.41Å; E175-D178 PolarHBondContact O-N 3.31Å; E175-E179 WeakPolarHBondContact O-CB 3.47Å; E175-E179 PolarHBondContact O-N 3.25Å; E175-F206 HydrophobicContact CG-CE1 4.33Å; E175-Q302 PolarHBondContact OE2-NE2 2.86Å
176	H	87.9	Confident	84.9	Confident	110 Å²	110	52.2 Å²	52.2	51%	0.509	28%	0.283	S	S	.	.	H	α-helix	trans	-66	-32.4	175.5	-60.5	99.7	0	0	0	112.8	V128 V173 L180	V128-H176 HydrophobicContact CG1-CB 4.01Å; V173-H176 WeakPolarHBondContact CB-ND1 3.45Å; V173-H176 VanDerWaalsContact CG1-ND1 3.34Å; V173-H176 WeakPolarHBondContact CG1-ND1 3.43Å; V173-H176 PolarHBondContact O-N 3.28Å; H176-L180 PolarHBondContact O-N 3.05Å
177	F	90.3	Very high	84.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-68.9	-43.3	174.9	159.5	-87.4	0	0	0	111.5	L94 I98 L125 V128 L129 F172 K174 E175 E179 L180 C181	L94-F177 HydrophobicContact CB-CE1 4.27Å; L94-F177 HydrophobicContact CB-CE2 4.5Å; L94-F177 HydrophobicContact CB-CZ 3.8Å; L94-F177 HydrophobicContact CD2-CD1 3.66Å; L94-F177 HydrophobicContact CD2-CD2 4.29Å; L94-F177 HydrophobicContact CD2-CE1 3.31Å; L94-F177 HydrophobicContact CD2-CE2 3.95Å; L94-F177 HydrophobicContact CD2-CG 4.15Å; L94-F177 HydrophobicContact CD2-CZ 3.46Å; L94-F177 VanDerWaalsContact CD2-CZ 3.46Å; L94-F177 HydrophobicContact CG-CE1 4.37Å; L94-F177 HydrophobicContact CG-CZ 4.21Å; I98-F177 HydrophobicContact CD1-CE2 3.98Å; I98-F177 HydrophobicContact CD1-CZ 3.95Å; I98-F177 HydrophobicContact CG1-CE2 3.93Å; I98-F177 HydrophobicContact CG1-CZ 3.8Å; L125-F177 HydrophobicContact CD2-CD2 4.02Å; L125-F177 HydrophobicContact CD2-CE2 3.65Å; V128-F177 HydrophobicContact CG1-CB 3.93Å; L129-F177 HydrophobicContact CD1-CD2 4.48Å; L129-F177 HydrophobicContact CD1-CE2 4.48Å; L129-F177 HydrophobicContact CD2-CD2 3.69Å; L129-F177 HydrophobicContact CD2-CE2 4.2Å; L129-F177 HydrophobicContact CD2-CG 4.26Å; L129-F177 HydrophobicContact CG-CD2 4.14Å; F172-F177 HydrophobicContact CD2-CB 4.45Å; F172-F177 HydrophobicContact CE2-CB 4.47Å; K174-F177 WeakPolarHBondContact O-CB 3.39Å; K174-F177 PolarHBondContact O-N 3.33Å; E175-F177 VanDerWaalsContact C-N 3.32Å; E175-F177 PolarHBondContact O-N 3.41Å; F177-E179 VanDerWaalsContact C-N 3.34Å; F177-L180 PolarHBondContact O-N 2.95Å; F177-C181 PolarHBondContact O-N 3.49Å; F177-C181 VanDerWaalsContact O-N 3.16Å; F177-C181 PolarHBondContact O-SG 3.06Å
178	D	90.1	Very high	84	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.011	32%	0.315	C	S	.	.	H	α-helix	trans	-67	-37.1	175.3	-79.4	-32.7	0	0	0	110.8	S97 K174 E175 C181 W182 F206 W209	S97-D178 WeakPolarHBondContact CB-OD1 3.43Å; S97-D178 PolarHBondContact OG-OD1 2.98Å; K174-D178 IonicContact NZ-OD1 3.38Å; K174-D178 IonicContact NZ-OD2 2.76Å; K174-D178 PolarHBondContact NZ-OD2 2.92Å; K174-D178 PolarHBondContact O-N 3.01Å; E175-D178 PolarHBondContact O-N 3.31Å; D178-C181 PolarHBondContact O-N 3.07Å; D178-W182 WeakPolarHBondContact O-CB 3.46Å; D178-W182 PolarHBondContact O-N 3.31Å; D178-F206 HydrophobicContact CB-CE2 3.95Å; D178-F206 HydrophobicContact CB-CZ 4.04Å; D178-W209 HydrophobicContact CB-CZ3 4.01Å; D178-W209 WeakPolarHBondContact O-CZ3 3.3Å
179	E	89.9	Confident	83.8	Confident	86 Å²	86	56 Å²	56	40%	0.402	30%	0.299	S	S	.	.	H	α-helix	trans	-64.1	-41.6	174.6	-174.4	178.4	-154.4	0	0	112.4	E175 F177 C181 W182 T183 F206	E175-E179 WeakPolarHBondContact O-CB 3.47Å; E175-E179 PolarHBondContact O-N 3.25Å; F177-E179 VanDerWaalsContact C-N 3.34Å; E179-C181 VanDerWaalsContact C-N 3.31Å; E179-C181 PolarHBondContact O-N 3.21Å; E179-W182 PolarHBondContact O-N 2.88Å; E179-T183 HydrophobicContact CG-CG2 4.32Å; E179-T183 WeakPolarHBondContact O-CB 3.49Å; E179-T183 WeakPolarHBondContact O-CG2 3.35Å; E179-T183 PolarHBondContact O-N 3.45Å; E179-T183 PolarHBondContact O-OG1 3.02Å; E179-F206 HydrophobicContact CB-CE2 4.36Å; E179-F206 HydrophobicContact CB-CZ 4.06Å
180	L	89.1	Confident	84	Confident	26 Å²	26	52.3 Å²	52.3	14%	0.136	28%	0.281	C	S	.	.	H	α-helix	trans	-58.2	-43.1	171.5	173.7	65.7	0	0	0	111.5	N124 L125 V128 H176 F177 T183 L184	N124-L180 HydrophobicContact CB-CD1 4.06Å; N124-L180 HydrophobicContact CB-CD2 3.79Å; L125-L180 HydrophobicContact CD2-CD2 4.4Å; V128-L180 HydrophobicContact CB-CD2 4.41Å; V128-L180 HydrophobicContact CG2-CD2 4.05Å; H176-L180 PolarHBondContact O-N 3.05Å; F177-L180 PolarHBondContact O-N 2.95Å; L180-T183 PolarHBondContact O-OG1 3.27Å; L180-T183 VanDerWaalsContact O-OG1 3.12Å; L180-L184 HydrophobicContact CD1-CD1 4.48Å; L180-L184 WeakPolarHBondContact O-CG 3.4Å; L180-L184 PolarHBondContact O-N 3.46Å
181	C	89	Confident	83.6	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-71	-39.6	178.6	-64.3	0	0	0	0	112	S97 A101 F177 D178 E179 T185 W209	S97-C181 WeakPolarHBondContact O-CB 3.42Å; A101-C181 HydrophobicContact CB-CB 4.47Å; F177-C181 PolarHBondContact O-N 3.49Å; F177-C181 VanDerWaalsContact O-N 3.16Å; F177-C181 PolarHBondContact O-SG 3.06Å; D178-C181 PolarHBondContact O-N 3.07Å; E179-C181 VanDerWaalsContact C-N 3.31Å; E179-C181 PolarHBondContact O-N 3.21Å; C181-T185 WeakPolarHBondContact O-CB 3.48Å; C181-T185 PolarHBondContact O-N 3.4Å; C181-T185 PolarHBondContact O-OG1 2.93Å; C181-W209 HydrophobicContact CB-CH2 3.75Å; C181-W209 HydrophobicContact CB-CZ2 4.42Å
182	W	90.3	Very high	82.6	Confident	5 Å²	5	59.2 Å²	59.2	2%	0.019	29%	0.285	C	S	.	.	H	α-helix	trans	-64.2	-49.8	176.9	173.9	-113.1	0	0	0	111.9	D178 E179 L184 T185 A186 Y190 N202 A205 F206 W209 W269 L272	D178-W182 WeakPolarHBondContact O-CB 3.46Å; D178-W182 PolarHBondContact O-N 3.31Å; E179-W182 PolarHBondContact O-N 2.88Å; W182-L184 VanDerWaalsContact C-N 3.28Å; W182-L184 PolarHBondContact O-N 2.9Å; W182-T185 PolarHBondContact O-N 3.5Å; W182-A186 HydrophobicContact CD2-CB 3.75Å; W182-A186 HydrophobicContact CE3-CB 4.02Å; W182-A186 HydrophobicContact CG-CB 4.36Å; W182-A186 HydrophobicContact CH2-CB 3.95Å; W182-A186 HydrophobicContact CZ2-CB 3.66Å; W182-A186 HydrophobicContact CZ3-CB 4.11Å; W182-A186 WeakPolarHBondContact O-CB 3.28Å; W182-A186 PolarHBondContact O-N 3.39Å; W182-Y190 HydrophobicContact CH2-CD1 4.15Å; W182-Y190 HydrophobicContact CH2-CD2 4.3Å; W182-Y190 AromaticContact CH2-CG 3.92Å; W182-Y190 HydrophobicContact CH2-CG 3.92Å; W182-Y190 HydrophobicContact CZ2-CD1 4.06Å; W182-Y190 HydrophobicContact CZ2-CG 4.29Å; W182-N202 PolarHBondContact NE1-OD1 3.14Å; W182-A205 HydrophobicContact CH2-CB 3.93Å; W182-A205 HydrophobicContact CZ2-CB 3.74Å; W182-F206 HydrophobicContact CB-CD2 3.58Å; W182-F206 HydrophobicContact CB-CE2 3.89Å; W182-F206 AromaticContact CD1-CD2 3.68Å; W182-F206 HydrophobicContact CD2-CB 4.29Å; W182-F206 HydrophobicContact CD2-CD2 4.12Å; W182-F206 HydrophobicContact CG-CB 4.22Å; W182-F206 AromaticContact CG-CD2 3.51Å; W182-F206 HydrophobicContact CG-CD2 3.51Å; W182-F206 HydrophobicContact CG-CE2 4.31Å; W182-F206 HydrophobicContact CG-CG 4.24Å; W182-W209 HydrophobicContact CB-CE3 4.21Å; W182-W209 HydrophobicContact CB-CZ3 4.15Å; W182-W209 HydrophobicContact CE3-CB 3.72Å; W182-W209 AromaticContact CE3-CD1 3.82Å; W182-W209 AromaticContact CE3-CD2 3.69Å; W182-W209 HydrophobicContact CE3-CD2 3.69Å; W182-W209 HydrophobicContact CE3-CE3 4.17Å; W182-W209 AromaticContact CE3-CG 3.46Å; W182-W209 HydrophobicContact CE3-CG 3.46Å; W182-W209 VanDerWaalsContact CE3-CG 3.46Å; W182-W209 HydrophobicContact CH2-CB 4.34Å; W182-W209 HydrophobicContact CZ3-CB 3.54Å; W182-W209 AromaticContact CZ3-CD1 3.7Å; W182-W209 HydrophobicContact CZ3-CD2 4.29Å; W182-W209 AromaticContact CZ3-CG 3.57Å; W182-W209 HydrophobicContact CZ3-CG 3.57Å; W182-W269 HydrophobicContact CZ3-CZ3 4.44Å; W182-L272 HydrophobicContact CH2-CD1 4Å; W182-L272 HydrophobicContact CZ3-CD1 4.2Å
183	T	86.7	Confident	81.3	Confident	73 Å²	73	62.9 Å²	62.9	45%	0.448	31%	0.305	S	S	.	.	H	α-helix	trans	-60.3	-35	-178.4	48.8	0	0	0	0	113	E179 L180 K187	E179-T183 HydrophobicContact CG-CG2 4.32Å; E179-T183 WeakPolarHBondContact O-CB 3.49Å; E179-T183 WeakPolarHBondContact O-CG2 3.35Å; E179-T183 PolarHBondContact O-N 3.45Å; E179-T183 PolarHBondContact O-OG1 3.02Å; L180-T183 PolarHBondContact O-OG1 3.27Å; L180-T183 VanDerWaalsContact O-OG1 3.12Å; T183-K187 WeakPolarHBondContact O-CB 3.18Å
184	L	84.3	Confident	79.9	Confident	56 Å²	56	64.5 Å²	64.5	29%	0.293	32%	0.321	S	S	.	.	H	α-helix	trans	-68.7	-40.5	172	-69.5	172.5	0	0	0	112.8	A101 L121 L180 W182	A101-L184 HydrophobicContact CB-CB 4.48Å; A101-L184 HydrophobicContact CB-CD1 4.08Å; L121-L184 HydrophobicContact CD1-CD1 3.75Å; L180-L184 HydrophobicContact CD1-CD1 4.48Å; L180-L184 WeakPolarHBondContact O-CG 3.4Å; L180-L184 PolarHBondContact O-N 3.46Å; W182-L184 VanDerWaalsContact C-N 3.28Å; W182-L184 PolarHBondContact O-N 2.9Å
185	T	84.6	Confident	78.4	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-83	-49.7	-172.6	-47.2	0	0	0	0	112.5	Y100 A101 A104 C181 W182 K187 K188 N189 W269	Y100-T185 VanDerWaalsContact C-OG1 3.22Å; Y100-T185 HydrophobicContact CD1-CG2 4.15Å; Y100-T185 HydrophobicContact CG-CG2 4.44Å; Y100-T185 PolarHBondContact O-OG1 3.27Å; A101-T185 PolarHBondContact N-OG1 3.01Å; A104-T185 HydrophobicContact CB-CG2 4.17Å; C181-T185 WeakPolarHBondContact O-CB 3.48Å; C181-T185 PolarHBondContact O-N 3.4Å; C181-T185 PolarHBondContact O-OG1 2.93Å; W182-T185 PolarHBondContact O-N 3.5Å; T185-K187 VanDerWaalsContact C-N 3.3Å; T185-K187 PolarHBondContact O-N 3.48Å; T185-K188 PolarHBondContact O-N 3.36Å; T185-N189 PolarHBondContact O-N 3.08Å; T185-W269 HydrophobicContact CG2-CH2 3.55Å; T185-W269 HydrophobicContact CG2-CZ2 3.6Å
186	A	83	Confident	77	Confident	7 Å²	7	67.7 Å²	67.7	6%	0.058	36%	0.359	C	S	.	.	H	α-helix	trans	-60	-39	-177.3	0	0	0	0	0	112	W182 K188 N189 Y190	W182-A186 HydrophobicContact CD2-CB 3.75Å; W182-A186 HydrophobicContact CE3-CB 4.02Å; W182-A186 HydrophobicContact CG-CB 4.36Å; W182-A186 HydrophobicContact CH2-CB 3.95Å; W182-A186 HydrophobicContact CZ2-CB 3.66Å; W182-A186 HydrophobicContact CZ3-CB 4.11Å; W182-A186 WeakPolarHBondContact O-CB 3.28Å; W182-A186 PolarHBondContact O-N 3.39Å; A186-K188 PolarHBondContact O-N 2.74Å; A186-N189 PolarHBondContact O-N 3.34Å; A186-Y190 WeakPolarHBondContact O-CA 3.27Å; A186-Y190 PolarHBondContact O-N 3.21Å
187	K	77.2	Confident	75.7	Confident	192 Å²	192	68.8 Å²	68.8	84%	0.835	37%	0.369	S	S	*	.	H	α-helix	trans	-57.4	-23.2	-180	-175.1	171.2	-178.7	176.4	0	114.2	T183 T185	T183-K187 WeakPolarHBondContact O-CB 3.18Å; T185-K187 VanDerWaalsContact C-N 3.3Å; T185-K187 PolarHBondContact O-N 3.48Å
188	K	72.8	Confident	74.9	Confident	94 Å²	94	69.6 Å²	69.6	41%	0.409	37%	0.374	S	S	.	.	H	α-helix	trans	-105.6	-39.8	175.1	-67.4	-177.8	-178	-176.3	0	113	A104 T185 A186	A104-K188 WeakPolarHBondContact O-CD 3.47Å; A104-K188 WeakPolarHBondContact O-CE 3.27Å; A104-K188 PolarHBondContact O-NZ 3.34Å; T185-K188 PolarHBondContact O-N 3.36Å; A186-K188 PolarHBondContact O-N 2.74Å
189	N	74.5	Confident	74.1	Confident	67 Å²	67	72.5 Å²	72.5	36%	0.358	39%	0.388	S	S	.	.	H	α-helix	trans	-106.5	-21.6	-165	-61.4	-0.7	0	0	0	114.1	T185 A186 W269	T185-N189 PolarHBondContact O-N 3.08Å; A186-N189 PolarHBondContact O-N 3.34Å; N189-W269 HydrophobicContact CB-CD2 4.16Å; N189-W269 HydrophobicContact CB-CE3 4.19Å; N189-W269 HydrophobicContact CB-CH2 3.62Å; N189-W269 HydrophobicContact CB-CZ2 3.52Å; N189-W269 HydrophobicContact CB-CZ3 3.94Å
190	Y	78.1	Confident	73.8	Confident	24 Å²	24	68.6 Å²	68.6	9%	0.094	37%	0.37	C	S	.	.			trans	-103.4	100.5	179.4	-172.9	-110.9	0	0	0	110.9	W182 A186 A192 A205 L272 N276	W182-Y190 HydrophobicContact CH2-CD1 4.15Å; W182-Y190 HydrophobicContact CH2-CD2 4.3Å; W182-Y190 AromaticContact CH2-CG 3.92Å; W182-Y190 HydrophobicContact CH2-CG 3.92Å; W182-Y190 HydrophobicContact CZ2-CD1 4.06Å; W182-Y190 HydrophobicContact CZ2-CG 4.29Å; A186-Y190 WeakPolarHBondContact O-CA 3.27Å; A186-Y190 PolarHBondContact O-N 3.21Å; Y190-A192 HydrophobicContact CE1-CB 3.89Å; Y190-A205 HydrophobicContact CD1-CB 4.34Å; Y190-A205 HydrophobicContact CE1-CB 3.62Å; Y190-A205 HydrophobicContact CE2-CB 4.11Å; Y190-A205 VanDerWaalsContact CZ-CB 3.5Å; Y190-L272 HydrophobicContact CD2-CB 4.48Å; Y190-L272 HydrophobicContact CD2-CD1 3.88Å; Y190-L272 HydrophobicContact CE2-CB 4.06Å; Y190-L272 HydrophobicContact CE2-CD1 4.07Å; Y190-N276 PolarHBondContact OH-ND2 2.82Å; Y190-N276 PolarHBondContact OH-OD1 3.23Å
191	R	65.6	Low	73.7	Confident	216 Å²	216	68.8 Å²	68.8	82%	0.815	37%	0.374	S	S	*	.			trans	-97.2	93.9	170.2	-64.9	-175.1	-179.5	-142.7	-0.3	108.8	D193	R191-D193 PolarHBondContact O-N 3.33Å
192	A	61.7	Low	73.6	Confident	49 Å²	49	73.2 Å²	73.2	41%	0.405	40%	0.398	S	S	.	.			trans	-61.5	132.7	157.7	0	0	0	0	0	107.9	Y190 S194	Y190-A192 HydrophobicContact CE1-CB 3.89Å; A192-S194 PolarHBondContact O-N 3.31Å
193	D	57.1	Low	73.5	Confident	98 Å²	98	77 Å²	77	52%	0.524	42%	0.416	S	S	.	.			trans	-55.3	125.4	-170.3	-109.8	-23	0	0	0	112.4	R191 N195 G196	R191-D193 PolarHBondContact O-N 3.33Å; D193-N195 PolarHBondContact O-N 2.92Å; D193-G196 PolarHBondContact O-N 3.22Å
194	S	52.5	Low	73.7	Confident	116 Å²	116	73.8 Å²	73.8	81%	0.811	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-13.2	179.6	50.5	0	0	0	0	113.6	A192 G196	A192-S194 PolarHBondContact O-N 3.31Å; S194-G196 VanDerWaalsContact C-N 3.28Å
195	N	55.9	Low	74	Confident	132 Å²	132	71.1 Å²	71.1	71%	0.706	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	1.6	179.4	-58.9	-0.6	0	0	0	112.5	D193 N197	D193-N195 PolarHBondContact O-N 2.92Å; N195-N197 PolarHBondContact O-N 2.93Å
196	G	56.9	Low	74.4	Confident	68 Å²	68	71.3 Å²	71.3	70%	0.701	38%	0.382	S	S	*	.	S	Bend	trans	75.9	0.5	175.7	0	0	0	0	0	115.5	D193 S194 S198	D193-G196 PolarHBondContact O-N 3.22Å; S194-G196 VanDerWaalsContact C-N 3.28Å; G196-S198 VanDerWaalsContact C-N 3.32Å; G196-S198 PolarHBondContact O-N 2.85Å
197	N	61	Low	74.9	Confident	134 Å²	134	72.6 Å²	72.6	72%	0.717	39%	0.385	S	S	*	.			trans	-87.5	3.6	-173.4	-138.7	44.4	0	0	0	114.1	N195 M199	N195-N197 PolarHBondContact O-N 2.93Å; N197-M199 PolarHBondContact O-N 3.27Å
198	S	72.3	Confident	75.7	Confident	16 Å²	16	63.4 Å²	63.4	11%	0.112	35%	0.346	C	S	.	.			trans	-65.7	120.8	179.1	172.1	0	0	0	0	111.7	G196 L200 N276	G196-S198 VanDerWaalsContact C-N 3.32Å; G196-S198 PolarHBondContact O-N 2.85Å; S198-L200 PolarHBondContact O-N 3.04Å; S198-L200 PolarHBondContact OG-O 3Å; S198-N276 PolarHBondContact OG-OD1 3.44Å
199	M	74.7	Confident	76.7	Confident	64 Å²	64	59 Å²	59	32%	0.315	33%	0.326	S	S	.	.	S	Bend	trans	-58.5	-45	175.6	-77.4	-73	101.2	0	0	112.5	N197 R286 L289	N197-M199 PolarHBondContact O-N 3.27Å; M199-R286 WeakPolarHBondContact O-CD 3.49Å; M199-R286 WeakPolarHBondContact O-CG 3.5Å; M199-R286 PolarHBondContact O-NE 3.13Å; M199-L289 HydrophobicContact CB-CD2 4.49Å
200	L	83.3	Confident	77.6	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.021	31%	0.31	C	S	.	.	S	Bend	trans	-76.9	143.7	-177.2	-58.3	177.6	0	0	0	112.4	S198 D204 A205 L208 L272 F275 N276 L289 I293	S198-L200 PolarHBondContact O-N 3.04Å; S198-L200 PolarHBondContact OG-O 3Å; L200-D204 HydrophobicContact CB-CB 4.39Å; L200-D204 HydrophobicContact CD2-CB 4.05Å; L200-A205 HydrophobicContact CD1-CB 4.32Å; L200-L208 HydrophobicContact CD1-CD1 3.57Å; L200-L208 HydrophobicContact CD2-CD1 3.6Å; L200-L208 HydrophobicContact CG-CD1 4.25Å; L200-L272 HydrophobicContact CD1-CD2 4.16Å; L200-F275 HydrophobicContact CD1-CB 3.9Å; L200-F275 HydrophobicContact CD2-CB 4.16Å; L200-F275 HydrophobicContact CG-CB 4.2Å; L200-N276 WeakPolarHBondContact CB-OD1 3.37Å; L200-N276 WeakPolarHBondContact CD1-OD1 3.36Å; L200-N276 VanDerWaalsContact CG-OD1 3.28Å; L200-N276 WeakPolarHBondContact CG-OD1 3.32Å; L200-L289 HydrophobicContact CD2-CD2 4.23Å; L200-I293 HydrophobicContact CD2-CD1 3.71Å
201	S	87.1	Confident	78.3	Confident	30 Å²	30	54.8 Å²	54.8	21%	0.21	31%	0.306	C	S	.	.			trans	-77.9	168.1	156.3	80	0	0	0	0	110.7	Q203 D204 A205	S201-Q203 PolarHBondContact O-N 3.49Å; S201-Q203 PolarHBondContact OG-N 3.32Å; S201-D204 VanDerWaalsContact CB-OD2 3.24Å; S201-D204 WeakPolarHBondContact CB-OD2 3.39Å; S201-D204 PolarHBondContact N-OD2 3.33Å; S201-D204 PolarHBondContact O-N 3.5Å; S201-D204 PolarHBondContact OG-N 3.35Å; S201-D204 VanDerWaalsContact OG-N 3.13Å; S201-D204 PolarHBondContact OG-OD2 3.33Å; S201-A205 PolarHBondContact O-N 3.26Å
202	N	86.7	Confident	79.7	Confident	93 Å²	93	44.5 Å²	44.5	50%	0.497	27%	0.267	S	S	.	.	H	α-helix	trans	-62.5	-33.1	173.4	-161.3	-79.6	0	0	0	111.7	W182 A205 F206	W182-N202 PolarHBondContact NE1-OD1 3.14Å; N202-A205 PolarHBondContact O-N 3.27Å; N202-F206 WeakPolarHBondContact O-CB 3.43Å; N202-F206 PolarHBondContact O-N 2.87Å
203	Q	88.3	Confident	81.1	Confident	85 Å²	85	42.8 Å²	42.8	40%	0.397	25%	0.251	S	S	.	.	H	α-helix	trans	-68	-37.3	176.4	-158.7	68.5	23.5	0	0	112	S201 F206 R207	S201-Q203 PolarHBondContact O-N 3.49Å; S201-Q203 PolarHBondContact OG-N 3.32Å; Q203-F206 WeakPolarHBondContact O-CB 3.48Å; Q203-F206 PolarHBondContact O-N 2.93Å; Q203-R207 WeakPolarHBondContact O-CD 3.3Å; Q203-R207 VanDerWaalsContact O-CG 3.23Å; Q203-R207 WeakPolarHBondContact O-CG 3.46Å; Q203-R207 PolarHBondContact O-N 3.02Å
204	D	90.4	Very high	82.8	Confident	4 Å²	4	39.7 Å²	39.7	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-73.5	-37.1	177.5	-54	-52.5	0	0	0	111.3	L200 S201 F206 R207 L208 S290 I293	L200-D204 HydrophobicContact CB-CB 4.39Å; L200-D204 HydrophobicContact CD2-CB 4.05Å; S201-D204 VanDerWaalsContact CB-OD2 3.24Å; S201-D204 WeakPolarHBondContact CB-OD2 3.39Å; S201-D204 PolarHBondContact N-OD2 3.33Å; S201-D204 PolarHBondContact O-N 3.5Å; S201-D204 PolarHBondContact OG-N 3.35Å; S201-D204 VanDerWaalsContact OG-N 3.13Å; S201-D204 PolarHBondContact OG-OD2 3.33Å; D204-F206 VanDerWaalsContact C-N 3.35Å; D204-R207 PolarHBondContact O-N 3.34Å; D204-R207 IonicContact OD1-CZ 3.87Å; D204-R207 IonicContact OD1-NH1 2.9Å; D204-R207 PolarHBondContact OD1-NH1 2.91Å; D204-L208 VanDerWaalsContact O-CB 3.3Å; D204-L208 WeakPolarHBondContact O-CB 3.31Å; D204-L208 WeakPolarHBondContact O-CG 3.47Å; D204-L208 PolarHBondContact O-N 3.43Å; D204-S290 VanDerWaalsContact CG-OG 3.27Å; D204-S290 WeakPolarHBondContact OD1-CB 3.44Å; D204-S290 PolarHBondContact OD1-OG 3.09Å; D204-S290 PolarHBondContact OD2-OG 2.92Å; D204-I293 HydrophobicContact CB-CD1 4.08Å; D204-I293 HydrophobicContact CB-CG2 4.4Å
205	A	90.9	Very high	84.6	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.8	-39.5	170.7	0	0	0	0	0	112.2	W182 Y190 L200 S201 N202 L208 W209 L272	W182-A205 HydrophobicContact CH2-CB 3.93Å; W182-A205 HydrophobicContact CZ2-CB 3.74Å; Y190-A205 HydrophobicContact CD1-CB 4.34Å; Y190-A205 HydrophobicContact CE1-CB 3.62Å; Y190-A205 HydrophobicContact CE2-CB 4.11Å; Y190-A205 VanDerWaalsContact CZ-CB 3.5Å; L200-A205 HydrophobicContact CD1-CB 4.32Å; S201-A205 PolarHBondContact O-N 3.26Å; N202-A205 PolarHBondContact O-N 3.27Å; A205-L208 PolarHBondContact O-N 3.08Å; A205-W209 VanDerWaalsContact O-CB 3.29Å; A205-W209 WeakPolarHBondContact O-CB 3.49Å; A205-W209 PolarHBondContact O-N 3.43Å; A205-L272 HydrophobicContact CB-CD2 4.23Å
206	F	92.8	Very high	86.3	Confident	4 Å²	4	28 Å²	28	2%	0.018	16%	0.161	C	C	.	.	H	α-helix	trans	-61.4	-50.3	171.6	172	-123.1	0	0	0	112.1	E175 D178 E179 W182 N202 Q203 D204 L208 W209 C210	E175-F206 HydrophobicContact CG-CE1 4.33Å; D178-F206 HydrophobicContact CB-CE2 3.95Å; D178-F206 HydrophobicContact CB-CZ 4.04Å; E179-F206 HydrophobicContact CB-CE2 4.36Å; E179-F206 HydrophobicContact CB-CZ 4.06Å; W182-F206 HydrophobicContact CB-CD2 3.58Å; W182-F206 HydrophobicContact CB-CE2 3.89Å; W182-F206 AromaticContact CD1-CD2 3.68Å; W182-F206 HydrophobicContact CD2-CB 4.29Å; W182-F206 HydrophobicContact CD2-CD2 4.12Å; W182-F206 HydrophobicContact CG-CB 4.22Å; W182-F206 AromaticContact CG-CD2 3.51Å; W182-F206 HydrophobicContact CG-CD2 3.51Å; W182-F206 HydrophobicContact CG-CE2 4.31Å; W182-F206 HydrophobicContact CG-CG 4.24Å; N202-F206 WeakPolarHBondContact O-CB 3.43Å; N202-F206 PolarHBondContact O-N 2.87Å; Q203-F206 WeakPolarHBondContact O-CB 3.48Å; Q203-F206 PolarHBondContact O-N 2.93Å; D204-F206 VanDerWaalsContact C-N 3.35Å; F206-L208 VanDerWaalsContact C-N 3.33Å; F206-L208 PolarHBondContact O-N 3.16Å; F206-W209 HydrophobicContact CD2-CE3 4.2Å; F206-W209 HydrophobicContact CE2-CE3 4.27Å; F206-W209 HydrophobicContact CE2-CZ3 4.29Å; F206-W209 PolarHBondContact O-N 2.72Å; F206-W209 VanDerWaalsContact O-N 3.16Å; F206-C210 VanDerWaalsContact CE2-SG 3.51Å; F206-C210 PolarHBondContact O-N 2.92Å; F206-C210 PolarHBondContact O-SG 2.79Å
207	R	94	Very high	87.7	Confident	34 Å²	34	25.6 Å²	25.6	13%	0.128	13%	0.132	C	C	.	.	H	α-helix	trans	-57.4	-45.5	176.4	-71.6	163.5	176.9	163.7	-9.6	111.4	Q203 D204 C210 L211 S290 I293 H294 Y297	Q203-R207 WeakPolarHBondContact O-CD 3.3Å; Q203-R207 VanDerWaalsContact O-CG 3.23Å; Q203-R207 WeakPolarHBondContact O-CG 3.46Å; Q203-R207 PolarHBondContact O-N 3.02Å; D204-R207 PolarHBondContact O-N 3.34Å; D204-R207 IonicContact OD1-CZ 3.87Å; D204-R207 IonicContact OD1-NH1 2.9Å; D204-R207 PolarHBondContact OD1-NH1 2.91Å; R207-C210 WeakPolarHBondContact O-CB 3.36Å; R207-C210 PolarHBondContact O-N 3.43Å; R207-L211 WeakPolarHBondContact O-CB 3.46Å; R207-L211 VanDerWaalsContact O-CG 3.27Å; R207-L211 WeakPolarHBondContact O-CG 3.45Å; R207-L211 PolarHBondContact O-N 3.2Å; R207-S290 PolarHBondContact NH1-OG 2.92Å; R207-I293 HydrophobicContact CB-CG2 3.62Å; R207-I293 HydrophobicContact CG-CG2 4.46Å; R207-H294 VanDerWaalsContact NH2-CG 3.34Å; R207-H294 PolarHBondContact NH2-ND1 3.49Å; R207-Y297 HydrophobicContact CB-CD2 3.73Å; R207-Y297 HydrophobicContact CB-CE2 4.38Å; R207-Y297 HydrophobicContact CB-CG 4.12Å; R207-Y297 HydrophobicContact CG-CD1 4.36Å; R207-Y297 HydrophobicContact CG-CD2 3.8Å; R207-Y297 HydrophobicContact CG-CE2 4.23Å; R207-Y297 HydrophobicContact CG-CG 3.87Å
208	L	92.8	Very high	88.8	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-65.8	-35.5	176.3	-77.6	174.2	0	0	0	112.9	L200 D204 A205 F206 L211 F212 F271 L272 F275 I293	L200-L208 HydrophobicContact CD1-CD1 3.57Å; L200-L208 HydrophobicContact CD2-CD1 3.6Å; L200-L208 HydrophobicContact CG-CD1 4.25Å; D204-L208 VanDerWaalsContact O-CB 3.3Å; D204-L208 WeakPolarHBondContact O-CB 3.31Å; D204-L208 WeakPolarHBondContact O-CG 3.47Å; D204-L208 PolarHBondContact O-N 3.43Å; A205-L208 PolarHBondContact O-N 3.08Å; F206-L208 VanDerWaalsContact C-N 3.33Å; F206-L208 PolarHBondContact O-N 3.16Å; L208-L211 HydrophobicContact CD2-CD1 4.29Å; L208-L211 PolarHBondContact O-N 2.81Å; L208-F212 WeakPolarHBondContact O-CB 3.19Å; L208-F212 PolarHBondContact O-N 2.99Å; L208-F271 HydrophobicContact CB-CE1 4.09Å; L208-F271 HydrophobicContact CD2-CE1 4.04Å; L208-F271 HydrophobicContact CD2-CZ 4.02Å; L208-L272 HydrophobicContact CB-CD2 3.64Å; L208-L272 HydrophobicContact CD1-CD2 4.25Å; L208-F275 HydrophobicContact CD1-CB 4.12Å; L208-F275 HydrophobicContact CD1-CD1 3.8Å; L208-F275 HydrophobicContact CD1-CD2 4.35Å; L208-F275 HydrophobicContact CD1-CE1 4.26Å; L208-F275 HydrophobicContact CD1-CG 3.84Å; L208-F275 HydrophobicContact CD2-CD1 4.41Å; L208-F275 HydrophobicContact CD2-CE1 4.05Å; L208-F275 HydrophobicContact CD2-CE2 4.37Å; L208-F275 HydrophobicContact CD2-CZ 4.02Å; L208-I293 HydrophobicContact CD1-CD1 3.74Å; L208-I293 HydrophobicContact CD2-CD1 4.33Å; L208-I293 HydrophobicContact CD2-CG1 4.24Å; L208-I293 HydrophobicContact CD2-CG2 4.38Å; L208-I293 HydrophobicContact CG-CD1 4.02Å; L208-I293 HydrophobicContact CG-CG1 4.34Å; L208-I293 HydrophobicContact CG-CG2 4.05Å
209	W	93.6	Very high	89.1	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-67.1	-40.1	172.8	176	88.4	0	0	0	111.9	Y100 D178 C181 W182 A205 F206 F212 N213 V268	Y100-W209 AromaticContact CD2-CE2 3.94Å; Y100-W209 AromaticContact CD2-CZ2 3.79Å; Y100-W209 HydrophobicContact CD2-CZ2 3.79Å; Y100-W209 AromaticContact CD2-NE1 3.56Å; Y100-W209 AromaticContact CE2-NE1 3.87Å; Y100-W209 HydrophobicContact CG-CZ2 4.09Å; Y100-W209 AromaticContact CG-NE1 3.76Å; D178-W209 HydrophobicContact CB-CZ3 4.01Å; D178-W209 WeakPolarHBondContact O-CZ3 3.3Å; C181-W209 HydrophobicContact CB-CH2 3.75Å; C181-W209 HydrophobicContact CB-CZ2 4.42Å; W182-W209 HydrophobicContact CB-CE3 4.21Å; W182-W209 HydrophobicContact CB-CZ3 4.15Å; W182-W209 HydrophobicContact CE3-CB 3.72Å; W182-W209 AromaticContact CE3-CD1 3.82Å; W182-W209 AromaticContact CE3-CD2 3.69Å; W182-W209 HydrophobicContact CE3-CD2 3.69Å; W182-W209 HydrophobicContact CE3-CE3 4.17Å; W182-W209 AromaticContact CE3-CG 3.46Å; W182-W209 HydrophobicContact CE3-CG 3.46Å; W182-W209 VanDerWaalsContact CE3-CG 3.46Å; W182-W209 HydrophobicContact CH2-CB 4.34Å; W182-W209 HydrophobicContact CZ3-CB 3.54Å; W182-W209 AromaticContact CZ3-CD1 3.7Å; W182-W209 HydrophobicContact CZ3-CD2 4.29Å; W182-W209 AromaticContact CZ3-CG 3.57Å; W182-W209 HydrophobicContact CZ3-CG 3.57Å; A205-W209 VanDerWaalsContact O-CB 3.29Å; A205-W209 WeakPolarHBondContact O-CB 3.49Å; A205-W209 PolarHBondContact O-N 3.43Å; F206-W209 HydrophobicContact CD2-CE3 4.2Å; F206-W209 HydrophobicContact CE2-CE3 4.27Å; F206-W209 HydrophobicContact CE2-CZ3 4.29Å; F206-W209 PolarHBondContact O-N 2.72Å; F206-W209 VanDerWaalsContact O-N 3.16Å; W209-F212 WeakPolarHBondContact O-CB 3.4Å; W209-F212 PolarHBondContact O-N 3.38Å; W209-N213 VanDerWaalsContact CE2-ND2 3.34Å; W209-N213 VanDerWaalsContact CH2-ND2 3.27Å; W209-N213 WeakPolarHBondContact CH2-ND2 3.3Å; W209-N213 WeakPolarHBondContact CZ2-ND2 3.44Å; W209-N213 VanDerWaalsContact O-CG 3.3Å; W209-N213 PolarHBondContact O-N 3.19Å; W209-N213 PolarHBondContact O-OD1 3.04Å; W209-V268 HydrophobicContact CG-CG2 4.38Å
210	C	93.6	Very high	89.3	Confident	3 Å²	3	27.3 Å²	27.3	2%	0.02	13%	0.131	C	C	.	.	H	α-helix	trans	-63.4	-42.7	171.4	-69.3	0	0	0	0	112.4	F206 R207 F212 N213 F214 Y297 I301	F206-C210 VanDerWaalsContact CE2-SG 3.51Å; F206-C210 PolarHBondContact O-N 2.92Å; F206-C210 PolarHBondContact O-SG 2.79Å; R207-C210 WeakPolarHBondContact O-CB 3.36Å; R207-C210 PolarHBondContact O-N 3.43Å; C210-F212 VanDerWaalsContact C-N 3.33Å; C210-N213 PolarHBondContact O-N 3.45Å; C210-F214 WeakPolarHBondContact O-CB 3.42Å; C210-F214 PolarHBondContact O-N 3.5Å; C210-Y297 HydrophobicContact CB-CD2 4.17Å; C210-Y297 HydrophobicContact CB-CE2 3.62Å; C210-I301 HydrophobicContact CB-CG1 4.47Å
211	L	94.2	Very high	89.2	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.3	-38.8	174	-73.2	163.8	0	0	0	111.7	R207 L208 F214 L215 L232 V296 L300 I301	R207-L211 WeakPolarHBondContact O-CB 3.46Å; R207-L211 VanDerWaalsContact O-CG 3.27Å; R207-L211 WeakPolarHBondContact O-CG 3.45Å; R207-L211 PolarHBondContact O-N 3.2Å; L208-L211 HydrophobicContact CD2-CD1 4.29Å; L208-L211 PolarHBondContact O-N 2.81Å; L211-F214 PolarHBondContact O-N 3.44Å; L211-L215 PolarHBondContact O-N 2.95Å; L211-L232 HydrophobicContact CB-CD2 4.06Å; L211-L232 HydrophobicContact CD1-CD1 4.45Å; L211-L232 HydrophobicContact CD2-CD1 4.37Å; L211-V296 HydrophobicContact CD1-CG1 4.3Å; L211-V296 HydrophobicContact CD2-CG1 4.1Å; L211-L300 HydrophobicContact CD2-CB 3.82Å; L211-L300 HydrophobicContact CD2-CD1 3.86Å; L211-L300 HydrophobicContact CD2-CG 4.33Å; L211-I301 HydrophobicContact CD2-CD1 4.14Å; L211-I301 HydrophobicContact CD2-CG1 3.95Å; L211-I301 HydrophobicContact CG-CG1 4.29Å
212	F	93.4	Very high	89.2	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.1	-50.9	171.4	-176.1	-80.4	0	0	0	111.5	Y100 L208 W209 C210 F214 L215 S216 L222 M224 L266 V268 F271	Y100-F212 WeakPolarHBondContact OH-CE1 3.48Å; L208-F212 WeakPolarHBondContact O-CB 3.19Å; L208-F212 PolarHBondContact O-N 2.99Å; W209-F212 WeakPolarHBondContact O-CB 3.4Å; W209-F212 PolarHBondContact O-N 3.38Å; C210-F212 VanDerWaalsContact C-N 3.33Å; F212-F214 VanDerWaalsContact C-N 3.25Å; F212-F214 PolarHBondContact O-N 3.04Å; F212-L215 PolarHBondContact O-N 2.63Å; F212-S216 WeakPolarHBondContact O-CB 3.44Å; F212-S216 PolarHBondContact O-N 2.85Å; F212-S216 PolarHBondContact O-OG 3.42Å; F212-L222 HydrophobicContact CE1-CB 4.19Å; F212-L222 WeakPolarHBondContact CZ-O 3.28Å; F212-M224 HydrophobicContact CB-CE 4.08Å; F212-M224 HydrophobicContact CD2-CB 4.09Å; F212-M224 HydrophobicContact CD2-CE 3.59Å; F212-M224 HydrophobicContact CE2-CB 3.64Å; F212-M224 HydrophobicContact CE2-CE 4.33Å; F212-M224 HydrophobicContact CG-CE 4.1Å; F212-M224 HydrophobicContact CZ-CB 4.24Å; F212-L266 WeakPolarHBondContact CE2-O 3.46Å; F212-V268 HydrophobicContact CB-CG2 3.73Å; F212-V268 HydrophobicContact CD1-CB 3.61Å; F212-V268 HydrophobicContact CD1-CG2 3.66Å; F212-V268 HydrophobicContact CD2-CB 3.96Å; F212-V268 HydrophobicContact CD2-CG2 3.93Å; F212-V268 HydrophobicContact CE1-CB 3.7Å; F212-V268 HydrophobicContact CE1-CG2 4.28Å; F212-V268 HydrophobicContact CE2-CB 4.03Å; F212-V268 HydrophobicContact CE2-CG2 4.5Å; F212-V268 HydrophobicContact CG-CB 3.77Å; F212-V268 HydrophobicContact CG-CG2 3.48Å; F212-V268 VanDerWaalsContact CG-CG2 3.48Å; F212-V268 HydrophobicContact CZ-CB 3.91Å; F212-V268 VanDerWaalsContact CZ-N 3.27Å; F212-F271 HydrophobicContact CB-CD1 4.18Å; F212-F271 HydrophobicContact CB-CE1 4.35Å; F212-F271 HydrophobicContact CD2-CB 3.92Å; F212-F271 AromaticContact CD2-CD1 3.84Å; F212-F271 HydrophobicContact CD2-CD1 3.84Å; F212-F271 AromaticContact CD2-CG 3.87Å; F212-F271 HydrophobicContact CD2-CG 3.87Å; F212-F271 HydrophobicContact CE2-CB 4.15Å; F212-F271 HydrophobicContact CG-CD1 4.46Å
213	N	91.9	Very high	89.3	Confident	13 Å²	13	27 Å²	27	7%	0.07	13%	0.131	C	C	.	.	H	α-helix	trans	-58.1	-40.9	178.6	-69.8	-5.1	0	0	0	111.3	K96 S97 Y100 W209 C210 S216	K96-N213 WeakPolarHBondContact CD-O 3.28Å; S97-N213 PolarHBondContact OG-ND2 3.47Å; Y100-N213 WeakPolarHBondContact CE2-OD1 3.26Å; W209-N213 VanDerWaalsContact CE2-ND2 3.34Å; W209-N213 VanDerWaalsContact CH2-ND2 3.27Å; W209-N213 WeakPolarHBondContact CH2-ND2 3.3Å; W209-N213 WeakPolarHBondContact CZ2-ND2 3.44Å; W209-N213 VanDerWaalsContact O-CG 3.3Å; W209-N213 PolarHBondContact O-N 3.19Å; W209-N213 PolarHBondContact O-OD1 3.04Å; C210-N213 PolarHBondContact O-N 3.45Å; N213-S216 PolarHBondContact O-OG 3.44Å
214	F	91.9	Very high	89.3	Confident	34 Å²	34	23 Å²	23	15%	0.149	11%	0.112	C	C	.	.	H	α-helix	trans	-63.8	-47.6	176.4	178.7	-99.1	0	0	0	113	C210 L211 F212 L300 I301 H409 K410 K413	C210-F214 WeakPolarHBondContact O-CB 3.42Å; C210-F214 PolarHBondContact O-N 3.5Å; L211-F214 PolarHBondContact O-N 3.44Å; F212-F214 VanDerWaalsContact C-N 3.25Å; F212-F214 PolarHBondContact O-N 3.04Å; F214-L300 HydrophobicContact CD1-CB 4.44Å; F214-L300 HydrophobicContact CE1-CB 4.29Å; F214-I301 HydrophobicContact CB-CD1 3.42Å; F214-I301 VanDerWaalsContact CB-CD1 3.42Å; F214-I301 HydrophobicContact CD1-CD1 4.4Å; F214-I301 HydrophobicContact CD2-CD1 4.15Å; F214-I301 HydrophobicContact CG-CD1 3.76Å; F214-H409 HydrophobicContact CE1-CB 4.48Å; F214-H409 HydrophobicContact CZ-CB 3.98Å; F214-K410 HydrophobicContact CE2-CG 3.74Å; F214-K410 HydrophobicContact CZ-CG 4.22Å; F214-K413 WeakPolarHBondContact O-CD 3.36Å; F214-K413 WeakPolarHBondContact O-CE 3.49Å; F214-K413 PolarHBondContact O-NZ 3.19Å
215	L	91.7	Very high	89.2	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-82.4	-24.6	-177.7	-67.1	-176.7	0	0	0	114.5	L211 F212 M224 E228 Y231 L232 K413	L211-L215 PolarHBondContact O-N 2.95Å; F212-L215 PolarHBondContact O-N 2.63Å; L215-M224 HydrophobicContact CB-CE 4.01Å; L215-M224 HydrophobicContact CB-CG 4.27Å; L215-M224 HydrophobicContact CB-SD 4.16Å; L215-M224 HydrophobicContact CD1-CE 4.27Å; L215-M224 HydrophobicContact CD1-SD 4.17Å; L215-E228 HydrophobicContact CB-CB 4.38Å; L215-Y231 HydrophobicContact CD1-CD1 4.2Å; L215-Y231 HydrophobicContact CD2-CD1 4.35Å; L215-Y231 HydrophobicContact CD2-CE1 4.3Å; L215-L232 HydrophobicContact CD1-CB 3.69Å; L215-L232 HydrophobicContact CD1-CD1 4.31Å; L215-L232 HydrophobicContact CD1-CD2 3.85Å; L215-L232 HydrophobicContact CD1-CG 4.16Å; L215-K413 HydrophobicContact CD2-CG 4.43Å; L215-K413 WeakPolarHBondContact O-CE 3.45Å; L215-K413 PolarHBondContact O-NZ 3.08Å; L215-K413 VanDerWaalsContact O-NZ 3.14Å
216	S	90.6	Very high	88.8	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	-52.1	152.1	-179.1	64.4	0	0	0	0	113.8	K96 F212 N213 I223 K413	K96-S216 WeakPolarHBondContact CD-OG 3.32Å; K96-S216 PolarHBondContact NZ-O 3.4Å; K96-S216 PolarHBondContact NZ-OG 3.11Å; F212-S216 WeakPolarHBondContact O-CB 3.44Å; F212-S216 PolarHBondContact O-N 2.85Å; F212-S216 PolarHBondContact O-OG 3.42Å; N213-S216 PolarHBondContact O-OG 3.44Å; S216-I223 WeakPolarHBondContact CA-O 3.31Å; S216-I223 WeakPolarHBondContact CB-O 3.26Å; S216-K413 PolarHBondContact O-NZ 2.85Å
217	E	86.6	Confident	88.5	Confident	18 Å²	18	29.6 Å²	29.6	8%	0.084	15%	0.152	C	C	.	.			trans	-66.7	167.2	168.8	-72.1	-62.9	150.8	0	0	111.5	K96 K219 L222 I223 V225 R417 R420	K96-E217 PolarHBondContact NZ-O 3.39Å; E217-K219 VanDerWaalsContact C-N 3.29Å; E217-L222 VanDerWaalsContact O-CD2 3.29Å; E217-L222 WeakPolarHBondContact O-CD2 3.37Å; E217-I223 PolarHBondContact N-O 3.19Å; E217-V225 HydrophobicContact CG-CG1 3.92Å; E217-R417 IonicContact OE1-NE 2.66Å; E217-R417 IonicContact OE2-CZ 2.85Å; E217-R417 IonicContact OE2-NE 3.42Å; E217-R417 PolarHBondContact OE2-NE 3.09Å; E217-R417 IonicContact OE2-NH2 2.62Å; E217-R417 PolarHBondContact OE2-NH2 2.76Å; E217-R420 IonicContact OE1-CZ 3.13Å; E217-R420 VanDerWaalsContact OE1-CZ 3.3Å; E217-R420 IonicContact OE1-NH1 2.75Å; E217-R420 PolarHBondContact OE1-NH1 3.2Å; E217-R420 IonicContact OE1-NH2 2.72Å; E217-R420 PolarHBondContact OE1-NH2 2.88Å
218	D	83.3	Confident	88.3	Confident	51 Å²	51	28 Å²	28	27%	0.273	15%	0.146	S	C	.	.	S	Bend	trans	-95.5	18.7	-178.7	-50.1	-39.8	0	0	0	112.7	K96 R417	K96-D218 VanDerWaalsContact CE-OD1 3.23Å; K96-D218 WeakPolarHBondContact CE-OD1 3.44Å; K96-D218 IonicContact NZ-OD1 2.67Å; K96-D218 PolarHBondContact NZ-OD1 3.08Å; D218-R417 IonicContact OD2-CZ 2.66Å; D218-R417 VanDerWaalsContact OD2-CZ 3.26Å; D218-R417 IonicContact OD2-NH1 3.41Å; D218-R417 PolarHBondContact OD2-NH1 3.2Å; D218-R417 IonicContact OD2-NH2 2.78Å; D218-R417 PolarHBondContact OD2-NH2 2.94Å
219	K	80.1	Confident	88.1	Confident	156 Å²	156	28 Å²	28	68%	0.678	15%	0.146	S	C	*	.	S	Bend	trans	-101.8	145.9	176.1	-61	176.2	-175.8	172.7	0	108.3	E217 P221	E217-K219 VanDerWaalsContact C-N 3.29Å; K219-P221 CarbonylContact O-C 3.35Å
220	Y	79	Confident	87.6	Confident	44 Å²	44	30.9 Å²	30.9	17%	0.173	16%	0.159	C	C	.	.	S	Bend	trans	-113	138.9	-178.4	-68.7	-97.9	0	0	0	110.1	L70 K96 W99 L222	L70-Y220 HydrophobicContact CD1-CD2 3.19Å; L70-Y220 HydrophobicContact CD1-CE2 3.26Å; L70-Y220 HydrophobicContact CD1-CG 4.23Å; K96-Y220 WeakPolarHBondContact CG-OH 3.39Å; K96-Y220 PolarHBondContact N-OH 3.32Å; W99-Y220 HydrophobicContact CB-CD1 4.17Å; W99-Y220 HydrophobicContact CB-CE1 3.56Å; W99-Y220 AromaticContact CD1-CD1 3.69Å; W99-Y220 AromaticContact CD1-CE1 3.94Å; W99-Y220 AromaticContact CD2-CD1 3.43Å; W99-Y220 HydrophobicContact CD2-CD1 3.43Å; W99-Y220 VanDerWaalsContact CD2-CD1 3.43Å; W99-Y220 AromaticContact CD2-CE1 3.69Å; W99-Y220 HydrophobicContact CD2-CE1 3.69Å; W99-Y220 AromaticContact CE2-CD1 3.61Å; W99-Y220 AromaticContact CE3-CD1 3.95Å; W99-Y220 HydrophobicContact CE3-CD1 3.95Å; W99-Y220 HydrophobicContact CE3-CE1 4.1Å; W99-Y220 AromaticContact CG-CD1 3.51Å; W99-Y220 HydrophobicContact CG-CD1 3.51Å; W99-Y220 AromaticContact CG-CE1 3.43Å; W99-Y220 HydrophobicContact CG-CE1 3.43Å; W99-Y220 VanDerWaalsContact CG-CE1 3.43Å; W99-Y220 HydrophobicContact CZ2-CD1 4.26Å; W99-Y220 AromaticContact NE1-CD1 3.75Å; Y220-L222 HydrophobicContact CD1-CD1 4.3Å; Y220-L222 HydrophobicContact CD1-CD2 4.07Å; Y220-L222 HydrophobicContact CD1-CG 3.74Å; Y220-L222 HydrophobicContact CE1-CD1 3.76Å; Y220-L222 HydrophobicContact CE1-CD2 3.79Å; Y220-L222 HydrophobicContact CE1-CG 3.62Å; Y220-L222 HydrophobicContact CE2-CD2 4.3Å; Y220-L222 HydrophobicContact CG-CD2 4.47Å; Y220-L222 HydrophobicContact CG-CG 4.49Å
221	P	81.3	Confident	87.5	Confident	84 Å²	84	33.4 Å²	33.4	55%	0.545	17%	0.168	S	C	.	.	S	Bend	cis	-63.6	145.8	-0.3	29.3	-36.7	0	0	0	112.8	W99 K219 I223	W99-P221 HydrophobicContact CH2-CB 3.68Å; W99-P221 HydrophobicContact CZ2-CB 3.97Å; K219-P221 CarbonylContact O-C 3.35Å; P221-I223 PolarHBondContact O-N 3.02Å
222	L	86.1	Confident	87.4	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.01	17%	0.168	C	C	.	.			trans	-67.3	122.5	-174.4	-68.6	169.7	0	0	0	111	K96 W99 Y100 F212 E217 Y220	K96-L222 HydrophobicContact CB-CD1 3.69Å; K96-L222 HydrophobicContact CD-CD1 4.18Å; K96-L222 HydrophobicContact CD-CD2 3.88Å; K96-L222 HydrophobicContact CG-CD1 3.85Å; K96-L222 HydrophobicContact CG-CD2 3.98Å; W99-L222 HydrophobicContact CE3-CD1 3.82Å; W99-L222 HydrophobicContact CE3-CG 4.11Å; W99-L222 HydrophobicContact CZ3-CB 4.15Å; W99-L222 HydrophobicContact CZ3-CD1 4.19Å; W99-L222 HydrophobicContact CZ3-CG 4.15Å; Y100-L222 HydrophobicContact CD2-CD1 4.19Å; Y100-L222 HydrophobicContact CE2-CB 4.43Å; Y100-L222 HydrophobicContact CE2-CD1 3.56Å; F212-L222 HydrophobicContact CE1-CB 4.19Å; F212-L222 WeakPolarHBondContact CZ-O 3.28Å; E217-L222 VanDerWaalsContact O-CD2 3.29Å; E217-L222 WeakPolarHBondContact O-CD2 3.37Å; Y220-L222 HydrophobicContact CD1-CD1 4.3Å; Y220-L222 HydrophobicContact CD1-CD2 4.07Å; Y220-L222 HydrophobicContact CD1-CG 3.74Å; Y220-L222 HydrophobicContact CE1-CD1 3.76Å; Y220-L222 HydrophobicContact CE1-CD2 3.79Å; Y220-L222 HydrophobicContact CE1-CG 3.62Å; Y220-L222 HydrophobicContact CE2-CD2 4.3Å; Y220-L222 HydrophobicContact CG-CD2 4.47Å; Y220-L222 HydrophobicContact CG-CG 4.49Å
223	I	89.1	Confident	87	Confident	35 Å²	35	33.6 Å²	33.6	18%	0.179	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	149	177.3	56.4	171.3	0	0	0	111.1	S216 E217 P221 L266	S216-I223 WeakPolarHBondContact CA-O 3.31Å; S216-I223 WeakPolarHBondContact CB-O 3.26Å; E217-I223 PolarHBondContact N-O 3.19Å; P221-I223 PolarHBondContact O-N 3.02Å; I223-L266 CarbonylContact C-O 3.59Å; I223-L266 VanDerWaalsContact CA-O 3.31Å; I223-L266 WeakPolarHBondContact CA-O 3.27Å
224	M	88.4	Confident	86.8	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127.2	163	-161.9	-170.8	-59.1	0	0	108.3	F212 L215 E228 V229 L232 G265 L266 F271	F212-M224 HydrophobicContact CB-CE 4.08Å; F212-M224 HydrophobicContact CD2-CB 4.09Å; F212-M224 HydrophobicContact CD2-CE 3.59Å; F212-M224 HydrophobicContact CE2-CB 3.64Å; F212-M224 HydrophobicContact CE2-CE 4.33Å; F212-M224 HydrophobicContact CG-CE 4.1Å; F212-M224 HydrophobicContact CZ-CB 4.24Å; L215-M224 HydrophobicContact CB-CE 4.01Å; L215-M224 HydrophobicContact CB-CG 4.27Å; L215-M224 HydrophobicContact CB-SD 4.16Å; L215-M224 HydrophobicContact CD1-CE 4.27Å; L215-M224 HydrophobicContact CD1-SD 4.17Å; M224-E228 HydrophobicContact CG-CB 3.77Å; M224-E228 HydrophobicContact SD-CB 4.2Å; M224-V229 HydrophobicContact CB-CG2 3.9Å; M224-V229 HydrophobicContact CG-CG2 3.72Å; M224-V229 VanDerWaalsContact SD-CA 3.54Å; M224-V229 HydrophobicContact SD-CB 4.06Å; M224-V229 HydrophobicContact SD-CG2 3.46Å; M224-V229 WeakPolarHBondContact SD-CG2 3.45Å; M224-V229 PolarHBondContact SD-N 3.37Å; M224-L232 HydrophobicContact CE-CD2 4.06Å; M224-G265 WeakPolarHBondContact O-CA 3.24Å; M224-L266 PolarHBondContact N-O 3.01Å; M224-L266 PolarHBondContact O-N 2.77Å; M224-F271 HydrophobicContact CE-CD2 4.24Å; M224-F271 HydrophobicContact CE-CE1 4.46Å; M224-F271 HydrophobicContact CE-CE2 4.04Å; M224-F271 HydrophobicContact CE-CZ 4.18Å
225	V	87.5	Confident	86.7	Confident	22 Å²	22	36.8 Å²	36.8	13%	0.133	18%	0.183	C	C	.	.			trans	-75.5	152.9	176.7	-61	0	0	0	0	110.6	E217 D227 E228 V229	E217-V225 HydrophobicContact CG-CG1 3.92Å; V225-D227 VanDerWaalsContact C-N 3.33Å; V225-D227 PolarHBondContact O-N 2.89Å; V225-E228 HydrophobicContact CG2-CB 4.21Å; V225-E228 HydrophobicContact CG2-CG 3.61Å; V225-E228 PolarHBondContact O-N 2.89Å; V225-V229 PolarHBondContact O-N 2.66Å
226	P	84.1	Confident	86.6	Confident	58 Å²	58	36.8 Å²	36.8	38%	0.377	18%	0.183	S	C	.	.	H	α-helix	trans	-49.7	-46.3	-176.5	-30.4	37.1	0	0	0	114.4	E228 V229 E230	P226-E228 PolarHBondContact O-N 3.46Å; P226-E228 VanDerWaalsContact O-N 3.14Å; P226-V229 WeakPolarHBondContact O-CB 3.43Å; P226-V229 PolarHBondContact O-N 2.89Å; P226-E230 WeakPolarHBondContact O-CB 3.44Å; P226-E230 PolarHBondContact O-N 3.49Å
227	D	84.9	Confident	86.4	Confident	66 Å²	66	37.2 Å²	37.2	35%	0.353	19%	0.185	S	C	.	.	H	α-helix	trans	-53.5	-34.7	177.6	-57.6	45.3	0	0	0	113.7	V225 Y231 R420	V225-D227 VanDerWaalsContact C-N 3.33Å; V225-D227 PolarHBondContact O-N 2.89Å; D227-Y231 VanDerWaalsContact O-CB 3.3Å; D227-Y231 WeakPolarHBondContact O-CB 3.25Å; D227-Y231 PolarHBondContact O-N 3.5Å; D227-Y231 VanDerWaalsContact O-N 3.09Å; D227-R420 WeakPolarHBondContact OD2-CD 3.23Å
228	E	90.4	Very high	86.4	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-86.2	-28.9	-179.3	-56.7	-69.7	163.6	0	0	111.6	L215 M224 V225 P226 L232 R416 R420	L215-E228 HydrophobicContact CB-CB 4.38Å; M224-E228 HydrophobicContact CG-CB 3.77Å; M224-E228 HydrophobicContact SD-CB 4.2Å; V225-E228 HydrophobicContact CG2-CB 4.21Å; V225-E228 HydrophobicContact CG2-CG 3.61Å; V225-E228 PolarHBondContact O-N 2.89Å; P226-E228 PolarHBondContact O-N 3.46Å; P226-E228 VanDerWaalsContact O-N 3.14Å; E228-L232 WeakPolarHBondContact O-CB 3.32Å; E228-L232 PolarHBondContact O-N 2.83Å; E228-R416 IonicContact OE1-NE 2.65Å; E228-R416 PolarHBondContact OE1-NE 3.36Å; E228-R416 IonicContact OE2-CZ 3.97Å; E228-R416 IonicContact OE2-NE 3.69Å; E228-R416 PolarHBondContact OE2-NE 3.5Å; E228-R416 IonicContact OE2-NH2 2.68Å; E228-R416 PolarHBondContact OE2-NH2 2.92Å; E228-R420 IonicContact OE1-CZ 2.73Å; E228-R420 IonicContact OE1-NE 2.73Å; E228-R420 PolarHBondContact OE1-NE 2.96Å; E228-R420 IonicContact OE1-NH2 3.72Å; E228-R420 PolarHBondContact OE1-NH2 2.99Å
229	V	87.7	Confident	86.5	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-67.2	-47.3	171.1	-178.7	0	0	0	0	109.7	M224 V225 P226 L232 L233 L253 L266 F271	M224-V229 HydrophobicContact CB-CG2 3.9Å; M224-V229 HydrophobicContact CG-CG2 3.72Å; M224-V229 VanDerWaalsContact SD-CA 3.54Å; M224-V229 HydrophobicContact SD-CB 4.06Å; M224-V229 HydrophobicContact SD-CG2 3.46Å; M224-V229 WeakPolarHBondContact SD-CG2 3.45Å; M224-V229 PolarHBondContact SD-N 3.37Å; V225-V229 PolarHBondContact O-N 2.66Å; P226-V229 WeakPolarHBondContact O-CB 3.43Å; P226-V229 PolarHBondContact O-N 2.89Å; V229-L232 PolarHBondContact O-N 3.19Å; V229-L233 HydrophobicContact CG1-CD1 3.85Å; V229-L233 HydrophobicContact CG1-CG 4.48Å; V229-L233 WeakPolarHBondContact O-CB 3.39Å; V229-L233 WeakPolarHBondContact O-CG 3.38Å; V229-L233 PolarHBondContact O-N 3.06Å; V229-L253 HydrophobicContact CG1-CD2 3.86Å; V229-L266 HydrophobicContact CG1-CD1 4.27Å; V229-L266 HydrophobicContact CG2-CD1 4.19Å; V229-F271 HydrophobicContact CG1-CD2 4.47Å
230	E	85	Confident	86.7	Confident	60 Å²	60	33.2 Å²	33.2	28%	0.28	18%	0.18	S	C	.	.	H	α-helix	trans	-59.1	-46.1	174.8	-170.6	-151.1	139.6	0	0	111.1	P226 L232 L233 K234 L249 L253	P226-E230 WeakPolarHBondContact O-CB 3.44Å; P226-E230 PolarHBondContact O-N 3.49Å; E230-L232 PolarHBondContact O-N 2.98Å; E230-L233 PolarHBondContact O-N 2.93Å; E230-K234 HydrophobicContact CG-CD 4.22Å; E230-K234 WeakPolarHBondContact O-CB 3.27Å; E230-K234 WeakPolarHBondContact O-CG 3.45Å; E230-K234 PolarHBondContact O-N 2.97Å; E230-K234 WeakPolarHBondContact OE1-CE 3.4Å; E230-K234 IonicContact OE1-NZ 2.68Å; E230-K234 PolarHBondContact OE1-NZ 3.42Å; E230-L249 HydrophobicContact CG-CD2 4.16Å; E230-L253 HydrophobicContact CB-CD1 3.94Å; E230-L253 HydrophobicContact CG-CD1 4.16Å
231	Y	90.3	Very high	86.6	Confident	55 Å²	55	36.3 Å²	36.3	22%	0.216	21%	0.209	C	C	.	.	H	α-helix	trans	-56.8	-47.1	173.1	169.1	-100.3	0	0	0	112.2	L215 D227 K235 L300 R416	L215-Y231 HydrophobicContact CD1-CD1 4.2Å; L215-Y231 HydrophobicContact CD2-CD1 4.35Å; L215-Y231 HydrophobicContact CD2-CE1 4.3Å; D227-Y231 VanDerWaalsContact O-CB 3.3Å; D227-Y231 WeakPolarHBondContact O-CB 3.25Å; D227-Y231 PolarHBondContact O-N 3.5Å; D227-Y231 VanDerWaalsContact O-N 3.09Å; Y231-K235 WeakPolarHBondContact O-CB 3.47Å; Y231-K235 PolarHBondContact O-N 3.49Å; Y231-L300 HydrophobicContact CE1-CD1 4.31Å; Y231-R416 VanDerWaalsContact CE1-NH2 3.29Å; Y231-R416 VanDerWaalsContact CZ-NH1 3.27Å
232	L	91.3	Very high	86.2	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-68.6	-42.1	-178.7	-175.3	53.7	0	0	0	112.3	L211 L215 M224 E228 V229 E230 K235 V236 F271 V296 L300	L211-L232 HydrophobicContact CB-CD2 4.06Å; L211-L232 HydrophobicContact CD1-CD1 4.45Å; L211-L232 HydrophobicContact CD2-CD1 4.37Å; L215-L232 HydrophobicContact CD1-CB 3.69Å; L215-L232 HydrophobicContact CD1-CD1 4.31Å; L215-L232 HydrophobicContact CD1-CD2 3.85Å; L215-L232 HydrophobicContact CD1-CG 4.16Å; M224-L232 HydrophobicContact CE-CD2 4.06Å; E228-L232 WeakPolarHBondContact O-CB 3.32Å; E228-L232 PolarHBondContact O-N 2.83Å; V229-L232 PolarHBondContact O-N 3.19Å; E230-L232 PolarHBondContact O-N 2.98Å; L232-K235 PolarHBondContact O-N 3.3Å; L232-V236 HydrophobicContact CD1-CG2 4.25Å; L232-V236 WeakPolarHBondContact O-CG2 3.28Å; L232-V236 PolarHBondContact O-N 2.84Å; L232-F271 HydrophobicContact CD2-CE1 4.37Å; L232-F271 HydrophobicContact CD2-CE2 4.03Å; L232-F271 HydrophobicContact CD2-CZ 3.47Å; L232-F271 VanDerWaalsContact CD2-CZ 3.47Å; L232-F271 HydrophobicContact CG-CZ 4.46Å; L232-V296 HydrophobicContact CD1-CG1 3.71Å; L232-L300 HydrophobicContact CD1-CD1 4.3Å
233	L	86.6	Confident	85	Confident	4 Å²	4	45.5 Å²	45.5	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-61.7	-51	175.4	-74	167.3	0	0	0	110.6	V229 E230 K235 V236 L237 L249 L253 L274 F275 C280	V229-L233 HydrophobicContact CG1-CD1 3.85Å; V229-L233 HydrophobicContact CG1-CG 4.48Å; V229-L233 WeakPolarHBondContact O-CB 3.39Å; V229-L233 WeakPolarHBondContact O-CG 3.38Å; V229-L233 PolarHBondContact O-N 3.06Å; E230-L233 PolarHBondContact O-N 2.93Å; L233-K235 PolarHBondContact O-N 3.45Å; L233-V236 PolarHBondContact O-N 3.23Å; L233-L237 WeakPolarHBondContact O-CB 3.5Å; L233-L237 WeakPolarHBondContact O-CD1 3.42Å; L233-L237 WeakPolarHBondContact O-CG 3.4Å; L233-L237 PolarHBondContact O-N 3.32Å; L233-L249 HydrophobicContact CB-CD1 4.08Å; L233-L249 HydrophobicContact CD1-CD1 3.8Å; L233-L253 HydrophobicContact CD1-CD2 4.13Å; L233-L274 HydrophobicContact CD1-CD2 4.31Å; L233-F275 HydrophobicContact CD2-CE1 4.42Å; L233-F275 HydrophobicContact CD2-CE2 3.72Å; L233-F275 HydrophobicContact CD2-CZ 3.56Å; L233-C280 HydrophobicContact CD2-CB 4.37Å
234	K	86.9	Confident	83.7	Confident	61 Å²	61	46.6 Å²	46.6	27%	0.265	25%	0.254	S	S	.	.	H	α-helix	trans	-56.3	-37.4	174.4	-74.2	178.5	176.4	177.3	0	112	E230 S238 L249	E230-K234 HydrophobicContact CG-CD 4.22Å; E230-K234 WeakPolarHBondContact O-CB 3.27Å; E230-K234 WeakPolarHBondContact O-CG 3.45Å; E230-K234 PolarHBondContact O-N 2.97Å; E230-K234 WeakPolarHBondContact OE1-CE 3.4Å; E230-K234 IonicContact OE1-NZ 2.68Å; E230-K234 PolarHBondContact OE1-NZ 3.42Å; K234-S238 VanDerWaalsContact O-CB 3.32Å; K234-S238 WeakPolarHBondContact O-CB 3.32Å; K234-S238 PolarHBondContact O-N 2.9Å; K234-S238 PolarHBondContact O-OG 2.73Å; K234-L249 HydrophobicContact CD-CD2 4.35Å; K234-L249 HydrophobicContact CG-CD2 3.78Å
235	K	90	Very high	82.2	Confident	53 Å²	53	48.9 Å²	48.9	23%	0.23	27%	0.271	C	S	.	.	H	α-helix	trans	-69	-41.7	179.2	-175.3	57.3	179	173.6	0	113	Y231 L232 L233 S239 V296 E299	Y231-K235 WeakPolarHBondContact O-CB 3.47Å; Y231-K235 PolarHBondContact O-N 3.49Å; L232-K235 PolarHBondContact O-N 3.3Å; L233-K235 PolarHBondContact O-N 3.45Å; K235-S239 PolarHBondContact O-N 3.33Å; K235-V296 HydrophobicContact CG-CG1 3.94Å; K235-V296 HydrophobicContact CG-CG2 3.89Å; K235-E299 WeakPolarHBondContact CE-OE1 3.4Å; K235-E299 WeakPolarHBondContact CE-OE2 3.27Å; K235-E299 IonicContact NZ-OE1 2.75Å; K235-E299 PolarHBondContact NZ-OE1 3.14Å; K235-E299 IonicContact NZ-OE2 3.91Å; K235-E299 PolarHBondContact NZ-OE2 3.46Å
236	V	89.4	Confident	80.7	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.006	29%	0.288	C	S	.	.	H	α-helix	trans	-70.6	-39.2	175.3	172	0	0	0	0	111.6	L232 L233 S238 S239 M240 L289 A292 V296	L232-V236 HydrophobicContact CD1-CG2 4.25Å; L232-V236 WeakPolarHBondContact O-CG2 3.28Å; L232-V236 PolarHBondContact O-N 2.84Å; L233-V236 PolarHBondContact O-N 3.23Å; V236-S238 VanDerWaalsContact C-N 3.31Å; V236-S238 PolarHBondContact O-N 2.94Å; V236-S239 PolarHBondContact O-N 3.06Å; V236-S239 PolarHBondContact O-OG 3.44Å; V236-M240 HydrophobicContact CG1-CE 3.97Å; V236-M240 WeakPolarHBondContact O-CE 3.12Å; V236-M240 PolarHBondContact O-N 2.85Å; V236-L289 HydrophobicContact CG1-CD1 4.11Å; V236-A292 HydrophobicContact CG1-CB 4Å; V236-V296 HydrophobicContact CG2-CB 4.24Å; V236-V296 HydrophobicContact CG2-CG1 4.24Å; V236-V296 HydrophobicContact CG2-CG2 4Å
237	L	86.4	Confident	79.5	Confident	9 Å²	9	51.5 Å²	51.5	5%	0.047	29%	0.289	C	S	.	.	H	α-helix	trans	-64.5	-36.2	174.8	-68.6	165.3	0	0	0	112	L233 M240 S241 L242 V244 L281	L233-L237 WeakPolarHBondContact O-CB 3.5Å; L233-L237 WeakPolarHBondContact O-CD1 3.42Å; L233-L237 WeakPolarHBondContact O-CG 3.4Å; L233-L237 PolarHBondContact O-N 3.32Å; L237-M240 HydrophobicContact CD2-CE 4Å; L237-M240 PolarHBondContact O-N 3.22Å; L237-S241 PolarHBondContact O-N 3.36Å; L237-L242 HydrophobicContact CD2-CD1 4.38Å; L237-L242 PolarHBondContact O-N 3.42Å; L237-L242 VanDerWaalsContact O-N 3.12Å; L237-V244 HydrophobicContact CB-CG2 4.42Å; L237-V244 HydrophobicContact CD1-CB 3.96Å; L237-V244 HydrophobicContact CD1-CG1 4.26Å; L237-V244 HydrophobicContact CD1-CG2 3.74Å; L237-V244 HydrophobicContact CD2-CG2 3.67Å; L237-V244 HydrophobicContact CG-CG2 4.14Å; L237-L281 HydrophobicContact CD2-CD2 3.73Å
238	S	86.7	Confident	78.5	Confident	81 Å²	81	54.2 Å²	54.2	57%	0.566	30%	0.3	S	S	*	.	H	α-helix	trans	-65.2	-39.1	178.3	-62.8	0	0	0	0	113.4	K234 V236 M240 S241	K234-S238 VanDerWaalsContact O-CB 3.32Å; K234-S238 WeakPolarHBondContact O-CB 3.32Å; K234-S238 PolarHBondContact O-N 2.9Å; K234-S238 PolarHBondContact O-OG 2.73Å; V236-S238 VanDerWaalsContact C-N 3.31Å; V236-S238 PolarHBondContact O-N 2.94Å; S238-M240 VanDerWaalsContact C-N 3.29Å; S238-M240 PolarHBondContact O-N 2.88Å; S238-S241 PolarHBondContact O-N 2.92Å; S238-S241 VanDerWaalsContact O-N 3.11Å
239	S	85.8	Confident	77.1	Confident	37 Å²	37	54.6 Å²	54.6	26%	0.259	30%	0.302	S	S	.	.	H	α-helix	trans	-67.3	-31.1	175	36.1	0	0	0	0	112.1	K235 V236 S241 E295	K235-S239 PolarHBondContact O-N 3.33Å; V236-S239 PolarHBondContact O-N 3.06Å; V236-S239 PolarHBondContact O-OG 3.44Å; S239-S241 PolarHBondContact O-N 2.92Å; S239-E295 WeakPolarHBondContact CB-OE2 3.32Å
240	M	84.1	Confident	76	Confident	23 Å²	23	59.6 Å²	59.6	11%	0.113	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	0.6	172.5	-60.7	-173.1	-69.8	0	0	114	V236 L237 S238 L242 L281 V284 T288 L289 A292	V236-M240 HydrophobicContact CG1-CE 3.97Å; V236-M240 WeakPolarHBondContact O-CE 3.12Å; V236-M240 PolarHBondContact O-N 2.85Å; L237-M240 HydrophobicContact CD2-CE 4Å; L237-M240 PolarHBondContact O-N 3.22Å; S238-M240 VanDerWaalsContact C-N 3.29Å; S238-M240 PolarHBondContact O-N 2.88Å; M240-L242 HydrophobicContact CB-CD1 3.92Å; M240-L242 HydrophobicContact CB-CG 3.93Å; M240-L242 HydrophobicContact CE-CD1 4.22Å; M240-L242 PolarHBondContact O-N 2.96Å; M240-L281 HydrophobicContact CE-CD2 3.77Å; M240-V284 HydrophobicContact CE-CG1 4.16Å; M240-V284 HydrophobicContact CE-CG2 4.34Å; M240-V284 HydrophobicContact SD-CG1 3.43Å; M240-V284 WeakPolarHBondContact SD-CG1 3.44Å; M240-V284 HydrophobicContact SD-CG2 4.46Å; M240-T288 HydrophobicContact CB-CG2 4.45Å; M240-T288 HydrophobicContact CG-CG2 4.01Å; M240-T288 HydrophobicContact SD-CG2 4.01Å; M240-L289 HydrophobicContact CE-CD1 4.5Å; M240-A292 HydrophobicContact CE-CB 4.42Å; M240-A292 HydrophobicContact CG-CB 3.38Å; M240-A292 HydrophobicContact SD-CB 3.79Å
241	S	76.9	Confident	75.1	Confident	110 Å²	110	63 Å²	63	77%	0.769	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	31.1	-174.7	-54.3	0	0	0	0	113.7	L237 S238 S239	L237-S241 PolarHBondContact O-N 3.36Å; S238-S241 PolarHBondContact O-N 2.92Å; S238-S241 VanDerWaalsContact O-N 3.11Å; S239-S241 PolarHBondContact O-N 2.92Å
242	L	73.1	Confident	73.9	Confident	77 Å²	77	63 Å²	63	40%	0.403	35%	0.345	S	S	.	.			trans	-97.4	111.5	-180	-64.7	175.2	0	0	0	110.9	L237 M240 V244 V284	L237-L242 HydrophobicContact CD2-CD1 4.38Å; L237-L242 PolarHBondContact O-N 3.42Å; L237-L242 VanDerWaalsContact O-N 3.12Å; M240-L242 HydrophobicContact CB-CD1 3.92Å; M240-L242 HydrophobicContact CB-CG 3.93Å; M240-L242 HydrophobicContact CE-CD1 4.22Å; M240-L242 PolarHBondContact O-N 2.96Å; L242-V244 VanDerWaalsContact C-N 3.33Å; L242-V244 HydrophobicContact CB-CG2 4.29Å; L242-V244 PolarHBondContact O-N 3.45Å; L242-V284 HydrophobicContact CD1-CG2 3.66Å
243	E	61.5	Low	72.6	Confident	202 Å²	202	64.2 Å²	64.2	94%	0.944	35%	0.351	S	S	*	.			trans	-74.7	84.6	168.5	-66.8	-171.8	173.9	0	0	110.1
244	V	60.1	Low	71.6	Confident	57 Å²	57	66.6 Å²	66.6	35%	0.345	37%	0.371	S	S	.	.			trans	-80.6	133	174.2	176.1	0	0	0	0	110.2	L237 L242	L237-V244 HydrophobicContact CB-CG2 4.42Å; L237-V244 HydrophobicContact CD1-CB 3.96Å; L237-V244 HydrophobicContact CD1-CG1 4.26Å; L237-V244 HydrophobicContact CD1-CG2 3.74Å; L237-V244 HydrophobicContact CD2-CG2 3.67Å; L237-V244 HydrophobicContact CG-CG2 4.14Å; L242-V244 VanDerWaalsContact C-N 3.33Å; L242-V244 HydrophobicContact CB-CG2 4.29Å; L242-V244 PolarHBondContact O-N 3.45Å
245	S	57	Low	70.5	Confident	50 Å²	50	69.6 Å²	69.6	35%	0.35	39%	0.386	S	S	.	.			trans	-64.6	138.2	176.4	83.7	0	0	0	0	110.3	G247 E248 L249	S245-G247 PolarHBondContact O-N 3.36Å; S245-E248 WeakPolarHBondContact CB-OE1 3.37Å; S245-E248 PolarHBondContact O-N 3.28Å; S245-E248 VanDerWaalsContact OG-CD 3.29Å; S245-E248 WeakPolarHBondContact OG-CG 3.36Å; S245-E248 PolarHBondContact OG-N 2.98Å; S245-E248 PolarHBondContact OG-OE1 3.2Å; S245-L249 PolarHBondContact O-N 3.27Å
246	L	56.3	Low	69	Low	96 Å²	96	68.5 Å²	68.5	50%	0.503	38%	0.382	S	S	.	.	H	α-helix	trans	-61	-35.1	179.3	-88.2	77.6	0	0	0	111.5	L249 E250	L246-L249 PolarHBondContact O-N 2.92Å; L246-E250 VanDerWaalsContact O-CB 3.32Å; L246-E250 WeakPolarHBondContact O-CB 3.24Å; L246-E250 VanDerWaalsContact O-CG 3.28Å; L246-E250 WeakPolarHBondContact O-CG 3.49Å; L246-E250 PolarHBondContact O-N 3.5Å
247	G	59.5	Low	67.4	Low	39 Å²	39	69.7 Å²	69.7	40%	0.402	39%	0.392	S	S	.	.	H	α-helix	trans	-62.3	-44.9	-179.2	0	0	0	0	0	113.8	S245 L249 E250 E251	S245-G247 PolarHBondContact O-N 3.36Å; G247-L249 VanDerWaalsContact C-N 3.31Å; G247-L249 PolarHBondContact O-N 2.96Å; G247-E250 PolarHBondContact O-N 2.91Å; G247-E251 WeakPolarHBondContact O-CG 3.37Å; G247-E251 PolarHBondContact O-N 2.98Å
248	E	62.9	Low	66	Low	123 Å²	123	76.3 Å²	76.3	58%	0.575	42%	0.422	S	S	*	.	H	α-helix	trans	-63.8	-38.3	177.4	-73.5	163.2	-104.5	0	0	111.9	S245 L252	S245-E248 WeakPolarHBondContact CB-OE1 3.37Å; S245-E248 PolarHBondContact O-N 3.28Å; S245-E248 VanDerWaalsContact OG-CD 3.29Å; S245-E248 WeakPolarHBondContact OG-CG 3.36Å; S245-E248 PolarHBondContact OG-N 2.98Å; S245-E248 PolarHBondContact OG-OE1 3.2Å; E248-L252 WeakPolarHBondContact O-CB 3.5Å; E248-L252 VanDerWaalsContact O-CG 3.29Å; E248-L252 WeakPolarHBondContact O-CG 3.35Å; E248-L252 PolarHBondContact O-N 2.93Å; E248-L252 VanDerWaalsContact O-N 3.14Å
249	L	62.4	Low	64.4	Low	8 Å²	8	76 Å²	76	4%	0.042	42%	0.417	C	S	.	.	H	α-helix	trans	-69.5	-40.8	175.8	-174.1	65.3	0	0	0	111.6	E230 L233 K234 S245 L246 G247 L253	E230-L249 HydrophobicContact CG-CD2 4.16Å; L233-L249 HydrophobicContact CB-CD1 4.08Å; L233-L249 HydrophobicContact CD1-CD1 3.8Å; K234-L249 HydrophobicContact CD-CD2 4.35Å; K234-L249 HydrophobicContact CG-CD2 3.78Å; S245-L249 PolarHBondContact O-N 3.27Å; L246-L249 PolarHBondContact O-N 2.92Å; G247-L249 VanDerWaalsContact C-N 3.31Å; G247-L249 PolarHBondContact O-N 2.96Å; L249-L253 HydrophobicContact CD1-CD1 4.28Å; L249-L253 HydrophobicContact CG-CD1 4.01Å; L249-L253 VanDerWaalsContact O-CB 3.27Å; L249-L253 WeakPolarHBondContact O-CB 3.36Å; L249-L253 VanDerWaalsContact O-CG 3.22Å; L249-L253 WeakPolarHBondContact O-CG 3.37Å; L249-L253 PolarHBondContact O-N 3.38Å
250	E	63.8	Low	62.8	Low	106 Å²	106	74.6 Å²	74.6	50%	0.495	41%	0.407	S	S	.	.	H	α-helix	trans	-67.5	-38.4	177.3	-76.9	170.4	-154.3	0	0	112.1	L246 G247 A254	L246-E250 VanDerWaalsContact O-CB 3.32Å; L246-E250 WeakPolarHBondContact O-CB 3.24Å; L246-E250 VanDerWaalsContact O-CG 3.28Å; L246-E250 WeakPolarHBondContact O-CG 3.49Å; L246-E250 PolarHBondContact O-N 3.5Å; G247-E250 PolarHBondContact O-N 2.91Å; E250-A254 WeakPolarHBondContact O-CB 3.47Å; E250-A254 PolarHBondContact O-N 2.88Å
251	E	66.8	Low	61.4	Low	132 Å²	132	80.9 Å²	80.9	62%	0.617	44%	0.437	S	S	*	.	H	α-helix	trans	-67.9	-43.8	174.7	-76.3	-172.5	-177.4	0	0	112.5	G247 A254 Q255	G247-E251 WeakPolarHBondContact O-CG 3.37Å; G247-E251 PolarHBondContact O-N 2.98Å; E251-A254 PolarHBondContact O-N 2.92Å; E251-Q255 WeakPolarHBondContact O-CG 3.29Å; E251-Q255 PolarHBondContact O-N 2.66Å
252	L	63.7	Low	60.2	Low	55 Å²	55	81.4 Å²	81.4	29%	0.288	44%	0.435	S	S	.	.	H	α-helix	trans	-62.9	-43.2	175	-74.1	171.6	0	0	0	111.5	E248 A254 E256	E248-L252 WeakPolarHBondContact O-CB 3.5Å; E248-L252 VanDerWaalsContact O-CG 3.29Å; E248-L252 WeakPolarHBondContact O-CG 3.35Å; E248-L252 PolarHBondContact O-N 2.93Å; E248-L252 VanDerWaalsContact O-N 3.14Å; L252-A254 VanDerWaalsContact C-N 3.34Å; L252-E256 PolarHBondContact O-N 2.85Å
253	L	64.9	Low	59.4	Low	25 Å²	25	81.5 Å²	81.5	13%	0.131	44%	0.439	C	S	.	.	H	α-helix	trans	-68.7	-30.9	174.5	-71.6	173.7	0	0	0	112.1	V229 E230 L233 L249 A257	V229-L253 HydrophobicContact CG1-CD2 3.86Å; E230-L253 HydrophobicContact CB-CD1 3.94Å; E230-L253 HydrophobicContact CG-CD1 4.16Å; L233-L253 HydrophobicContact CD1-CD2 4.13Å; L249-L253 HydrophobicContact CD1-CD1 4.28Å; L249-L253 HydrophobicContact CG-CD1 4.01Å; L249-L253 VanDerWaalsContact O-CB 3.27Å; L249-L253 WeakPolarHBondContact O-CB 3.36Å; L249-L253 VanDerWaalsContact O-CG 3.22Å; L249-L253 WeakPolarHBondContact O-CG 3.37Å; L249-L253 PolarHBondContact O-N 3.38Å; L253-A257 WeakPolarHBondContact O-CA 3.43Å; L253-A257 WeakPolarHBondContact O-CB 3.44Å; L253-A257 PolarHBondContact O-N 2.87Å
254	A	64.9	Low	59.7	Low	54 Å²	54	74.3 Å²	74.3	45%	0.446	42%	0.419	S	S	.	.	H	α-helix	trans	-68.5	-38.8	176.3	0	0	0	0	0	112.5	E250 E251 L252 A257 Q258	E250-A254 WeakPolarHBondContact O-CB 3.47Å; E250-A254 PolarHBondContact O-N 2.88Å; E251-A254 PolarHBondContact O-N 2.92Å; L252-A254 VanDerWaalsContact C-N 3.34Å; A254-A257 PolarHBondContact O-N 3.29Å; A254-Q258 PolarHBondContact O-N 2.84Å
255	Q	63.4	Low	60.7	Low	124 Å²	124	71.6 Å²	71.6	58%	0.579	40%	0.403	S	S	*	.	H	α-helix	trans	-66.2	-43.1	176.5	-69.5	171.8	24.2	0	0	111.6	E251 A257	E251-Q255 WeakPolarHBondContact O-CG 3.29Å; E251-Q255 PolarHBondContact O-N 2.66Å; Q255-A257 VanDerWaalsContact C-N 3.34Å
256	E	59.3	Low	62	Low	30 Å²	30	69.7 Å²	69.7	14%	0.14	39%	0.389	C	S	.	.	H	α-helix	trans	-70.2	-30.2	170.5	-66.3	-77.6	153.2	0	0	111.6	L252 Q258 V259 A260 L274 R279	L252-E256 PolarHBondContact O-N 2.85Å; E256-Q258 VanDerWaalsContact C-N 3.33Å; E256-Q258 PolarHBondContact O-N 2.66Å; E256-V259 WeakPolarHBondContact O-CB 3.44Å; E256-V259 PolarHBondContact O-N 3.42Å; E256-V259 VanDerWaalsContact O-N 3.09Å; E256-A260 PolarHBondContact O-N 3.38Å; E256-L274 HydrophobicContact CG-CD1 4.36Å; E256-R279 IonicContact OE1-CZ 3.03Å; E256-R279 IonicContact OE1-NH1 2.86Å; E256-R279 PolarHBondContact OE1-NH1 2.92Å; E256-R279 IonicContact OE1-NH2 4Å; E256-R279 PolarHBondContact OE1-NH2 2.87Å
257	A	55.7	Low	63.5	Low	26 Å²	26	66.8 Å²	66.8	22%	0.215	38%	0.376	C	S	.	.	H	α-helix	trans	-71.4	-22.8	178	0	0	0	0	0	113.6	L253 A254 Q255 V259 A260 Q261	L253-A257 WeakPolarHBondContact O-CA 3.43Å; L253-A257 WeakPolarHBondContact O-CB 3.44Å; L253-A257 PolarHBondContact O-N 2.87Å; A254-A257 PolarHBondContact O-N 3.29Å; Q255-A257 VanDerWaalsContact C-N 3.34Å; A257-V259 PolarHBondContact O-N 3.36Å; A257-A260 CarbonylContact O-C 3.53Å; A257-A260 PolarHBondContact O-N 2.85Å; A257-Q261 WeakPolarHBondContact O-CB 3.24Å; A257-Q261 WeakPolarHBondContact O-CG 3.37Å; A257-Q261 PolarHBondContact O-N 3.46Å
258	Q	57.4	Low	64.8	Low	147 Å²	147	64.9 Å²	64.9	69%	0.687	36%	0.357	S	S	*	.	H	α-helix	trans	-63.8	-26.3	168.7	-108.2	172.8	-8.1	0	0	112.2	A254 E256	A254-Q258 PolarHBondContact O-N 2.84Å; E256-Q258 VanDerWaalsContact C-N 3.33Å; E256-Q258 PolarHBondContact O-N 2.66Å
259	V	52.7	Low	66	Low	75 Å²	75	62.5 Å²	62.5	46%	0.455	34%	0.343	S	S	.	.	H	α-helix	trans	-78.4	-49	166.6	-173.8	0	0	0	0	110	E256 A257 Q261 T262	E256-V259 WeakPolarHBondContact O-CB 3.44Å; E256-V259 PolarHBondContact O-N 3.42Å; E256-V259 VanDerWaalsContact O-N 3.09Å; A257-V259 PolarHBondContact O-N 3.36Å; V259-Q261 VanDerWaalsContact C-N 3.27Å; V259-Q261 PolarHBondContact O-N 2.57Å; V259-T262 PolarHBondContact O-N 3.15Å; V259-T262 PolarHBondContact O-OG1 2.87Å
260	A	52.4	Low	67	Low	7 Å²	7	64.8 Å²	64.8	6%	0.058	35%	0.354	C	S	.	.	H	α-helix	trans	-67.9	-17.5	-175.5	0	0	0	0	0	114.9	E256 A257 T262 T263 G264 L266	E256-A260 PolarHBondContact O-N 3.38Å; A257-A260 CarbonylContact O-C 3.53Å; A257-A260 PolarHBondContact O-N 2.85Å; A260-T262 PolarHBondContact O-N 3.43Å; A260-T263 CarbonylContact O-C 3.55Å; A260-T263 PolarHBondContact O-N 2.81Å; A260-T263 PolarHBondContact O-OG1 3.33Å; A260-G264 PolarHBondContact O-N 3.35Å; A260-L266 HydrophobicContact CB-CD2 4.24Å
261	Q	53.9	Low	68.1	Low	156 Å²	156	59.8 Å²	59.8	73%	0.729	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-23.4	173.1	-86.2	168.8	16.8	0	0	112.5	A257 V259	A257-Q261 WeakPolarHBondContact O-CB 3.24Å; A257-Q261 WeakPolarHBondContact O-CG 3.37Å; A257-Q261 PolarHBondContact O-N 3.46Å; V259-Q261 VanDerWaalsContact C-N 3.27Å; V259-Q261 PolarHBondContact O-N 2.57Å
262	T	51.9	Low	69.2	Low	120 Å²	120	53.5 Å²	53.5	74%	0.736	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-15.7	174.3	65.9	0	0	0	0	114	V259 A260	V259-T262 PolarHBondContact O-N 3.15Å; V259-T262 PolarHBondContact O-OG1 2.87Å; A260-T262 PolarHBondContact O-N 3.43Å
263	T	56.9	Low	70.1	Confident	79 Å²	79	55.4 Å²	55.4	49%	0.485	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.6	-9.7	-171.6	54.8	0	0	0	0	115.1	A260 G265	A260-T263 CarbonylContact O-C 3.55Å; A260-T263 PolarHBondContact O-N 2.81Å; A260-T263 PolarHBondContact O-OG1 3.33Å; T263-G265 VanDerWaalsContact C-N 3.29Å; T263-G265 PolarHBondContact O-N 2.9Å; T263-G265 PolarHBondContact OG1-O 3.02Å
264	G	67.8	Low	70.9	Confident	51 Å²	51	54.5 Å²	54.5	53%	0.526	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	76	6.6	-177.2	0	0	0	0	0	115.4	A260	A260-G264 PolarHBondContact O-N 3.35Å
265	G	80.4	Confident	71.8	Confident	1 Å²	1	52 Å²	52	1%	0.01	28%	0.282	C	S	.	.	S	Bend	trans	166	173.9	-179	0	0	0	0	0	113.7	M224 T263	M224-G265 WeakPolarHBondContact O-CA 3.24Å; T263-G265 VanDerWaalsContact C-N 3.29Å; T263-G265 PolarHBondContact O-N 2.9Å; T263-G265 PolarHBondContact OG1-O 3.02Å
266	L	84	Confident	72.7	Confident	10 Å²	10	46.8 Å²	46.8	5%	0.052	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	139.3	179.4	-66.8	179	0	0	0	111.6	F212 I223 M224 V229 A260 Q270	F212-L266 WeakPolarHBondContact CE2-O 3.46Å; I223-L266 CarbonylContact C-O 3.59Å; I223-L266 VanDerWaalsContact CA-O 3.31Å; I223-L266 WeakPolarHBondContact CA-O 3.27Å; M224-L266 PolarHBondContact N-O 3.01Å; M224-L266 PolarHBondContact O-N 2.77Å; V229-L266 HydrophobicContact CG1-CD1 4.27Å; V229-L266 HydrophobicContact CG2-CD1 4.19Å; A260-L266 HydrophobicContact CB-CD2 4.24Å; L266-Q270 HydrophobicContact CD2-CB 4.24Å
267	S	87.9	Confident	73.6	Confident	34 Å²	34	47.5 Å²	47.5	24%	0.238	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	161.7	167.6	71.7	0	0	0	0	111.8	W269 Q270 F271	S267-W269 PolarHBondContact O-N 2.88Å; S267-Q270 PolarHBondContact O-N 3.2Å; S267-Q270 PolarHBondContact OG-OE1 3.42Å; S267-F271 WeakPolarHBondContact O-CB 3.31Å; S267-F271 PolarHBondContact O-N 3.24Å
268	V	88.4	Confident	74.4	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.2	-29.6	-177.9	75.2	0	0	0	0	113.8	Y100 W209 F212 F271 L272	Y100-V268 HydrophobicContact CD1-CG1 4.49Å; Y100-V268 HydrophobicContact CE1-CG1 3.51Å; Y100-V268 WeakPolarHBondContact OH-CG1 3.49Å; W209-V268 HydrophobicContact CG-CG2 4.38Å; F212-V268 HydrophobicContact CB-CG2 3.73Å; F212-V268 HydrophobicContact CD1-CB 3.61Å; F212-V268 HydrophobicContact CD1-CG2 3.66Å; F212-V268 HydrophobicContact CD2-CB 3.96Å; F212-V268 HydrophobicContact CD2-CG2 3.93Å; F212-V268 HydrophobicContact CE1-CB 3.7Å; F212-V268 HydrophobicContact CE1-CG2 4.28Å; F212-V268 HydrophobicContact CE2-CB 4.03Å; F212-V268 HydrophobicContact CE2-CG2 4.5Å; F212-V268 HydrophobicContact CG-CB 3.77Å; F212-V268 HydrophobicContact CG-CG2 3.48Å; F212-V268 VanDerWaalsContact CG-CG2 3.48Å; F212-V268 HydrophobicContact CZ-CB 3.91Å; F212-V268 VanDerWaalsContact CZ-N 3.27Å; V268-F271 PolarHBondContact O-N 3.45Å; V268-L272 HydrophobicContact CG2-CD1 4.26Å; V268-L272 HydrophobicContact CG2-CG 4.46Å; V268-L272 WeakPolarHBondContact O-CB 3.48Å; V268-L272 VanDerWaalsContact O-CG 3.3Å; V268-L272 WeakPolarHBondContact O-CG 3.36Å; V268-L272 PolarHBondContact O-N 3.49Å
269	W	86.8	Confident	74.9	Confident	72 Å²	72	45.8 Å²	45.8	27%	0.273	25%	0.253	S	S	.	.	H	α-helix	trans	-73.4	-42.8	179.8	-49.6	119.2	0	0	0	111.4	Y100 W182 T185 N189 S267 F271 L272 E273	Y100-W269 HydrophobicContact CD1-CZ2 4.12Å; Y100-W269 HydrophobicContact CE1-CZ2 4.19Å; W182-W269 HydrophobicContact CZ3-CZ3 4.44Å; T185-W269 HydrophobicContact CG2-CH2 3.55Å; T185-W269 HydrophobicContact CG2-CZ2 3.6Å; N189-W269 HydrophobicContact CB-CD2 4.16Å; N189-W269 HydrophobicContact CB-CE3 4.19Å; N189-W269 HydrophobicContact CB-CH2 3.62Å; N189-W269 HydrophobicContact CB-CZ2 3.52Å; N189-W269 HydrophobicContact CB-CZ3 3.94Å; S267-W269 PolarHBondContact O-N 2.88Å; W269-F271 VanDerWaalsContact C-N 3.33Å; W269-L272 HydrophobicContact CE3-CD1 4.24Å; W269-L272 HydrophobicContact CZ3-CD1 4.18Å; W269-L272 PolarHBondContact O-N 2.88Å; W269-E273 VanDerWaalsContact O-CB 3.31Å; W269-E273 WeakPolarHBondContact O-CB 3.39Å; W269-E273 PolarHBondContact O-N 3.47Å
270	Q	84.7	Confident	75.5	Confident	57 Å²	57	43 Å²	43	27%	0.266	24%	0.237	S	C	.	.	H	α-helix	trans	-64.1	-39.9	171.9	-66.1	160.4	-66	0	0	111.3	L266 S267 E273 L274	L266-Q270 HydrophobicContact CD2-CB 4.24Å; S267-Q270 PolarHBondContact O-N 3.2Å; S267-Q270 PolarHBondContact OG-OE1 3.42Å; Q270-E273 PolarHBondContact O-N 3.15Å; Q270-L274 PolarHBondContact O-N 3.17Å
271	F	87.3	Confident	76.3	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.5	-43.9	177.2	174.3	-101.8	0	0	0	112.7	L208 F212 M224 V229 L232 S267 V268 W269 L274 F275	L208-F271 HydrophobicContact CB-CE1 4.09Å; L208-F271 HydrophobicContact CD2-CE1 4.04Å; L208-F271 HydrophobicContact CD2-CZ 4.02Å; F212-F271 HydrophobicContact CB-CD1 4.18Å; F212-F271 HydrophobicContact CB-CE1 4.35Å; F212-F271 HydrophobicContact CD2-CB 3.92Å; F212-F271 AromaticContact CD2-CD1 3.84Å; F212-F271 HydrophobicContact CD2-CD1 3.84Å; F212-F271 AromaticContact CD2-CG 3.87Å; F212-F271 HydrophobicContact CD2-CG 3.87Å; F212-F271 HydrophobicContact CE2-CB 4.15Å; F212-F271 HydrophobicContact CG-CD1 4.46Å; M224-F271 HydrophobicContact CE-CD2 4.24Å; M224-F271 HydrophobicContact CE-CE1 4.46Å; M224-F271 HydrophobicContact CE-CE2 4.04Å; M224-F271 HydrophobicContact CE-CZ 4.18Å; V229-F271 HydrophobicContact CG1-CD2 4.47Å; L232-F271 HydrophobicContact CD2-CE1 4.37Å; L232-F271 HydrophobicContact CD2-CE2 4.03Å; L232-F271 HydrophobicContact CD2-CZ 3.47Å; L232-F271 VanDerWaalsContact CD2-CZ 3.47Å; L232-F271 HydrophobicContact CG-CZ 4.46Å; S267-F271 WeakPolarHBondContact O-CB 3.31Å; S267-F271 PolarHBondContact O-N 3.24Å; V268-F271 PolarHBondContact O-N 3.45Å; W269-F271 VanDerWaalsContact C-N 3.33Å; F271-L274 PolarHBondContact O-N 3.38Å; F271-F275 HydrophobicContact CD2-CE2 4.39Å; F271-F275 HydrophobicContact CE1-CE2 4.44Å; F271-F275 HydrophobicContact CE2-CD2 4.28Å; F271-F275 AromaticContact CE2-CE2 3.6Å; F271-F275 HydrophobicContact CE2-CE2 3.6Å; F271-F275 HydrophobicContact CZ-CD2 4.23Å; F271-F275 AromaticContact CZ-CE2 3.6Å; F271-F275 HydrophobicContact CZ-CE2 3.6Å; F271-F275 HydrophobicContact CZ-CZ 4.28Å; F271-F275 WeakPolarHBondContact O-CD2 3.44Å
272	L	87.9	Confident	77	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-67.5	-36	174.2	-71.1	170.3	0	0	0	111.9	W182 Y190 L200 A205 L208 V268 W269 F275 N276	W182-L272 HydrophobicContact CH2-CD1 4Å; W182-L272 HydrophobicContact CZ3-CD1 4.2Å; Y190-L272 HydrophobicContact CD2-CB 4.48Å; Y190-L272 HydrophobicContact CD2-CD1 3.88Å; Y190-L272 HydrophobicContact CE2-CB 4.06Å; Y190-L272 HydrophobicContact CE2-CD1 4.07Å; L200-L272 HydrophobicContact CD1-CD2 4.16Å; A205-L272 HydrophobicContact CB-CD2 4.23Å; L208-L272 HydrophobicContact CB-CD2 3.64Å; L208-L272 HydrophobicContact CD1-CD2 4.25Å; V268-L272 HydrophobicContact CG2-CD1 4.26Å; V268-L272 HydrophobicContact CG2-CG 4.46Å; V268-L272 WeakPolarHBondContact O-CB 3.48Å; V268-L272 VanDerWaalsContact O-CG 3.3Å; V268-L272 WeakPolarHBondContact O-CG 3.36Å; V268-L272 PolarHBondContact O-N 3.49Å; W269-L272 HydrophobicContact CE3-CD1 4.24Å; W269-L272 HydrophobicContact CZ3-CD1 4.18Å; W269-L272 PolarHBondContact O-N 2.88Å; L272-F275 PolarHBondContact O-N 3.37Å; L272-N276 PolarHBondContact O-N 2.97Å
273	E	83.7	Confident	77.8	Confident	95 Å²	95	45.9 Å²	45.9	44%	0.444	25%	0.253	S	S	.	.	H	α-helix	trans	-67	-35.4	176.9	-168.3	53.8	-142.2	0	0	112.9	W269 Q270 F275 N276 S277	W269-E273 VanDerWaalsContact O-CB 3.31Å; W269-E273 WeakPolarHBondContact O-CB 3.39Å; W269-E273 PolarHBondContact O-N 3.47Å; Q270-E273 PolarHBondContact O-N 3.15Å; E273-F275 VanDerWaalsContact C-N 3.27Å; E273-F275 PolarHBondContact O-N 2.96Å; E273-N276 PolarHBondContact O-N 3.34Å; E273-S277 VanDerWaalsContact O-CB 3.31Å; E273-S277 WeakPolarHBondContact O-CB 3.28Å; E273-S277 PolarHBondContact O-N 3.02Å; E273-S277 PolarHBondContact O-OG 2.92Å
274	L	81.6	Confident	78.9	Confident	5 Å²	5	43.3 Å²	43.3	3%	0.026	24%	0.238	C	C	.	.	H	α-helix	trans	-58	-39.2	173.3	179.8	61.4	0	0	0	112	L233 E256 Q270 F271 S277 C280	L233-L274 HydrophobicContact CD1-CD2 4.31Å; E256-L274 HydrophobicContact CG-CD1 4.36Å; Q270-L274 PolarHBondContact O-N 3.17Å; F271-L274 PolarHBondContact O-N 3.38Å; L274-S277 PolarHBondContact O-OG 2.93Å; L274-C280 HydrophobicContact CD1-CB 4.38Å; L274-C280 HydrophobicContact CG-CB 4.5Å; L274-C280 PolarHBondContact O-SG 3.44Å; L274-C280 VanDerWaalsContact O-SG 3.32Å
275	F	83.6	Confident	79.5	Confident	1 Å²	1	42.8 Å²	42.8	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-77.6	-42.8	175	-82.4	-104.8	0	0	0	112.5	L200 L208 L233 F271 L272 E273 S277 G278 L281 L289 I293	L200-F275 HydrophobicContact CD1-CB 3.9Å; L200-F275 HydrophobicContact CD2-CB 4.16Å; L200-F275 HydrophobicContact CG-CB 4.2Å; L208-F275 HydrophobicContact CD1-CB 4.12Å; L208-F275 HydrophobicContact CD1-CD1 3.8Å; L208-F275 HydrophobicContact CD1-CD2 4.35Å; L208-F275 HydrophobicContact CD1-CE1 4.26Å; L208-F275 HydrophobicContact CD1-CG 3.84Å; L208-F275 HydrophobicContact CD2-CD1 4.41Å; L208-F275 HydrophobicContact CD2-CE1 4.05Å; L208-F275 HydrophobicContact CD2-CE2 4.37Å; L208-F275 HydrophobicContact CD2-CZ 4.02Å; L233-F275 HydrophobicContact CD2-CE1 4.42Å; L233-F275 HydrophobicContact CD2-CE2 3.72Å; L233-F275 HydrophobicContact CD2-CZ 3.56Å; F271-F275 HydrophobicContact CD2-CE2 4.39Å; F271-F275 HydrophobicContact CE1-CE2 4.44Å; F271-F275 HydrophobicContact CE2-CD2 4.28Å; F271-F275 AromaticContact CE2-CE2 3.6Å; F271-F275 HydrophobicContact CE2-CE2 3.6Å; F271-F275 HydrophobicContact CZ-CD2 4.23Å; F271-F275 AromaticContact CZ-CE2 3.6Å; F271-F275 HydrophobicContact CZ-CE2 3.6Å; F271-F275 HydrophobicContact CZ-CZ 4.28Å; F271-F275 WeakPolarHBondContact O-CD2 3.44Å; L272-F275 PolarHBondContact O-N 3.37Å; E273-F275 VanDerWaalsContact C-N 3.27Å; E273-F275 PolarHBondContact O-N 2.96Å; F275-S277 VanDerWaalsContact C-N 3.35Å; F275-S277 PolarHBondContact O-N 3.37Å; F275-G278 PolarHBondContact O-N 2.93Å; F275-G278 VanDerWaalsContact O-N 3.14Å; F275-L281 HydrophobicContact CD1-CD1 3.79Å; F275-L281 HydrophobicContact CE1-CD1 4.08Å; F275-L289 HydrophobicContact CD1-CD1 4.42Å; F275-L289 HydrophobicContact CE1-CD1 4.43Å; F275-I293 HydrophobicContact CD1-CD1 4.47Å
276	N	83	Confident	79.7	Confident	16 Å²	16	48.1 Å²	48.1	9%	0.086	25%	0.252	C	S	.	.	H	α-helix	trans	-60.3	-42.3	178.3	-84.3	-20.2	0	0	0	112.8	Y190 S198 L200 L272 E273 G278	Y190-N276 PolarHBondContact OH-ND2 2.82Å; Y190-N276 PolarHBondContact OH-OD1 3.23Å; S198-N276 PolarHBondContact OG-OD1 3.44Å; L200-N276 WeakPolarHBondContact CB-OD1 3.37Å; L200-N276 WeakPolarHBondContact CD1-OD1 3.36Å; L200-N276 VanDerWaalsContact CG-OD1 3.28Å; L200-N276 WeakPolarHBondContact CG-OD1 3.32Å; L272-N276 PolarHBondContact O-N 2.97Å; E273-N276 PolarHBondContact O-N 3.34Å; N276-G278 PolarHBondContact O-N 2.97Å; N276-G278 VanDerWaalsContact O-N 3.15Å
277	S	77.8	Confident	79.9	Confident	44 Å²	44	53.3 Å²	53.3	31%	0.308	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-8.4	178.4	63.5	0	0	0	0	114.1	E273 L274 F275 R279	E273-S277 VanDerWaalsContact O-CB 3.31Å; E273-S277 WeakPolarHBondContact O-CB 3.28Å; E273-S277 PolarHBondContact O-N 3.02Å; E273-S277 PolarHBondContact O-OG 2.92Å; L274-S277 PolarHBondContact O-OG 2.93Å; F275-S277 VanDerWaalsContact C-N 3.35Å; F275-S277 PolarHBondContact O-N 3.37Å; S277-R279 PolarHBondContact O-N 3.5Å; S277-R279 PolarHBondContact OG-NE 3.48Å
278	G	71.6	Confident	79.9	Confident	16 Å²	16	55.1 Å²	55.1	17%	0.165	29%	0.29	C	S	.	.			trans	64.7	-0.1	178.1	0	0	0	0	0	115.5	F275 N276 C280 L281 R282	F275-G278 PolarHBondContact O-N 2.93Å; F275-G278 VanDerWaalsContact O-N 3.14Å; N276-G278 PolarHBondContact O-N 2.97Å; N276-G278 VanDerWaalsContact O-N 3.15Å; G278-C280 VanDerWaalsContact C-N 3.29Å; G278-C280 PolarHBondContact O-N 2.96Å; G278-L281 CarbonylContact O-C 3.41Å; G278-L281 PolarHBondContact O-N 3.49Å; G278-R282 PolarHBondContact O-N 2.93Å
279	R	69.4	Low	79.9	Confident	121 Å²	121	55.3 Å²	55.3	46%	0.457	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-36.2	-171.3	-70.5	-178.5	-72.9	151.4	4.3	113	E256 S277 L281	E256-R279 IonicContact OE1-CZ 3.03Å; E256-R279 IonicContact OE1-NH1 2.86Å; E256-R279 PolarHBondContact OE1-NH1 2.92Å; E256-R279 IonicContact OE1-NH2 4Å; E256-R279 PolarHBondContact OE1-NH2 2.87Å; S277-R279 PolarHBondContact O-N 3.5Å; S277-R279 PolarHBondContact OG-NE 3.48Å; R279-L281 VanDerWaalsContact C-N 3.33Å
280	C	65.3	Low	80.1	Confident	17 Å²	17	53.2 Å²	53.2	12%	0.115	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-2.8	177.1	55.4	0	0	0	0	114.7	L233 L274 G278	L233-C280 HydrophobicContact CD2-CB 4.37Å; L274-C280 HydrophobicContact CD1-CB 4.38Å; L274-C280 HydrophobicContact CG-CB 4.5Å; L274-C280 PolarHBondContact O-SG 3.44Å; L274-C280 VanDerWaalsContact O-SG 3.32Å; G278-C280 VanDerWaalsContact C-N 3.29Å; G278-C280 PolarHBondContact O-N 2.96Å
281	L	69.3	Low	80.4	Confident	14 Å²	14	56.3 Å²	56.3	7%	0.073	30%	0.303	C	S	.	.	S	Bend	trans	-140.3	33.8	-166.1	-68.1	169.5	0	0	0	112	L237 M240 F275 G278 R279 G283 V284 L289	L237-L281 HydrophobicContact CD2-CD2 3.73Å; M240-L281 HydrophobicContact CE-CD2 3.77Å; F275-L281 HydrophobicContact CD1-CD1 3.79Å; F275-L281 HydrophobicContact CE1-CD1 4.08Å; G278-L281 CarbonylContact O-C 3.41Å; G278-L281 PolarHBondContact O-N 3.49Å; R279-L281 VanDerWaalsContact C-N 3.33Å; L281-G283 PolarHBondContact O-N 3.41Å; L281-G283 VanDerWaalsContact O-N 3.08Å; L281-V284 HydrophobicContact CB-CB 4.2Å; L281-V284 HydrophobicContact CB-CG2 4.1Å; L281-V284 HydrophobicContact CD2-CG2 4.1Å; L281-V284 WeakPolarHBondContact O-CB 3.4Å; L281-V284 WeakPolarHBondContact O-CG2 3.31Å; L281-V284 PolarHBondContact O-N 2.88Å; L281-L289 HydrophobicContact CD1-CD1 3.49Å; L281-L289 VanDerWaalsContact CD1-CD1 3.49Å; L281-L289 HydrophobicContact CD1-CD2 3.66Å; L281-L289 HydrophobicContact CD1-CG 4.2Å; L281-L289 HydrophobicContact CD2-CD1 4.5Å
282	R	68.5	Low	80.6	Confident	245 Å²	245	56.4 Å²	56.4	93%	0.925	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	110.4	-173	-168	179.6	-170.5	179.3	3.4	111.5	G278	G278-R282 PolarHBondContact O-N 2.93Å
283	G	67.4	Low	80.9	Confident	84 Å²	84	56.3 Å²	56.3	87%	0.866	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	102	-3.6	-177.7	0	0	0	0	0	114.6	L281	L281-G283 PolarHBondContact O-N 3.41Å; L281-G283 VanDerWaalsContact O-N 3.08Å
284	V	79.9	Confident	81.3	Confident	26 Å²	26	54.9 Å²	54.9	16%	0.158	30%	0.296	C	S	.	.			trans	-78.9	133.6	174.1	-179	0	0	0	0	110.4	M240 L242 L281 L289	M240-V284 HydrophobicContact CE-CG1 4.16Å; M240-V284 HydrophobicContact CE-CG2 4.34Å; M240-V284 HydrophobicContact SD-CG1 3.43Å; M240-V284 WeakPolarHBondContact SD-CG1 3.44Å; M240-V284 HydrophobicContact SD-CG2 4.46Å; L242-V284 HydrophobicContact CD1-CG2 3.66Å; L281-V284 HydrophobicContact CB-CB 4.2Å; L281-V284 HydrophobicContact CB-CG2 4.1Å; L281-V284 HydrophobicContact CD2-CG2 4.1Å; L281-V284 WeakPolarHBondContact O-CB 3.4Å; L281-V284 WeakPolarHBondContact O-CG2 3.31Å; L281-V284 PolarHBondContact O-N 2.88Å; V284-L289 HydrophobicContact CG1-CB 4.05Å
285	G	81.8	Confident	81.8	Confident	39 Å²	39	58.8 Å²	58.8	40%	0.402	31%	0.314	S	S	.	.			trans	-74.3	143.2	173.2	0	0	0	0	0	112.3	D287 T288 L289	G285-D287 VanDerWaalsContact C-N 3.28Å; G285-D287 PolarHBondContact O-N 3.24Å; G285-T288 WeakPolarHBondContact O-CB 3.46Å; G285-T288 PolarHBondContact O-N 2.62Å; G285-T288 VanDerWaalsContact O-N 3.14Å; G285-L289 PolarHBondContact O-N 3.02Å
286	R	84.4	Confident	82.3	Confident	113 Å²	113	58.8 Å²	58.8	43%	0.426	32%	0.315	S	S	.	.	H	α-helix	trans	-52.6	-42.8	-179.5	178.8	165.1	-171.6	-100.8	10.9	113.6	M199 L289 S290	M199-R286 WeakPolarHBondContact O-CD 3.49Å; M199-R286 WeakPolarHBondContact O-CG 3.5Å; M199-R286 PolarHBondContact O-NE 3.13Å; R286-L289 PolarHBondContact O-N 3.36Å; R286-S290 PolarHBondContact O-N 3.44Å
287	D	86.8	Confident	82.8	Confident	119 Å²	119	58.2 Å²	58.2	64%	0.636	31%	0.311	S	S	*	.	H	α-helix	trans	-72.4	-38.5	-177.9	-52.8	-39	0	0	0	111.2	G285 L289 S290 M291	G285-D287 VanDerWaalsContact C-N 3.28Å; G285-D287 PolarHBondContact O-N 3.24Å; D287-L289 VanDerWaalsContact C-N 3.32Å; D287-L289 PolarHBondContact O-N 2.92Å; D287-S290 PolarHBondContact O-N 3.29Å; D287-M291 WeakPolarHBondContact O-CG 3.32Å; D287-M291 PolarHBondContact O-N 3.3Å
288	T	88.4	Confident	83.5	Confident	73 Å²	73	57.2 Å²	57.2	45%	0.448	30%	0.302	S	S	.	.	H	α-helix	trans	-59.1	-42.7	171.8	-44.4	0	0	0	0	111.3	M240 G285 M291 A292	M240-T288 HydrophobicContact CB-CG2 4.45Å; M240-T288 HydrophobicContact CG-CG2 4.01Å; M240-T288 HydrophobicContact SD-CG2 4.01Å; G285-T288 WeakPolarHBondContact O-CB 3.46Å; G285-T288 PolarHBondContact O-N 2.62Å; G285-T288 VanDerWaalsContact O-N 3.14Å; T288-M291 PolarHBondContact O-N 2.88Å; T288-A292 WeakPolarHBondContact O-CB 3.31Å; T288-A292 PolarHBondContact O-N 2.93Å
289	L	88.6	Confident	84.5	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.016	30%	0.304	C	S	.	.	H	α-helix	trans	-66.2	-42.8	175.3	-179.7	58	0	0	0	112.3	M199 L200 V236 M240 F275 L281 V284 G285 R286 D287 M291 A292 I293	M199-L289 HydrophobicContact CB-CD2 4.49Å; L200-L289 HydrophobicContact CD2-CD2 4.23Å; V236-L289 HydrophobicContact CG1-CD1 4.11Å; M240-L289 HydrophobicContact CE-CD1 4.5Å; F275-L289 HydrophobicContact CD1-CD1 4.42Å; F275-L289 HydrophobicContact CE1-CD1 4.43Å; L281-L289 HydrophobicContact CD1-CD1 3.49Å; L281-L289 VanDerWaalsContact CD1-CD1 3.49Å; L281-L289 HydrophobicContact CD1-CD2 3.66Å; L281-L289 HydrophobicContact CD1-CG 4.2Å; L281-L289 HydrophobicContact CD2-CD1 4.5Å; V284-L289 HydrophobicContact CG1-CB 4.05Å; G285-L289 PolarHBondContact O-N 3.02Å; R286-L289 PolarHBondContact O-N 3.36Å; D287-L289 VanDerWaalsContact C-N 3.32Å; D287-L289 PolarHBondContact O-N 2.92Å; L289-M291 PolarHBondContact O-N 3.2Å; L289-A292 PolarHBondContact O-N 2.97Å; L289-I293 HydrophobicContact CD1-CD1 3.76Å; L289-I293 HydrophobicContact CD1-CG1 4.02Å; L289-I293 HydrophobicContact CD2-CD1 4.45Å; L289-I293 HydrophobicContact CG-CD1 3.73Å; L289-I293 HydrophobicContact CG-CG1 4.41Å; L289-I293 WeakPolarHBondContact O-CB 3.48Å; L289-I293 VanDerWaalsContact O-CG1 3.27Å; L289-I293 WeakPolarHBondContact O-CG1 3.29Å; L289-I293 PolarHBondContact O-N 3.34Å
290	S	91.2	Very high	85.5	Confident	29 Å²	29	53 Å²	53	20%	0.203	28%	0.283	C	S	.	.	H	α-helix	trans	-63.5	-40.1	176.8	-174.5	0	0	0	0	111.9	D204 R207 R286 D287 H294	D204-S290 VanDerWaalsContact CG-OG 3.27Å; D204-S290 WeakPolarHBondContact OD1-CB 3.44Å; D204-S290 PolarHBondContact OD1-OG 3.09Å; D204-S290 PolarHBondContact OD2-OG 2.92Å; R207-S290 PolarHBondContact NH1-OG 2.92Å; R286-S290 PolarHBondContact O-N 3.44Å; D287-S290 PolarHBondContact O-N 3.29Å; S290-H294 VanDerWaalsContact O-CB 3.3Å; S290-H294 WeakPolarHBondContact O-CB 3.44Å; S290-H294 PolarHBondContact O-N 2.93Å
291	M	90.9	Very high	86.7	Confident	121 Å²	121	53.6 Å²	53.6	60%	0.596	29%	0.285	S	S	*	.	H	α-helix	trans	-60.9	-49.3	172.1	-71.6	-179.8	67.6	0	0	111.5	D287 T288 L289 I293 H294 E295	D287-M291 WeakPolarHBondContact O-CG 3.32Å; D287-M291 PolarHBondContact O-N 3.3Å; T288-M291 PolarHBondContact O-N 2.88Å; L289-M291 PolarHBondContact O-N 3.2Å; M291-I293 PolarHBondContact O-N 3.43Å; M291-H294 WeakPolarHBondContact O-CA 3.46Å; M291-H294 WeakPolarHBondContact O-CB 3.34Å; M291-H294 PolarHBondContact O-N 3.33Å; M291-E295 PolarHBondContact O-N 3.07Å
292	A	91.9	Very high	87.7	Confident	2 Å²	2	55.7 Å²	55.7	2%	0.017	29%	0.294	C	S	.	.	H	α-helix	trans	-62.7	-41	-179.7	0	0	0	0	0	113.1	V236 M240 T288 L289 H294 V296	V236-A292 HydrophobicContact CG1-CB 4Å; M240-A292 HydrophobicContact CE-CB 4.42Å; M240-A292 HydrophobicContact CG-CB 3.38Å; M240-A292 HydrophobicContact SD-CB 3.79Å; T288-A292 WeakPolarHBondContact O-CB 3.31Å; T288-A292 PolarHBondContact O-N 2.93Å; L289-A292 PolarHBondContact O-N 2.97Å; A292-H294 VanDerWaalsContact C-N 3.32Å; A292-V296 WeakPolarHBondContact O-CB 3.32Å; A292-V296 VanDerWaalsContact O-CG2 3.3Å; A292-V296 WeakPolarHBondContact O-CG2 3.22Å; A292-V296 PolarHBondContact O-N 3.03Å; A292-V296 VanDerWaalsContact O-N 3.11Å
293	I	92.9	Very high	88.7	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.7	-38	172.8	-68.7	167.3	0	0	0	110.6	L200 D204 R207 L208 F275 L289 M291 Y297	L200-I293 HydrophobicContact CD2-CD1 3.71Å; D204-I293 HydrophobicContact CB-CD1 4.08Å; D204-I293 HydrophobicContact CB-CG2 4.4Å; R207-I293 HydrophobicContact CB-CG2 3.62Å; R207-I293 HydrophobicContact CG-CG2 4.46Å; L208-I293 HydrophobicContact CD1-CD1 3.74Å; L208-I293 HydrophobicContact CD2-CD1 4.33Å; L208-I293 HydrophobicContact CD2-CG1 4.24Å; L208-I293 HydrophobicContact CD2-CG2 4.38Å; L208-I293 HydrophobicContact CG-CD1 4.02Å; L208-I293 HydrophobicContact CG-CG1 4.34Å; L208-I293 HydrophobicContact CG-CG2 4.05Å; F275-I293 HydrophobicContact CD1-CD1 4.47Å; L289-I293 HydrophobicContact CD1-CD1 3.76Å; L289-I293 HydrophobicContact CD1-CG1 4.02Å; L289-I293 HydrophobicContact CD2-CD1 4.45Å; L289-I293 HydrophobicContact CG-CD1 3.73Å; L289-I293 HydrophobicContact CG-CG1 4.41Å; L289-I293 WeakPolarHBondContact O-CB 3.48Å; L289-I293 VanDerWaalsContact O-CG1 3.27Å; L289-I293 WeakPolarHBondContact O-CG1 3.29Å; L289-I293 PolarHBondContact O-N 3.34Å; M291-I293 PolarHBondContact O-N 3.43Å; I293-Y297 WeakPolarHBondContact O-CB 3.28Å; I293-Y297 PolarHBondContact O-N 2.97Å
294	H	92.8	Very high	89.9	Confident	64 Å²	64	41.9 Å²	41.9	30%	0.296	22%	0.219	S	C	.	.	H	α-helix	trans	-65.7	-46.7	177.7	-171	16.4	0	0	0	112.4	R207 S290 M291 A292 Y297 Q298	R207-H294 VanDerWaalsContact NH2-CG 3.34Å; R207-H294 PolarHBondContact NH2-ND1 3.49Å; S290-H294 VanDerWaalsContact O-CB 3.3Å; S290-H294 WeakPolarHBondContact O-CB 3.44Å; S290-H294 PolarHBondContact O-N 2.93Å; M291-H294 WeakPolarHBondContact O-CA 3.46Å; M291-H294 WeakPolarHBondContact O-CB 3.34Å; M291-H294 PolarHBondContact O-N 3.33Å; A292-H294 VanDerWaalsContact C-N 3.32Å; H294-Y297 WeakPolarHBondContact O-CB 3.32Å; H294-Y297 PolarHBondContact O-N 3.13Å; H294-Q298 VanDerWaalsContact CE1-CD 3.5Å; H294-Q298 PolarHBondContact CE1-NE2 3.33Å; H294-Q298 WeakPolarHBondContact O-CG 3.38Å; H294-Q298 PolarHBondContact O-N 3.33Å
295	E	91.8	Very high	90.6	Very high	87 Å²	87	42.1 Å²	42.1	41%	0.407	22%	0.219	S	C	.	.	H	α-helix	trans	-60.5	-47.2	177.3	-72.1	177.8	-169.3	0	0	111.5	S239 M291 Y297 Q298 E299	S239-E295 WeakPolarHBondContact CB-OE2 3.32Å; M291-E295 PolarHBondContact O-N 3.07Å; E295-Y297 VanDerWaalsContact C-N 3.3Å; E295-Y297 PolarHBondContact O-N 2.87Å; E295-Q298 PolarHBondContact O-N 3.45Å; E295-Q298 VanDerWaalsContact O-N 3.15Å; E295-E299 PolarHBondContact O-N 2.87Å
296	V	94.2	Very high	91.1	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.012	21%	0.207	C	C	.	.	H	α-helix	trans	-67.2	-32.1	179.1	175.6	0	0	0	0	111.8	L211 L232 K235 V236 A292 L300	L211-V296 HydrophobicContact CD1-CG1 4.3Å; L211-V296 HydrophobicContact CD2-CG1 4.1Å; L232-V296 HydrophobicContact CD1-CG1 3.71Å; K235-V296 HydrophobicContact CG-CG1 3.94Å; K235-V296 HydrophobicContact CG-CG2 3.89Å; V236-V296 HydrophobicContact CG2-CB 4.24Å; V236-V296 HydrophobicContact CG2-CG1 4.24Å; V236-V296 HydrophobicContact CG2-CG2 4Å; A292-V296 WeakPolarHBondContact O-CB 3.32Å; A292-V296 VanDerWaalsContact O-CG2 3.3Å; A292-V296 WeakPolarHBondContact O-CG2 3.22Å; A292-V296 PolarHBondContact O-N 3.03Å; A292-V296 VanDerWaalsContact O-N 3.11Å; V296-L300 HydrophobicContact CG1-CD1 3.71Å; V296-L300 HydrophobicContact CG1-CG 4.15Å; V296-L300 WeakPolarHBondContact O-CB 3.43Å; V296-L300 WeakPolarHBondContact O-CG 3.4Å; V296-L300 PolarHBondContact O-N 2.92Å
297	Y	94.1	Very high	91.6	Very high	4 Å²	4	38.9 Å²	38.9	2%	0.016	20%	0.198	C	C	.	.	H	α-helix	trans	-66.6	-43.6	169.6	178.2	-87.8	0	0	0	112.2	R207 C210 I293 H294 E295 E299 I301 Q302	R207-Y297 HydrophobicContact CB-CD2 3.73Å; R207-Y297 HydrophobicContact CB-CE2 4.38Å; R207-Y297 HydrophobicContact CB-CG 4.12Å; R207-Y297 HydrophobicContact CG-CD1 4.36Å; R207-Y297 HydrophobicContact CG-CD2 3.8Å; R207-Y297 HydrophobicContact CG-CE2 4.23Å; R207-Y297 HydrophobicContact CG-CG 3.87Å; C210-Y297 HydrophobicContact CB-CD2 4.17Å; C210-Y297 HydrophobicContact CB-CE2 3.62Å; I293-Y297 WeakPolarHBondContact O-CB 3.28Å; I293-Y297 PolarHBondContact O-N 2.97Å; H294-Y297 WeakPolarHBondContact O-CB 3.32Å; H294-Y297 PolarHBondContact O-N 3.13Å; E295-Y297 VanDerWaalsContact C-N 3.3Å; E295-Y297 PolarHBondContact O-N 2.87Å; Y297-E299 PolarHBondContact O-N 3.06Å; Y297-I301 HydrophobicContact CD2-CB 4.04Å; Y297-I301 HydrophobicContact CD2-CG1 3.73Å; Y297-I301 HydrophobicContact CD2-CG2 4.44Å; Y297-I301 HydrophobicContact CE2-CB 4.01Å; Y297-I301 HydrophobicContact CE2-CG1 3.99Å; Y297-I301 HydrophobicContact CE2-CG2 3.9Å; Y297-I301 HydrophobicContact CG-CB 4.35Å; Y297-I301 HydrophobicContact CG-CG1 4.28Å; Y297-I301 WeakPolarHBondContact O-CA 3.47Å; Y297-I301 VanDerWaalsContact O-CB 3.24Å; Y297-I301 WeakPolarHBondContact O-CB 3.31Å; Y297-I301 PolarHBondContact O-N 3.06Å; Y297-Q302 HydrophobicContact CD1-CG 4.43Å; Y297-Q302 HydrophobicContact CE1-CG 3.97Å; Y297-Q302 PolarHBondContact O-N 3.34Å
298	Q	91.8	Very high	92	Very high	22 Å²	22	33.8 Å²	33.8	10%	0.103	17%	0.174	C	C	.	.	H	α-helix	trans	-62.8	-42.5	177.2	-75.3	-175.6	-41	0	0	111.8	H294 E295 Q302 D303 V304	H294-Q298 VanDerWaalsContact CE1-CD 3.5Å; H294-Q298 PolarHBondContact CE1-NE2 3.33Å; H294-Q298 WeakPolarHBondContact O-CG 3.38Å; H294-Q298 PolarHBondContact O-N 3.33Å; E295-Q298 PolarHBondContact O-N 3.45Å; E295-Q298 VanDerWaalsContact O-N 3.15Å; Q298-Q302 CarbonylContact O-C 3.57Å; Q298-Q302 WeakPolarHBondContact O-CA 3.37Å; Q298-Q302 WeakPolarHBondContact O-CB 3.45Å; Q298-Q302 PolarHBondContact O-N 2.88Å; Q298-D303 PolarHBondContact O-N 3.02Å; Q298-V304 HydrophobicContact CB-CB 4.25Å; Q298-V304 HydrophobicContact CB-CG2 4.22Å; Q298-V304 WeakPolarHBondContact O-CB 3.47Å; Q298-V304 PolarHBondContact O-N 3.37Å
299	E	92.2	Very high	92.3	Very high	48 Å²	48	35 Å²	35	22%	0.224	17%	0.171	C	C	.	.	H	α-helix	trans	-66.9	-54.2	176.4	-175.8	-179.5	142.3	0	0	112.1	K235 E295 Y297 D303 H409	K235-E299 WeakPolarHBondContact CE-OE1 3.4Å; K235-E299 WeakPolarHBondContact CE-OE2 3.27Å; K235-E299 IonicContact NZ-OE1 2.75Å; K235-E299 PolarHBondContact NZ-OE1 3.14Å; K235-E299 IonicContact NZ-OE2 3.91Å; K235-E299 PolarHBondContact NZ-OE2 3.46Å; E295-E299 PolarHBondContact O-N 2.87Å; Y297-E299 PolarHBondContact O-N 3.06Å; E299-D303 WeakPolarHBondContact O-CA 3.41Å; E299-D303 PolarHBondContact O-N 3.39Å; E299-H409 VanDerWaalsContact CG-CE1 3.42Å; E299-H409 WeakPolarHBondContact CG-CE1 3.41Å; E299-H409 WeakPolarHBondContact CG-NE2 3.29Å; E299-H409 PolarHBondContact O-CD2 3.37Å; E299-H409 VanDerWaalsContact O-CD2 3.24Å; E299-H409 IonicContact OE1-CE1 3.63Å; E299-H409 PolarHBondContact OE1-CE1 3.43Å; E299-H409 IonicContact OE1-ND1 3.7Å
300	L	91.8	Very high	92.7	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-85.5	-23.7	-169.1	-58.5	-174.8	0	0	0	114.6	L211 F214 Y231 L232 V296 H409	L211-L300 HydrophobicContact CD2-CB 3.82Å; L211-L300 HydrophobicContact CD2-CD1 3.86Å; L211-L300 HydrophobicContact CD2-CG 4.33Å; F214-L300 HydrophobicContact CD1-CB 4.44Å; F214-L300 HydrophobicContact CE1-CB 4.29Å; Y231-L300 HydrophobicContact CE1-CD1 4.31Å; L232-L300 HydrophobicContact CD1-CD1 4.3Å; V296-L300 HydrophobicContact CG1-CD1 3.71Å; V296-L300 HydrophobicContact CG1-CG 4.15Å; V296-L300 WeakPolarHBondContact O-CB 3.43Å; V296-L300 WeakPolarHBondContact O-CG 3.4Å; V296-L300 PolarHBondContact O-N 2.92Å; L300-H409 HydrophobicContact CD2-CB 3.84Å; L300-H409 VanDerWaalsContact CD2-ND1 3.3Å; L300-H409 WeakPolarHBondContact CD2-ND1 3.29Å
301	I	90.6	Very high	92.8	Very high	29 Å²	29	37.4 Å²	37.4	15%	0.149	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-36.8	-174.9	-49.8	-61.7	0	0	0	112.6	C210 L211 F214 Y297	C210-I301 HydrophobicContact CB-CG1 4.47Å; L211-I301 HydrophobicContact CD2-CD1 4.14Å; L211-I301 HydrophobicContact CD2-CG1 3.95Å; L211-I301 HydrophobicContact CG-CG1 4.29Å; F214-I301 HydrophobicContact CB-CD1 3.42Å; F214-I301 VanDerWaalsContact CB-CD1 3.42Å; F214-I301 HydrophobicContact CD1-CD1 4.4Å; F214-I301 HydrophobicContact CD2-CD1 4.15Å; F214-I301 HydrophobicContact CG-CD1 3.76Å; Y297-I301 HydrophobicContact CD2-CB 4.04Å; Y297-I301 HydrophobicContact CD2-CG1 3.73Å; Y297-I301 HydrophobicContact CD2-CG2 4.44Å; Y297-I301 HydrophobicContact CE2-CB 4.01Å; Y297-I301 HydrophobicContact CE2-CG1 3.99Å; Y297-I301 HydrophobicContact CE2-CG2 3.9Å; Y297-I301 HydrophobicContact CG-CB 4.35Å; Y297-I301 HydrophobicContact CG-CG1 4.28Å; Y297-I301 WeakPolarHBondContact O-CA 3.47Å; Y297-I301 VanDerWaalsContact O-CB 3.24Å; Y297-I301 WeakPolarHBondContact O-CB 3.31Å; Y297-I301 PolarHBondContact O-N 3.06Å
302	Q	89.3	Confident	92.9	Very high	59 Å²	59	32.2 Å²	32.2	28%	0.276	15%	0.149	S	C	.	.	S	Bend	trans	-98.6	5.2	177.1	-61.6	-177.3	-19.7	0	0	113.4	E175 Y297 Q298 V304 Q328	E175-Q302 PolarHBondContact OE2-NE2 2.86Å; Y297-Q302 HydrophobicContact CD1-CG 4.43Å; Y297-Q302 HydrophobicContact CE1-CG 3.97Å; Y297-Q302 PolarHBondContact O-N 3.34Å; Q298-Q302 CarbonylContact O-C 3.57Å; Q298-Q302 WeakPolarHBondContact O-CA 3.37Å; Q298-Q302 WeakPolarHBondContact O-CB 3.45Å; Q298-Q302 PolarHBondContact O-N 2.88Å; Q302-V304 HydrophobicContact CB-CG2 4.13Å; Q302-V304 PolarHBondContact O-N 2.91Å; Q302-Q328 PolarHBondContact O-NE2 3.46Å
303	D	90.4	Very high	93	Very high	29 Å²	29	34 Å²	34	16%	0.155	16%	0.156	C	C	.	.			trans	52.4	33.2	-179.9	-83	-62	0	0	0	113.9	Q298 E299 L305 P329 S407 H409	Q298-D303 PolarHBondContact O-N 3.02Å; E299-D303 WeakPolarHBondContact O-CA 3.41Å; E299-D303 PolarHBondContact O-N 3.39Å; D303-L305 PolarHBondContact O-N 3.41Å; D303-L305 VanDerWaalsContact O-N 3.14Å; D303-P329 HydrophobicContact CB-CG 4.03Å; D303-P329 WeakPolarHBondContact O-CD 3.41Å; D303-S407 VanDerWaalsContact CG-OG 3.29Å; D303-S407 WeakPolarHBondContact OD1-CA 3.34Å; D303-S407 WeakPolarHBondContact OD1-CB 3.27Å; D303-S407 PolarHBondContact OD1-OG 2.87Å; D303-S407 VanDerWaalsContact OD2-CB 3.25Å; D303-S407 WeakPolarHBondContact OD2-CB 3.44Å; D303-S407 PolarHBondContact OD2-OG 3.44Å; D303-H409 IonicContact OD1-CD2 3.6Å
304	V	92.8	Very high	92.7	Very high	9 Å²	9	35.5 Å²	35.5	6%	0.055	17%	0.171	C	C	.	.			trans	-78.4	98.8	177.5	-176.5	0	0	0	0	109.7	Q298 Q302 Q307 Q326 L327	Q298-V304 HydrophobicContact CB-CB 4.25Å; Q298-V304 HydrophobicContact CB-CG2 4.22Å; Q298-V304 WeakPolarHBondContact O-CB 3.47Å; Q298-V304 PolarHBondContact O-N 3.37Å; Q302-V304 HydrophobicContact CB-CG2 4.13Å; Q302-V304 PolarHBondContact O-N 2.91Å; V304-Q307 HydrophobicContact CG1-CB 4.19Å; V304-Q307 HydrophobicContact CG1-CG 4.48Å; V304-Q326 HydrophobicContact CG1-CB 4.48Å; V304-L327 CarbonylContact C-O 3.46Å
305	L	93	Very high	91.8	Very high	32 Å²	32	38.7 Å²	38.7	17%	0.168	19%	0.186	C	C	.	.			trans	-73	-29.7	-174.4	-60.3	177.9	0	0	0	113.6	D303 L327 P329 A397 L400 L408	D303-L305 PolarHBondContact O-N 3.41Å; D303-L305 VanDerWaalsContact O-N 3.14Å; L305-L327 HydrophobicContact CB-CD2 4.02Å; L305-L327 HydrophobicContact CB-CG 4.14Å; L305-L327 HydrophobicContact CD1-CD2 4.45Å; L305-L327 HydrophobicContact CD1-CG 4.41Å; L305-L327 PolarHBondContact N-O 2.88Å; L305-P329 HydrophobicContact CD1-CB 4.44Å; L305-P329 HydrophobicContact CD1-CG 4.13Å; L305-P329 HydrophobicContact CG-CG 4.39Å; L305-A397 HydrophobicContact CD1-CB 3.89Å; L305-L400 HydrophobicContact CD1-CD1 4.3Å; L305-L408 HydrophobicContact CD2-CB 3.82Å; L305-L408 HydrophobicContact CD2-CD2 3.91Å
306	K	93.6	Very high	91	Very high	32 Å²	32	42.4 Å²	42.4	14%	0.139	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.9	145.9	170.2	-174.4	164.4	166.3	70.8	0	110	L327 E389 W390 A393	K306-L327 WeakPolarHBondContact O-CB 3.39Å; K306-L327 PolarHBondContact O-N 2.9Å; K306-E389 HydrophobicContact CD-CB 4.11Å; K306-E389 IonicContact NZ-OE2 3.73Å; K306-E389 PolarHBondContact NZ-OE2 3.48Å; K306-W390 HydrophobicContact CB-CE3 4.41Å; K306-W390 HydrophobicContact CB-CZ3 4.22Å; K306-W390 HydrophobicContact CD-CD2 3.85Å; K306-W390 HydrophobicContact CD-CE3 4.08Å; K306-W390 HydrophobicContact CD-CG 4.11Å; K306-W390 VanDerWaalsContact CE-CG 3.47Å; K306-W390 HydrophobicContact CG-CD2 4.2Å; K306-W390 HydrophobicContact CG-CE3 4.16Å; K306-W390 HydrophobicContact CG-CH2 4.2Å; K306-W390 HydrophobicContact CG-CZ2 4.23Å; K306-W390 HydrophobicContact CG-CZ3 4.16Å; K306-A393 HydrophobicContact CB-CB 4.01Å; K306-A393 HydrophobicContact CD-CB 4.2Å
307	Q	94.6	Very high	90.2	Very high	51 Å²	51	52.5 Å²	52.5	24%	0.238	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	167.4	170.6	65	-171.7	-0.1	0	0	112	V304 W324 F325 Q326	V304-Q307 HydrophobicContact CG1-CB 4.19Å; V304-Q307 HydrophobicContact CG1-CG 4.48Å; Q307-W324 HydrophobicContact CB-CZ2 3.78Å; Q307-W324 HydrophobicContact CG-CH2 4.17Å; Q307-W324 HydrophobicContact CG-CZ2 3.61Å; Q307-F325 WeakPolarHBondContact CA-O 3.3Å; Q307-F325 WeakPolarHBondContact CB-O 3.37Å; Q307-Q326 HydrophobicContact CB-CG 3.88Å
308	G	94.6	Very high	89.7	Confident	12 Å²	12	60.7 Å²	60.7	12%	0.124	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	147.6	171.1	-177.2	0	0	0	0	0	114	F325	G308-F325 PolarHBondContact N-O 3.39Å; G308-F325 VanDerWaalsContact N-O 3.15Å; G308-F325 PolarHBondContact O-N 3.41Å
309	Y	95.3	Very high	89.5	Confident	99 Å²	99	64.9 Å²	64.9	39%	0.388	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	138.6	173.9	-68.6	-81.4	0	0	0	112.2	E322 R323 W324 E338	Y309-E322 HydrophobicContact CD1-CG 4.06Å; Y309-R323 WeakPolarHBondContact CA-O 3.14Å; Y309-W324 HydrophobicContact CD1-CB 4.34Å; Y309-W324 HydrophobicContact CD1-CE3 4.16Å; Y309-W324 AromaticContact CD2-CE3 3.56Å; Y309-W324 HydrophobicContact CD2-CE3 3.56Å; Y309-W324 AromaticContact CD2-CZ3 3.7Å; Y309-W324 HydrophobicContact CD2-CZ3 3.7Å; Y309-W324 HydrophobicContact CE1-CB 4.06Å; Y309-W324 HydrophobicContact CE1-CE3 4.06Å; Y309-W324 AromaticContact CE2-CE3 3.43Å; Y309-W324 HydrophobicContact CE2-CE3 3.43Å; Y309-W324 VanDerWaalsContact CE2-CE3 3.43Å; Y309-W324 AromaticContact CE2-CZ3 3.56Å; Y309-W324 HydrophobicContact CE2-CZ3 3.56Å; Y309-W324 AromaticContact CG-CE3 3.92Å; Y309-W324 HydrophobicContact CG-CE3 3.92Å; Y309-W324 HydrophobicContact CG-CZ3 4.45Å; Y309-W324 AromaticContact CZ-CE3 3.7Å; Y309-E338 HydrophobicContact CE2-CB 4.48Å; Y309-E338 VanDerWaalsContact OH-CB 3.29Å; Y309-E338 WeakPolarHBondContact OH-CB 3.36Å; Y309-E338 PolarHBondContact OH-N 2.83Å
310	L	96.1	Very high	89.4	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	147.9	169.3	-69.9	171.3	0	0	0	110.8	K312 E322 R323 F325 F368 A381 W390	L310-K312 PolarHBondContact O-N 2.93Å; L310-E322 WeakPolarHBondContact O-CA 3.33Å; L310-R323 PolarHBondContact N-O 3.13Å; L310-R323 PolarHBondContact O-N 3.23Å; L310-F325 HydrophobicContact CB-CD2 3.63Å; L310-F325 HydrophobicContact CB-CE2 3.69Å; L310-F325 HydrophobicContact CD1-CB 4.44Å; L310-F325 HydrophobicContact CD1-CD2 4Å; L310-F325 HydrophobicContact CD1-CE2 4.37Å; L310-F325 HydrophobicContact CD1-CG 4.14Å; L310-F325 HydrophobicContact CG-CD2 4.17Å; L310-F368 HydrophobicContact CD1-CE1 4.41Å; L310-F368 HydrophobicContact CD1-CZ 3.81Å; L310-F368 HydrophobicContact CD2-CE1 4.1Å; L310-F368 HydrophobicContact CD2-CZ 4.32Å; L310-A381 HydrophobicContact CD2-CB 3.87Å; L310-W390 HydrophobicContact CD1-CD2 3.84Å; L310-W390 HydrophobicContact CD1-CE3 4.22Å; L310-W390 HydrophobicContact CD1-CG 4.19Å; L310-W390 HydrophobicContact CD1-CH2 4.47Å; L310-W390 HydrophobicContact CD1-CZ2 4.1Å; L310-W390 HydrophobicContact CD2-CG 4.23Å; L310-W390 HydrophobicContact CG-CD2 4.39Å; L310-W390 HydrophobicContact CG-CZ2 4.22Å
311	W	94.4	Very high	89.5	Confident	82 Å²	82	67.1 Å²	67.1	31%	0.311	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	116.4	169.8	-72.8	77.2	0	0	0	109.3	W320 E322 M379 S380	W311-W320 HydrophobicContact CB-CE3 4.16Å; W311-W320 HydrophobicContact CE3-CB 4.05Å; W311-W320 WeakPolarHBondContact O-CZ3 3.02Å; W311-E322 HydrophobicContact CD2-CB 4.04Å; W311-E322 HydrophobicContact CE3-CB 4.3Å; W311-E322 HydrophobicContact CH2-CB 4.16Å; W311-E322 HydrophobicContact CZ2-CB 3.86Å; W311-E322 HydrophobicContact CZ2-CG 4.36Å; W311-E322 HydrophobicContact CZ3-CB 4.36Å; W311-E322 PolarHBondContact NE1-OE1 3.46Å; W311-M379 CarbonylContact O-C 3.52Å; W311-M379 VanDerWaalsContact O-CA 3.31Å; W311-M379 WeakPolarHBondContact O-CA 3.26Å; W311-S380 PolarHBondContact N-O 3.43Å; W311-S380 PolarHBondContact O-N 2.89Å
312	K	93.6	Very high	89.6	Confident	11 Å²	11	69.8 Å²	69.8	5%	0.048	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	135.3	-177.1	-168.9	-164.3	178.9	-59.6	0	111.1	L310 W320 T321 F325 Y334	L310-K312 PolarHBondContact O-N 2.93Å; K312-W320 WeakPolarHBondContact O-CA 3.39Å; K312-T321 PolarHBondContact N-O 2.94Å; K312-T321 PolarHBondContact O-N 2.99Å; K312-F325 HydrophobicContact CB-CE2 4.15Å; K312-F325 HydrophobicContact CB-CZ 3.93Å; K312-F325 HydrophobicContact CD-CZ 3.89Å; K312-F325 HydrophobicContact CG-CZ 3.91Å; K312-Y334 HydrophobicContact CD-CD1 4.49Å; K312-Y334 HydrophobicContact CD-CD2 4.36Å; K312-Y334 HydrophobicContact CD-CE1 4.33Å; K312-Y334 HydrophobicContact CD-CE2 4.22Å
313	R	92.2	Very high	89.9	Confident	41 Å²	41	70.3 Å²	70.3	16%	0.155	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	134.1	170.8	-154.7	174	-170.3	152.7	12.7	112.4	R318 W320 D362 E378	R313-R318 WeakPolarHBondContact CG-O 3.37Å; R313-R318 PolarHBondContact NE-O 2.95Å; R313-W320 HydrophobicContact CB-CD2 4.35Å; R313-W320 HydrophobicContact CB-CE3 4.1Å; R313-W320 HydrophobicContact CB-CH2 4.1Å; R313-W320 HydrophobicContact CB-CZ2 4.34Å; R313-W320 HydrophobicContact CB-CZ3 3.97Å; R313-W320 HydrophobicContact CG-CD2 4.43Å; R313-W320 HydrophobicContact CG-CZ2 4.34Å; R313-D362 IonicContact CZ-OD2 3.51Å; R313-D362 IonicContact NH1-OD2 2.67Å; R313-D362 PolarHBondContact NH1-OD2 2.81Å; R313-D362 IonicContact NH2-OD2 2.87Å; R313-D362 PolarHBondContact NH2-OD2 3.23Å; R313-E378 HydrophobicContact CB-CB 3.83Å; R313-E378 WeakPolarHBondContact CD-OE2 3.34Å; R313-E378 IonicContact CZ-OE2 3.03Å; R313-E378 PolarHBondContact N-O 2.86Å; R313-E378 IonicContact NE-OE2 2.65Å; R313-E378 IonicContact NH1-OE1 2.62Å; R313-E378 IonicContact NH1-OE2 3.04Å; R313-E378 PolarHBondContact NH1-OE2 3.34Å
314	G	86.6	Confident	90.1	Very high	30 Å²	30	69.6 Å²	69.6	31%	0.309	32%	0.318	S	S	.	.			trans	-73.6	147.8	170.5	0	0	0	0	0	111.8	R318 N319	G314-R318 WeakPolarHBondContact O-CA 3.43Å; G314-N319 PolarHBondContact N-O 2.79Å
315	H	75.4	Confident	90.3	Very high	132 Å²	132	69.2 Å²	69.2	61%	0.611	32%	0.315	S	S	*	.	S	Bend	trans	-73.1	-61.1	-178	-160.5	-119.7	0	0	0	111.8	R375	H315-R375 PolarHBondContact CD2-NE 3.04Å
316	L	75.2	Confident	90.4	Very high	164 Å²	164	68.8 Å²	68.8	86%	0.859	31%	0.313	S	S	*	.	S	Bend	trans	-80.6	-44.4	-167.7	-172.1	65.4	0	0	0	112.8
317	R	76	Confident	90.5	Very high	214 Å²	214	67.2 Å²	67.2	81%	0.808	31%	0.306	S	S	*	.	S	Bend	trans	-96.7	-0.3	-178.4	-62.2	-169.9	-178.7	-154.7	0.6	114.2	N319	R317-N319 PolarHBondContact O-N 3.27Å; R317-N319 PolarHBondContact O-OD1 2.88Å; R317-N319 VanDerWaalsContact O-OD1 3.06Å
318	R	83.3	Confident	90.4	Very high	176 Å²	176	67.8 Å²	67.8	66%	0.664	31%	0.308	S	S	*	.			trans	53.3	-3.7	-179	-69.2	-174.2	176.7	-176.9	-1.3	118.5	R313 G314	R313-R318 WeakPolarHBondContact CG-O 3.37Å; R313-R318 PolarHBondContact NE-O 2.95Å; G314-R318 WeakPolarHBondContact O-CA 3.43Å
319	N	87.8	Confident	90.2	Very high	110 Å²	110	67.6 Å²	67.6	59%	0.588	31%	0.305	S	S	*	.			trans	-52.3	148.5	172.6	-67.4	10	0	0	0	112.5	G314 R317	G314-N319 PolarHBondContact N-O 2.79Å; R317-N319 PolarHBondContact O-N 3.27Å; R317-N319 PolarHBondContact O-OD1 2.88Å; R317-N319 VanDerWaalsContact O-OD1 3.06Å
320	W	91.5	Very high	90	Very high	41 Å²	41	65.9 Å²	65.9	16%	0.155	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	131	170.8	-67.3	97.3	0	0	0	110.4	W311 K312 R313 K364 M367 E378	W311-W320 HydrophobicContact CB-CE3 4.16Å; W311-W320 HydrophobicContact CE3-CB 4.05Å; W311-W320 WeakPolarHBondContact O-CZ3 3.02Å; K312-W320 WeakPolarHBondContact O-CA 3.39Å; R313-W320 HydrophobicContact CB-CD2 4.35Å; R313-W320 HydrophobicContact CB-CE3 4.1Å; R313-W320 HydrophobicContact CB-CH2 4.1Å; R313-W320 HydrophobicContact CB-CZ2 4.34Å; R313-W320 HydrophobicContact CB-CZ3 3.97Å; R313-W320 HydrophobicContact CG-CD2 4.43Å; R313-W320 HydrophobicContact CG-CZ2 4.34Å; W320-K364 HydrophobicContact CD2-CG 3.91Å; W320-K364 HydrophobicContact CE3-CG 4.47Å; W320-K364 HydrophobicContact CG-CG 4.12Å; W320-K364 HydrophobicContact CZ2-CB 4.31Å; W320-K364 HydrophobicContact CZ2-CG 4.17Å; W320-M367 HydrophobicContact CH2-SD 3.63Å; W320-M367 HydrophobicContact CZ2-SD 3.65Å; W320-E378 HydrophobicContact CH2-CB 4.17Å
321	T	92.3	Very high	89.9	Confident	55 Å²	55	66.6 Å²	66.6	34%	0.337	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	133.4	169.6	60.3	0	0	0	0	110.2	K312	K312-T321 PolarHBondContact N-O 2.94Å; K312-T321 PolarHBondContact O-N 2.99Å
322	E	94.3	Very high	89.9	Confident	85 Å²	85	62.7 Å²	62.7	40%	0.397	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	138	168.5	-165.4	153.2	-120.7	0	0	111	Y309 L310 W311	Y309-E322 HydrophobicContact CD1-CG 4.06Å; L310-E322 WeakPolarHBondContact O-CA 3.33Å; W311-E322 HydrophobicContact CD2-CB 4.04Å; W311-E322 HydrophobicContact CE3-CB 4.3Å; W311-E322 HydrophobicContact CH2-CB 4.16Å; W311-E322 HydrophobicContact CZ2-CB 3.86Å; W311-E322 HydrophobicContact CZ2-CG 4.36Å; W311-E322 HydrophobicContact CZ3-CB 4.36Å; W311-E322 PolarHBondContact NE1-OE1 3.46Å
323	R	94.9	Very high	89.9	Confident	70 Å²	70	62.2 Å²	62.2	26%	0.264	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	147	178	-67.7	-67.1	174.1	-108.2	13.6	108.6	Y309 L310 F325 Y334 F335	Y309-R323 WeakPolarHBondContact CA-O 3.14Å; L310-R323 PolarHBondContact N-O 3.13Å; L310-R323 PolarHBondContact O-N 3.23Å; R323-F325 HydrophobicContact CB-CD2 4.23Å; R323-F325 HydrophobicContact CB-CE2 3.81Å; R323-F325 WeakPolarHBondContact O-CD2 3.29Å; R323-Y334 HydrophobicContact CB-CD2 4.45Å; R323-Y334 HydrophobicContact CG-CD2 4.18Å; R323-F335 WeakPolarHBondContact CD-O 3.29Å
324	W	95.6	Very high	90.1	Very high	15 Å²	15	62 Å²	62	6%	0.057	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	135.8	164.6	-177.2	-109.8	0	0	0	109.1	Q307 Y309 Y334 F335 E338 C340	Q307-W324 HydrophobicContact CB-CZ2 3.78Å; Q307-W324 HydrophobicContact CG-CH2 4.17Å; Q307-W324 HydrophobicContact CG-CZ2 3.61Å; Y309-W324 HydrophobicContact CD1-CB 4.34Å; Y309-W324 HydrophobicContact CD1-CE3 4.16Å; Y309-W324 AromaticContact CD2-CE3 3.56Å; Y309-W324 HydrophobicContact CD2-CE3 3.56Å; Y309-W324 AromaticContact CD2-CZ3 3.7Å; Y309-W324 HydrophobicContact CD2-CZ3 3.7Å; Y309-W324 HydrophobicContact CE1-CB 4.06Å; Y309-W324 HydrophobicContact CE1-CE3 4.06Å; Y309-W324 AromaticContact CE2-CE3 3.43Å; Y309-W324 HydrophobicContact CE2-CE3 3.43Å; Y309-W324 VanDerWaalsContact CE2-CE3 3.43Å; Y309-W324 AromaticContact CE2-CZ3 3.56Å; Y309-W324 HydrophobicContact CE2-CZ3 3.56Å; Y309-W324 AromaticContact CG-CE3 3.92Å; Y309-W324 HydrophobicContact CG-CE3 3.92Å; Y309-W324 HydrophobicContact CG-CZ3 4.45Å; Y309-W324 AromaticContact CZ-CE3 3.7Å; W324-Y334 CarbonylContact O-C 3.53Å; W324-Y334 WeakPolarHBondContact O-CA 3.23Å; W324-Y334 WeakPolarHBondContact O-CB 3.36Å; W324-F335 HydrophobicContact CB-CB 4.39Å; W324-F335 PolarHBondContact N-O 3.02Å; W324-F335 PolarHBondContact O-N 3.2Å; W324-E338 HydrophobicContact CD2-CB 3.92Å; W324-E338 HydrophobicContact CD2-CG 4.22Å; W324-E338 HydrophobicContact CE3-CB 3.95Å; W324-E338 HydrophobicContact CE3-CG 4.24Å; W324-E338 HydrophobicContact CG-CB 4.36Å; W324-E338 HydrophobicContact CH2-CB 4.31Å; W324-E338 VanDerWaalsContact CH2-CD 3.43Å; W324-E338 HydrophobicContact CH2-CG 3.69Å; W324-E338 VanDerWaalsContact CH2-OE1 3.29Å; W324-E338 WeakPolarHBondContact CH2-OE1 3.41Å; W324-E338 HydrophobicContact CZ2-CB 4.32Å; W324-E338 HydrophobicContact CZ2-CG 3.69Å; W324-E338 HydrophobicContact CZ3-CB 4.12Å; W324-E338 HydrophobicContact CZ3-CG 3.97Å; W324-C340 VanDerWaalsContact CD1-SG 3.52Å
325	F	96.3	Very high	90.4	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	145.3	176.8	-79.9	-97	0	0	0	110.8	Q307 G308 L310 K312 R323 L332 C333 Y334 I347 M379 W390	Q307-F325 WeakPolarHBondContact CA-O 3.3Å; Q307-F325 WeakPolarHBondContact CB-O 3.37Å; G308-F325 PolarHBondContact N-O 3.39Å; G308-F325 VanDerWaalsContact N-O 3.15Å; G308-F325 PolarHBondContact O-N 3.41Å; L310-F325 HydrophobicContact CB-CD2 3.63Å; L310-F325 HydrophobicContact CB-CE2 3.69Å; L310-F325 HydrophobicContact CD1-CB 4.44Å; L310-F325 HydrophobicContact CD1-CD2 4Å; L310-F325 HydrophobicContact CD1-CE2 4.37Å; L310-F325 HydrophobicContact CD1-CG 4.14Å; L310-F325 HydrophobicContact CG-CD2 4.17Å; K312-F325 HydrophobicContact CB-CE2 4.15Å; K312-F325 HydrophobicContact CB-CZ 3.93Å; K312-F325 HydrophobicContact CD-CZ 3.89Å; K312-F325 HydrophobicContact CG-CZ 3.91Å; R323-F325 HydrophobicContact CB-CD2 4.23Å; R323-F325 HydrophobicContact CB-CE2 3.81Å; R323-F325 WeakPolarHBondContact O-CD2 3.29Å; F325-L332 HydrophobicContact CB-CD1 4.13Å; F325-L332 HydrophobicContact CD1-CD1 3.71Å; F325-L332 HydrophobicContact CD1-CD2 4.27Å; F325-L332 HydrophobicContact CD1-CG 3.81Å; F325-L332 HydrophobicContact CE1-CG 4.32Å; F325-L332 HydrophobicContact CG-CD1 4.39Å; F325-C333 WeakPolarHBondContact CA-O 3.19Å; F325-Y334 HydrophobicContact CD1-CG 4.49Å; F325-Y334 AromaticContact CE1-CD1 3.94Å; F325-Y334 HydrophobicContact CE1-CD1 3.94Å; F325-Y334 AromaticContact CE1-CG 3.98Å; F325-Y334 HydrophobicContact CE1-CG 3.98Å; F325-Y334 HydrophobicContact CZ-CD1 4.43Å; F325-Y334 HydrophobicContact CZ-CG 4.2Å; F325-I347 HydrophobicContact CE1-CD1 4.44Å; F325-M379 HydrophobicContact CD1-CE 4.01Å; F325-M379 HydrophobicContact CE1-CE 3.23Å; F325-M379 HydrophobicContact CZ-CE 3.57Å; F325-W390 HydrophobicContact CB-CH2 3.59Å; F325-W390 HydrophobicContact CB-CZ2 4.15Å; F325-W390 HydrophobicContact CB-CZ3 4.26Å
326	Q	95.2	Very high	91.2	Very high	23 Å²	23	56.6 Å²	56.6	11%	0.107	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	123.1	168.4	-70.5	-177.9	-39.5	0	0	109.1	V304 Q307 C333 F335	V304-Q326 HydrophobicContact CG1-CB 4.48Å; Q307-Q326 HydrophobicContact CB-CG 3.88Å; Q326-C333 PolarHBondContact N-O 2.72Å; Q326-C333 PolarHBondContact O-N 2.87Å; Q326-F335 HydrophobicContact CB-CE2 4.28Å; Q326-F335 HydrophobicContact CG-CE2 4.23Å
327	L	95.6	Very high	92	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	122.2	175	-179.4	66.1	0	0	0	110	V304 L305 K306 L332 L349 W390 A393 I394 A397	V304-L327 CarbonylContact C-O 3.46Å; L305-L327 HydrophobicContact CB-CD2 4.02Å; L305-L327 HydrophobicContact CB-CG 4.14Å; L305-L327 HydrophobicContact CD1-CD2 4.45Å; L305-L327 HydrophobicContact CD1-CG 4.41Å; L305-L327 PolarHBondContact N-O 2.88Å; K306-L327 WeakPolarHBondContact O-CB 3.39Å; K306-L327 PolarHBondContact O-N 2.9Å; L327-L332 HydrophobicContact CB-CD1 4.02Å; L327-L332 HydrophobicContact CD1-CB 4.03Å; L327-L332 HydrophobicContact CD1-CD1 4.18Å; L327-L349 HydrophobicContact CD1-CD1 3.5Å; L327-W390 HydrophobicContact CB-CZ3 4.18Å; L327-A393 HydrophobicContact CD2-CB 3.64Å; L327-A393 WeakPolarHBondContact CD2-O 3.3Å; L327-I394 HydrophobicContact CD1-CG1 4.13Å; L327-I394 HydrophobicContact CD2-CG1 4.02Å; L327-A397 HydrophobicContact CD1-CB 3.96Å; L327-A397 HydrophobicContact CD2-CB 4.28Å; L327-A397 HydrophobicContact CG-CB 4.3Å
328	Q	92.6	Very high	92.6	Very high	62 Å²	62	45.6 Å²	45.6	29%	0.29	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	164.8	167.4	-70.2	179.7	-45.1	0	0	109	Q302 S330 C331	Q302-Q328 PolarHBondContact O-NE2 3.46Å; Q328-S330 PolarHBondContact O-N 2.99Å; Q328-S330 VanDerWaalsContact O-N 3.08Å; Q328-C331 PolarHBondContact N-O 2.73Å; Q328-C331 PolarHBondContact O-N 2.68Å
329	P	90.6	Very high	92.5	Very high	8 Å²	8	42.6 Å²	42.6	5%	0.052	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-28.5	-171.8	-26.7	36.4	0	0	0	114.3	D303 L305 Q401 K406	D303-P329 HydrophobicContact CB-CG 4.03Å; D303-P329 WeakPolarHBondContact O-CD 3.41Å; L305-P329 HydrophobicContact CD1-CB 4.44Å; L305-P329 HydrophobicContact CD1-CG 4.13Å; L305-P329 HydrophobicContact CG-CG 4.39Å; P329-Q401 WeakPolarHBondContact O-CG 3.37Å; P329-Q401 PolarHBondContact O-NE2 2.74Å; P329-K406 WeakPolarHBondContact CG-O 3.42Å
330	S	90.7	Very high	92.3	Very high	63 Å²	63	38.9 Å²	38.9	44%	0.441	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-8.4	-177.2	57.7	0	0	0	0	114.8	Q328 L349	Q328-S330 PolarHBondContact O-N 2.99Å; Q328-S330 VanDerWaalsContact O-N 3.08Å; S330-L349 PolarHBondContact O-N 3.26Å
331	C	93.2	Very high	91.7	Very high	16 Å²	16	44.9 Å²	44.9	11%	0.108	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	153.7	177.9	68.6	0	0	0	0	113.7	Q328 I346 I347	Q328-C331 PolarHBondContact N-O 2.73Å; Q328-C331 PolarHBondContact O-N 2.68Å; C331-I346 HydrophobicContact CB-CG2 3.71Å; C331-I347 CarbonylContact C-O 3.6Å; C331-I347 VanDerWaalsContact CA-O 3.29Å; C331-I347 WeakPolarHBondContact CA-O 3.22Å; C331-I347 WeakPolarHBondContact CB-O 3.36Å
332	L	95.1	Very high	91.3	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	104.1	170.6	176	56	0	0	0	108.7	F325 L327 I347 L349 V370 M379 W390 I394	F325-L332 HydrophobicContact CB-CD1 4.13Å; F325-L332 HydrophobicContact CD1-CD1 3.71Å; F325-L332 HydrophobicContact CD1-CD2 4.27Å; F325-L332 HydrophobicContact CD1-CG 3.81Å; F325-L332 HydrophobicContact CE1-CG 4.32Å; F325-L332 HydrophobicContact CG-CD1 4.39Å; L327-L332 HydrophobicContact CB-CD1 4.02Å; L327-L332 HydrophobicContact CD1-CB 4.03Å; L327-L332 HydrophobicContact CD1-CD1 4.18Å; L332-I347 HydrophobicContact CB-CB 4.22Å; L332-I347 HydrophobicContact CD2-CD1 4.35Å; L332-I347 HydrophobicContact CG-CD1 4.45Å; L332-I347 PolarHBondContact N-O 2.92Å; L332-I347 PolarHBondContact O-N 3.22Å; L332-L349 HydrophobicContact CB-CD1 4.38Å; L332-V370 HydrophobicContact CD2-CG2 4.5Å; L332-M379 HydrophobicContact CD2-CE 3.65Å; L332-W390 HydrophobicContact CD1-CZ3 4.05Å; L332-I394 HydrophobicContact CD2-CD1 3.84Å; L332-I394 HydrophobicContact CD2-CG1 4.29Å
333	C	94.8	Very high	91.1	Very high	2 Å²	2	48 Å²	48	1%	0.014	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	152.4	-180	-68.5	0	0	0	0	111.1	F325 Q326 F335 K343	F325-C333 WeakPolarHBondContact CA-O 3.19Å; Q326-C333 PolarHBondContact N-O 2.72Å; Q326-C333 PolarHBondContact O-N 2.87Å; C333-F335 HydrophobicContact CB-CE2 3.86Å; C333-F335 HydrophobicContact CB-CZ 4.18Å; C333-K343 WeakPolarHBondContact SG-CE 3.46Å; C333-K343 PolarHBondContact SG-NZ 2.75Å
334	Y	94.4	Very high	90.9	Very high	37 Å²	37	50.1 Å²	50.1	15%	0.145	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	148	172.5	66.2	-90.7	0	0	0	113.9	K312 R323 W324 F325 R344 G345 I347	K312-Y334 HydrophobicContact CD-CD1 4.49Å; K312-Y334 HydrophobicContact CD-CD2 4.36Å; K312-Y334 HydrophobicContact CD-CE1 4.33Å; K312-Y334 HydrophobicContact CD-CE2 4.22Å; R323-Y334 HydrophobicContact CB-CD2 4.45Å; R323-Y334 HydrophobicContact CG-CD2 4.18Å; W324-Y334 CarbonylContact O-C 3.53Å; W324-Y334 WeakPolarHBondContact O-CA 3.23Å; W324-Y334 WeakPolarHBondContact O-CB 3.36Å; F325-Y334 HydrophobicContact CD1-CG 4.49Å; F325-Y334 AromaticContact CE1-CD1 3.94Å; F325-Y334 HydrophobicContact CE1-CD1 3.94Å; F325-Y334 AromaticContact CE1-CG 3.98Å; F325-Y334 HydrophobicContact CE1-CG 3.98Å; F325-Y334 HydrophobicContact CZ-CD1 4.43Å; F325-Y334 HydrophobicContact CZ-CG 4.2Å; Y334-R344 HydrophobicContact CD2-CB 3.66Å; Y334-R344 HydrophobicContact CE2-CB 3.59Å; Y334-R344 WeakPolarHBondContact CE2-O 3.5Å; Y334-R344 VanDerWaalsContact CZ-O 3.31Å; Y334-R344 WeakPolarHBondContact O-CA 3.49Å; Y334-R344 PolarHBondContact O-N 2.8Å; Y334-R344 PolarHBondContact OH-O 2.78Å; Y334-R344 VanDerWaalsContact OH-O 3.08Å; Y334-G345 PolarHBondContact N-O 2.93Å; Y334-G345 VanDerWaalsContact N-O 3.07Å; Y334-G345 PolarHBondContact O-N 2.91Å; Y334-I347 HydrophobicContact CE1-CG1 4.43Å
335	F	94.8	Very high	90.7	Very high	17 Å²	17	50.3 Å²	50.3	8%	0.075	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	168.7	-166.7	-58.1	-91.8	0	0	0	111.1	R323 W324 Q326 C333 S337 C340 K343	R323-F335 WeakPolarHBondContact CD-O 3.29Å; W324-F335 HydrophobicContact CB-CB 4.39Å; W324-F335 PolarHBondContact N-O 3.02Å; W324-F335 PolarHBondContact O-N 3.2Å; Q326-F335 HydrophobicContact CB-CE2 4.28Å; Q326-F335 HydrophobicContact CG-CE2 4.23Å; C333-F335 HydrophobicContact CB-CE2 3.86Å; C333-F335 HydrophobicContact CB-CZ 4.18Å; F335-S337 VanDerWaalsContact C-N 3.35Å; F335-C340 HydrophobicContact CD1-CB 3.78Å; F335-C340 WeakPolarHBondContact CD1-O 3.47Å; F335-C340 HydrophobicContact CD2-CB 4.38Å; F335-C340 HydrophobicContact CE1-CB 3.79Å; F335-C340 WeakPolarHBondContact CE1-O 3.37Å; F335-C340 HydrophobicContact CE2-CB 4.39Å; F335-C340 HydrophobicContact CG-CB 4.07Å; F335-C340 HydrophobicContact CZ-CB 4.11Å; F335-K343 HydrophobicContact CD1-CB 4.12Å; F335-K343 HydrophobicContact CD1-CG 4.28Å; F335-K343 HydrophobicContact CE1-CB 3.83Å; F335-K343 HydrophobicContact CE1-CD 4.37Å; F335-K343 HydrophobicContact CE1-CG 3.77Å; F335-K343 HydrophobicContact CZ-CG 4.2Å
336	G	91.1	Very high	90.6	Very high	31 Å²	31	54.3 Å²	54.3	32%	0.32	28%	0.275	S	S	.	.	S	Bend	trans	-65.8	-38.8	174.4	0	0	0	0	0	113
337	S	91.4	Very high	90.5	Very high	42 Å²	42	53.2 Å²	53.2	29%	0.294	27%	0.27	S	S	.	.	S	Bend	trans	-157	173.1	-172.8	56.8	0	0	0	0	110	F335 E339 C340	F335-S337 VanDerWaalsContact C-N 3.35Å; S337-E339 VanDerWaalsContact C-N 3.32Å; S337-E339 WeakPolarHBondContact CB-OE2 3.18Å; S337-E339 PolarHBondContact O-N 3.33Å; S337-E339 PolarHBondContact OG-OE2 3.07Å; S337-C340 PolarHBondContact O-N 3Å
338	E	89.3	Confident	90.4	Very high	105 Å²	105	56.5 Å²	56.5	49%	0.491	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-27.8	-175.4	177.2	162.9	-165.7	0	0	115.1	Y309 W324 C340	Y309-E338 HydrophobicContact CE2-CB 4.48Å; Y309-E338 VanDerWaalsContact OH-CB 3.29Å; Y309-E338 WeakPolarHBondContact OH-CB 3.36Å; Y309-E338 PolarHBondContact OH-N 2.83Å; W324-E338 HydrophobicContact CD2-CB 3.92Å; W324-E338 HydrophobicContact CD2-CG 4.22Å; W324-E338 HydrophobicContact CE3-CB 3.95Å; W324-E338 HydrophobicContact CE3-CG 4.24Å; W324-E338 HydrophobicContact CG-CB 4.36Å; W324-E338 HydrophobicContact CH2-CB 4.31Å; W324-E338 VanDerWaalsContact CH2-CD 3.43Å; W324-E338 HydrophobicContact CH2-CG 3.69Å; W324-E338 VanDerWaalsContact CH2-OE1 3.29Å; W324-E338 WeakPolarHBondContact CH2-OE1 3.41Å; W324-E338 HydrophobicContact CZ2-CB 4.32Å; W324-E338 HydrophobicContact CZ2-CG 3.69Å; W324-E338 HydrophobicContact CZ3-CB 4.12Å; W324-E338 HydrophobicContact CZ3-CG 3.97Å; E338-C340 PolarHBondContact O-N 2.94Å; E338-C340 PolarHBondContact O-SG 3.31Å
339	E	82.3	Confident	90.5	Very high	112 Å²	112	53.9 Å²	53.9	52%	0.523	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	1.5	177.5	-38	101.7	105.3	0	0	113.4	S337 K341	S337-E339 VanDerWaalsContact C-N 3.32Å; S337-E339 WeakPolarHBondContact CB-OE2 3.18Å; S337-E339 PolarHBondContact O-N 3.33Å; S337-E339 PolarHBondContact OG-OE2 3.07Å; E339-K341 HydrophobicContact CB-CD 4.15Å; E339-K341 HydrophobicContact CB-CG 4.12Å; E339-K341 PolarHBondContact O-N 3.23Å; E339-K341 IonicContact OE1-NZ 2.87Å; E339-K341 PolarHBondContact OE1-NZ 3.15Å
340	C	82.3	Confident	90.5	Very high	33 Å²	33	56 Å²	56	22%	0.223	29%	0.291	C	S	.	.			trans	56.3	9.4	171.2	-63.1	0	0	0	0	116.9	W324 F335 S337 E338 E342	W324-C340 VanDerWaalsContact CD1-SG 3.52Å; F335-C340 HydrophobicContact CD1-CB 3.78Å; F335-C340 WeakPolarHBondContact CD1-O 3.47Å; F335-C340 HydrophobicContact CD2-CB 4.38Å; F335-C340 HydrophobicContact CE1-CB 3.79Å; F335-C340 WeakPolarHBondContact CE1-O 3.37Å; F335-C340 HydrophobicContact CE2-CB 4.39Å; F335-C340 HydrophobicContact CG-CB 4.07Å; F335-C340 HydrophobicContact CZ-CB 4.11Å; S337-C340 PolarHBondContact O-N 3Å; E338-C340 PolarHBondContact O-N 2.94Å; E338-C340 PolarHBondContact O-SG 3.31Å; C340-E342 VanDerWaalsContact C-N 3.25Å; C340-E342 PolarHBondContact O-N 3.33Å; C340-E342 VanDerWaalsContact O-N 3.11Å
341	K	80.3	Confident	90.4	Very high	166 Å²	166	55.4 Å²	55.4	72%	0.722	29%	0.29	S	S	*	.			trans	-54.2	-32.2	-174.9	-65.7	167	-173.9	154.2	0	114.8	E339	E339-K341 HydrophobicContact CB-CD 4.15Å; E339-K341 HydrophobicContact CB-CG 4.12Å; E339-K341 PolarHBondContact O-N 3.23Å; E339-K341 IonicContact OE1-NZ 2.87Å; E339-K341 PolarHBondContact OE1-NZ 3.15Å
342	E	83.1	Confident	90.3	Very high	100 Å²	100	62.6 Å²	62.6	47%	0.467	32%	0.321	S	S	.	.	S	Bend	trans	-130.4	113.3	178.2	-159.3	-155	131.7	0	0	111.6	C340 R344	C340-E342 VanDerWaalsContact C-N 3.25Å; C340-E342 PolarHBondContact O-N 3.33Å; C340-E342 VanDerWaalsContact O-N 3.11Å; E342-R344 PolarHBondContact O-N 2.77Å; E342-R344 WeakPolarHBondContact OE1-CD 3.49Å; E342-R344 IonicContact OE1-CZ 2.83Å; E342-R344 IonicContact OE1-NE 2.74Å; E342-R344 PolarHBondContact OE1-NE 3.3Å; E342-R344 IonicContact OE1-NH1 3.26Å; E342-R344 PolarHBondContact OE1-NH1 2.91Å; E342-R344 IonicContact OE1-NH2 2.76Å; E342-R344 IonicContact OE2-CZ 2.67Å; E342-R344 IonicContact OE2-NE 3.19Å; E342-R344 IonicContact OE2-NH1 2.66Å; E342-R344 PolarHBondContact OE2-NH1 3.41Å; E342-R344 IonicContact OE2-NH2 3.32Å; E342-R344 PolarHBondContact OE2-NH2 2.93Å
343	K	89.9	Confident	90.2	Very high	105 Å²	105	62.9 Å²	62.9	46%	0.457	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	102.5	179.8	-161.1	172.6	-159	178.8	0	110.5	C333 F335 G345 I346	C333-K343 WeakPolarHBondContact SG-CE 3.46Å; C333-K343 PolarHBondContact SG-NZ 2.75Å; F335-K343 HydrophobicContact CD1-CB 4.12Å; F335-K343 HydrophobicContact CD1-CG 4.28Å; F335-K343 HydrophobicContact CE1-CB 3.83Å; F335-K343 HydrophobicContact CE1-CD 4.37Å; F335-K343 HydrophobicContact CE1-CG 3.77Å; F335-K343 HydrophobicContact CZ-CG 4.2Å; K343-G345 VanDerWaalsContact C-N 3.3Å; K343-G345 PolarHBondContact O-N 3.05Å; K343-I346 HydrophobicContact CD-CD1 4.4Å; K343-I346 HydrophobicContact CD-CG1 4.27Å
344	R	91.5	Very high	90.2	Very high	116 Å²	116	64.9 Å²	64.9	44%	0.438	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	-9.8	-176.7	-60.5	-64	-169.7	176.3	-4.7	113.5	Y334 E342	Y334-R344 HydrophobicContact CD2-CB 3.66Å; Y334-R344 HydrophobicContact CE2-CB 3.59Å; Y334-R344 WeakPolarHBondContact CE2-O 3.5Å; Y334-R344 VanDerWaalsContact CZ-O 3.31Å; Y334-R344 WeakPolarHBondContact O-CA 3.49Å; Y334-R344 PolarHBondContact O-N 2.8Å; Y334-R344 PolarHBondContact OH-O 2.78Å; Y334-R344 VanDerWaalsContact OH-O 3.08Å; E342-R344 PolarHBondContact O-N 2.77Å; E342-R344 WeakPolarHBondContact OE1-CD 3.49Å; E342-R344 IonicContact OE1-CZ 2.83Å; E342-R344 IonicContact OE1-NE 2.74Å; E342-R344 PolarHBondContact OE1-NE 3.3Å; E342-R344 IonicContact OE1-NH1 3.26Å; E342-R344 PolarHBondContact OE1-NH1 2.91Å; E342-R344 IonicContact OE1-NH2 2.76Å; E342-R344 IonicContact OE2-CZ 2.67Å; E342-R344 IonicContact OE2-NE 3.19Å; E342-R344 IonicContact OE2-NH1 2.66Å; E342-R344 PolarHBondContact OE2-NH1 3.41Å; E342-R344 IonicContact OE2-NH2 3.32Å; E342-R344 PolarHBondContact OE2-NH2 2.93Å
345	G	91.1	Very high	90.3	Very high	18 Å²	18	63.8 Å²	63.8	19%	0.186	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.5	178.7	167.8	0	0	0	0	0	114.3	Y334 K343	Y334-G345 PolarHBondContact N-O 2.93Å; Y334-G345 VanDerWaalsContact N-O 3.07Å; Y334-G345 PolarHBondContact O-N 2.91Å; K343-G345 VanDerWaalsContact C-N 3.3Å; K343-G345 PolarHBondContact O-N 3.05Å
346	I	93.4	Very high	90.3	Very high	84 Å²	84	66.7 Å²	66.7	43%	0.431	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	139.1	-179.4	-56.3	173.6	0	0	0	107.7	C331 K343	C331-I346 HydrophobicContact CB-CG2 3.71Å; K343-I346 HydrophobicContact CD-CD1 4.4Å; K343-I346 HydrophobicContact CD-CG1 4.27Å
347	I	93.9	Very high	90.5	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	104.2	164.8	-52.7	175.5	0	0	0	105.4	F325 C331 L332 Y334 V370 T372 Y377 M379	F325-I347 HydrophobicContact CE1-CD1 4.44Å; C331-I347 CarbonylContact C-O 3.6Å; C331-I347 VanDerWaalsContact CA-O 3.29Å; C331-I347 WeakPolarHBondContact CA-O 3.22Å; C331-I347 WeakPolarHBondContact CB-O 3.36Å; L332-I347 HydrophobicContact CB-CB 4.22Å; L332-I347 HydrophobicContact CD2-CD1 4.35Å; L332-I347 HydrophobicContact CG-CD1 4.45Å; L332-I347 PolarHBondContact N-O 2.92Å; L332-I347 PolarHBondContact O-N 3.22Å; Y334-I347 HydrophobicContact CE1-CG1 4.43Å; I347-V370 HydrophobicContact CG2-CG1 4.46Å; I347-T372 HydrophobicContact CG2-CG2 3.7Å; I347-Y377 HydrophobicContact CD1-CD1 3.48Å; I347-Y377 VanDerWaalsContact CD1-CD1 3.48Å; I347-Y377 HydrophobicContact CD1-CD2 4.38Å; I347-Y377 HydrophobicContact CD1-CE1 3.95Å; I347-Y377 HydrophobicContact CD1-CG 3.72Å; I347-Y377 HydrophobicContact CG1-CD1 3.73Å; I347-Y377 HydrophobicContact CG1-CE1 3.62Å; I347-Y377 HydrophobicContact CG1-CE2 4.44Å; I347-Y377 HydrophobicContact CG1-CG 4.19Å; I347-Y377 HydrophobicContact CG2-CD2 3.99Å; I347-Y377 HydrophobicContact CG2-CE2 3.91Å; I347-Y377 HydrophobicContact CG2-CG 4.39Å; I347-M379 HydrophobicContact CD1-CE 3.71Å
348	P	93.3	Very high	90.5	Very high	70 Å²	70	69 Å²	69	46%	0.455	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	140.9	174.3	28	-33.6	0	0	0	109.2
349	L	93.3	Very high	90.6	Very high	7 Å²	7	68.2 Å²	68.2	4%	0.037	36%	0.356	C	S	.	.			trans	-111.9	126.9	173.9	-61.9	177.1	0	0	0	107.8	L327 S330 L332 V370 A397 I398	L327-L349 HydrophobicContact CD1-CD1 3.5Å; S330-L349 PolarHBondContact O-N 3.26Å; L332-L349 HydrophobicContact CB-CD1 4.38Å; L349-V370 HydrophobicContact CD2-CG1 3.96Å; L349-A397 HydrophobicContact CD1-CB 3.81Å; L349-I398 HydrophobicContact CD2-CG1 4.42Å
350	D	90.8	Very high	91	Very high	52 Å²	52	67 Å²	67	28%	0.278	35%	0.353	S	S	.	.			trans	-128.5	176	176.4	64.7	50.7	0	0	0	110	H352 C353	D350-H352 PolarHBondContact O-N 2.68Å; D350-H352 WeakPolarHBondContact OD1-CA 3.49Å; D350-H352 WeakPolarHBondContact OD1-CB 3.3Å; D350-H352 IonicContact OD1-CG 3.85Å; D350-H352 PolarHBondContact OD1-N 2.67Å; D350-H352 IonicContact OD1-ND1 2.66Å; D350-C353 VanDerWaalsContact CG-SG 3.52Å; D350-C353 PolarHBondContact N-SG 3.43Å; D350-C353 VanDerWaalsContact N-SG 3.39Å; D350-C353 WeakPolarHBondContact O-CB 3.4Å; D350-C353 PolarHBondContact O-N 3.16Å; D350-C353 PolarHBondContact OD1-N 3.02Å; D350-C353 PolarHBondContact OD1-SG 2.94Å; D350-C353 VanDerWaalsContact OD1-SG 3.36Å
351	A	89.8	Confident	91.2	Very high	51 Å²	51	73.6 Å²	73.6	42%	0.421	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-10.8	-177.9	0	0	0	0	0	114.8	A402	A351-A402 HydrophobicContact CB-CB 3.89Å
352	H	89.6	Confident	91.3	Very high	166 Å²	166	70.3 Å²	70.3	77%	0.769	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-10.9	178.5	-45.7	98.3	0	0	0	112.5	D350	D350-H352 PolarHBondContact O-N 2.68Å; D350-H352 WeakPolarHBondContact OD1-CA 3.49Å; D350-H352 WeakPolarHBondContact OD1-CB 3.3Å; D350-H352 IonicContact OD1-CG 3.85Å; D350-H352 PolarHBondContact OD1-N 2.67Å; D350-H352 IonicContact OD1-ND1 2.66Å
353	C	94.1	Very high	91.2	Very high	6 Å²	6	69.6 Å²	69.6	4%	0.041	38%	0.383	C	S	.	.			trans	-62.7	145.7	172.6	-68.2	0	0	0	0	110.6	D350 K371 I398	D350-C353 VanDerWaalsContact CG-SG 3.52Å; D350-C353 PolarHBondContact N-SG 3.43Å; D350-C353 VanDerWaalsContact N-SG 3.39Å; D350-C353 WeakPolarHBondContact O-CB 3.4Å; D350-C353 PolarHBondContact O-N 3.16Å; D350-C353 PolarHBondContact OD1-N 3.02Å; D350-C353 PolarHBondContact OD1-SG 2.94Å; D350-C353 VanDerWaalsContact OD1-SG 3.36Å; C353-K371 WeakPolarHBondContact CA-O 3.31Å; C353-I398 HydrophobicContact CB-CD1 4.02Å; C353-I398 HydrophobicContact CB-CG1 4.09Å; C353-I398 WeakPolarHBondContact O-CG2 3.32Å
354	C	93.8	Very high	91.1	Very high	45 Å²	45	66.7 Å²	66.7	30%	0.304	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	161.6	168.8	75.1	0	0	0	0	111	E356 V370 K371	C354-E356 PolarHBondContact SG-OE1 3Å; C354-E356 VanDerWaalsContact SG-OE1 3.34Å; C354-V370 CarbonylContact O-C 3.56Å; C354-V370 WeakPolarHBondContact O-CA 3.31Å; C354-K371 PolarHBondContact N-O 3.42Å; C354-K371 PolarHBondContact O-N 2.97Å
355	V	96.2	Very high	91.1	Very high	13 Å²	13	69.7 Å²	69.7	8%	0.079	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	125.8	171	61.4	0	0	0	0	109.6	F368 C369 V370 T391 I394 Q395 I398	V355-F368 HydrophobicContact CG2-CD2 3.78Å; V355-F368 HydrophobicContact CG2-CE2 4.41Å; V355-C369 VanDerWaalsContact CA-O 3.28Å; V355-C369 WeakPolarHBondContact CA-O 3.45Å; V355-C369 WeakPolarHBondContact CG2-O 3.2Å; V355-V370 HydrophobicContact CB-CG2 4.34Å; V355-V370 HydrophobicContact CG2-CG2 4.03Å; V355-T391 HydrophobicContact CG2-CG2 4.02Å; V355-I394 HydrophobicContact CB-CG2 3.87Å; V355-I394 HydrophobicContact CG1-CB 4.14Å; V355-I394 HydrophobicContact CG1-CG2 3.83Å; V355-I394 HydrophobicContact CG2-CG2 4.26Å; V355-Q395 HydrophobicContact CG1-CB 4.5Å; V355-Q395 HydrophobicContact CG1-CG 3.41Å; V355-Q395 VanDerWaalsContact CG1-CG 3.41Å; V355-I398 HydrophobicContact CG1-CD1 4.47Å
356	E	95.4	Very high	91.3	Very high	79 Å²	79	69.5 Å²	69.5	37%	0.369	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	137.7	-172.4	-74.2	170	-148.5	0	0	110.3	C354 F368 C369 K371	C354-E356 PolarHBondContact SG-OE1 3Å; C354-E356 VanDerWaalsContact SG-OE1 3.34Å; E356-F368 CarbonylContact O-C 3.6Å; E356-F368 WeakPolarHBondContact O-CA 3.48Å; E356-F368 WeakPolarHBondContact O-CB 3.07Å; E356-C369 PolarHBondContact N-O 3.4Å; E356-C369 PolarHBondContact O-N 3.5Å; E356-K371 WeakPolarHBondContact OE1-CE 3.47Å; E356-K371 IonicContact OE1-NZ 3.06Å; E356-K371 PolarHBondContact OE1-NZ 3.34Å; E356-K371 VanDerWaalsContact OE2-CE 3.29Å; E356-K371 WeakPolarHBondContact OE2-CE 3.46Å; E356-K371 IonicContact OE2-NZ 2.68Å; E356-K371 PolarHBondContact OE2-NZ 3.41Å
357	V	94.9	Very high	91.3	Very high	81 Å²	81	65.6 Å²	65.6	49%	0.491	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	132.1	170.4	174.7	0	0	0	0	108.8	R387 T391	V357-R387 VanDerWaalsContact CG1-NH1 3.33Å; V357-T391 HydrophobicContact CG2-CG2 4.36Å
358	L	92.9	Very high	91.5	Very high	40 Å²	40	65.6 Å²	65.6	21%	0.209	36%	0.357	C	S	.	.			trans	-105.3	149.2	178.2	-67.8	-177.2	0	0	0	110.9	M367 C369 E378	L358-M367 HydrophobicContact CB-CB 3.89Å; L358-M367 HydrophobicContact CB-CE 4.43Å; L358-M367 PolarHBondContact N-O 3.42Å; L358-C369 HydrophobicContact CD1-CB 3.76Å; L358-C369 HydrophobicContact CG-CB 4.27Å; L358-E378 HydrophobicContact CD1-CG 4.01Å
359	P	91.3	Very high	91.6	Very high	88 Å²	88	62.4 Å²	62.4	57%	0.571	34%	0.336	S	S	*	.			trans	-67.3	148.8	169	30.5	-35.1	0	0	0	110.5	R361 M367	P359-R361 PolarHBondContact O-N 3.41Å; P359-M367 VanDerWaalsContact O-CE 3.31Å; P359-M367 WeakPolarHBondContact O-CE 3.36Å
360	D	90.8	Very high	91.7	Very high	87 Å²	87	62 Å²	62	47%	0.465	34%	0.335	S	S	.	.			trans	-61	129	179.1	-69.4	-3.1	0	0	0	111	R365 C366	D360-R365 VanDerWaalsContact CG-CA 3.42Å; D360-R365 VanDerWaalsContact OD1-CA 3.31Å; D360-R365 WeakPolarHBondContact OD1-CA 3.2Å; D360-R365 WeakPolarHBondContact OD2-CA 3.25Å; D360-R365 WeakPolarHBondContact OD2-CB 3.35Å; D360-R365 WeakPolarHBondContact OD2-CG 3.42Å; D360-C366 PolarHBondContact OD1-N 2.96Å
361	R	86.4	Confident	91.9	Very high	171 Å²	171	63 Å²	63	65%	0.645	34%	0.336	S	S	*	.	B	Isolated β-bridge	trans	-153.7	164.7	-173.9	-72	-175	161.8	-154.7	-6.3	110.6	P359 G363 K364 M367	P359-R361 PolarHBondContact O-N 3.41Å; R361-G363 PolarHBondContact O-N 3.14Å; R361-K364 PolarHBondContact N-O 3.36Å; R361-K364 PolarHBondContact O-N 3.24Å; R361-M367 HydrophobicContact CB-CE 3.75Å
362	D	80.8	Confident	92.1	Very high	97 Å²	97	61.3 Å²	61.3	52%	0.519	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	33.1	173	-55.9	-28.2	0	0	0	114.1	R313 K364	R313-D362 IonicContact CZ-OD2 3.51Å; R313-D362 IonicContact NH1-OD2 2.67Å; R313-D362 PolarHBondContact NH1-OD2 2.81Å; R313-D362 IonicContact NH2-OD2 2.87Å; R313-D362 PolarHBondContact NH2-OD2 3.23Å; D362-K364 PolarHBondContact O-N 2.9Å
363	G	81.7	Confident	92.1	Very high	85 Å²	85	57.6 Å²	57.6	88%	0.876	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	72	5.4	-176.5	0	0	0	0	0	115.2	R361	R361-G363 PolarHBondContact O-N 3.14Å
364	K	88.8	Confident	91.8	Very high	45 Å²	45	63.4 Å²	63.4	20%	0.196	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-106.7	141.6	178.3	-70.3	-61.9	-171.6	176	0	111.5	W320 R361 D362 M367	W320-K364 HydrophobicContact CD2-CG 3.91Å; W320-K364 HydrophobicContact CE3-CG 4.47Å; W320-K364 HydrophobicContact CG-CG 4.12Å; W320-K364 HydrophobicContact CZ2-CB 4.31Å; W320-K364 HydrophobicContact CZ2-CG 4.17Å; R361-K364 PolarHBondContact N-O 3.36Å; R361-K364 PolarHBondContact O-N 3.24Å; D362-K364 PolarHBondContact O-N 2.9Å; K364-M367 HydrophobicContact CB-CG 4.2Å; K364-M367 HydrophobicContact CB-SD 3.69Å
365	R	91.2	Very high	91.6	Very high	179 Å²	179	64.2 Å²	64.2	68%	0.675	35%	0.351	S	S	*	.			trans	-110.3	169.2	178.2	-59.8	-167.5	-61	-173.7	1	111.5	D360 M367 S380	D360-R365 VanDerWaalsContact CG-CA 3.42Å; D360-R365 VanDerWaalsContact OD1-CA 3.31Å; D360-R365 WeakPolarHBondContact OD1-CA 3.2Å; D360-R365 WeakPolarHBondContact OD2-CA 3.25Å; D360-R365 WeakPolarHBondContact OD2-CB 3.35Å; D360-R365 WeakPolarHBondContact OD2-CG 3.42Å; R365-M367 PolarHBondContact O-N 3Å; R365-S380 PolarHBondContact O-OG 3.47Å
366	C	94.1	Very high	91.5	Very high	13 Å²	13	66.8 Å²	66.8	9%	0.088	37%	0.366	C	S	.	.	S	Bend	trans	55.2	42.9	172.5	-59.6	0	0	0	0	111.5	D360 A381 T384 R387	D360-C366 PolarHBondContact OD1-N 2.96Å; C366-A381 PolarHBondContact O-N 3.25Å; C366-T384 PolarHBondContact SG-N 3.31Å; C366-T384 VanDerWaalsContact SG-N 3.4Å; C366-R387 HydrophobicContact CB-CB 4.3Å; C366-R387 WeakPolarHBondContact O-CD 3.38Å
367	M	95.1	Very high	91.4	Very high	2 Å²	2	64 Å²	64	1%	0.01	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	153.4	-173.2	-58.8	-144	-55	0	0	113.4	W320 L358 P359 R361 K364 R365 M379 R387	W320-M367 HydrophobicContact CH2-SD 3.63Å; W320-M367 HydrophobicContact CZ2-SD 3.65Å; L358-M367 HydrophobicContact CB-CB 3.89Å; L358-M367 HydrophobicContact CB-CE 4.43Å; L358-M367 PolarHBondContact N-O 3.42Å; P359-M367 VanDerWaalsContact O-CE 3.31Å; P359-M367 WeakPolarHBondContact O-CE 3.36Å; R361-M367 HydrophobicContact CB-CE 3.75Å; K364-M367 HydrophobicContact CB-CG 4.2Å; K364-M367 HydrophobicContact CB-SD 3.69Å; R365-M367 PolarHBondContact O-N 3Å; M367-M379 VanDerWaalsContact CA-O 3.31Å; M367-M379 WeakPolarHBondContact CA-O 3.32Å; M367-R387 WeakPolarHBondContact O-CD 3.33Å
368	F	96.7	Very high	91.4	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	169.3	170.1	67	-82.6	0	0	0	109.8	L310 V355 E356 M379 R387 W390 T391 I394	L310-F368 HydrophobicContact CD1-CE1 4.41Å; L310-F368 HydrophobicContact CD1-CZ 3.81Å; L310-F368 HydrophobicContact CD2-CE1 4.1Å; L310-F368 HydrophobicContact CD2-CZ 4.32Å; V355-F368 HydrophobicContact CG2-CD2 3.78Å; V355-F368 HydrophobicContact CG2-CE2 4.41Å; E356-F368 CarbonylContact O-C 3.6Å; E356-F368 WeakPolarHBondContact O-CA 3.48Å; E356-F368 WeakPolarHBondContact O-CB 3.07Å; F368-M379 HydrophobicContact CD1-CB 4.07Å; F368-M379 HydrophobicContact CD2-CB 4.19Å; F368-M379 HydrophobicContact CD2-SD 4.31Å; F368-M379 HydrophobicContact CE1-CB 3.73Å; F368-M379 HydrophobicContact CE2-CB 3.85Å; F368-M379 HydrophobicContact CE2-CG 4.3Å; F368-M379 HydrophobicContact CE2-SD 3.58Å; F368-M379 VanDerWaalsContact CE2-SD 3.58Å; F368-M379 HydrophobicContact CG-CB 4.31Å; F368-M379 HydrophobicContact CZ-CB 3.62Å; F368-M379 HydrophobicContact CZ-CG 4.23Å; F368-M379 HydrophobicContact CZ-SD 3.98Å; F368-M379 PolarHBondContact N-O 3.41Å; F368-M379 PolarHBondContact O-N 3.33Å; F368-R387 HydrophobicContact CB-CG 4.5Å; F368-R387 HydrophobicContact CD1-CG 4.04Å; F368-W390 HydrophobicContact CE1-CB 4.31Å; F368-W390 HydrophobicContact CZ-CB 3.96Å; F368-W390 HydrophobicContact CZ-CG 4.48Å; F368-T391 HydrophobicContact CB-CG2 3.75Å; F368-T391 HydrophobicContact CD1-CG2 4.39Å; F368-T391 HydrophobicContact CD2-CG2 3.94Å; F368-T391 HydrophobicContact CG-CG2 3.8Å; F368-I394 HydrophobicContact CE2-CD1 3.77Å; F368-I394 HydrophobicContact CZ-CD1 4.43Å
369	C	95.2	Very high	91.5	Very high	3 Å²	3	61.2 Å²	61.2	2%	0.02	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	146.5	169.9	67.8	0	0	0	0	112.2	V355 E356 L358 T376 Y377 E378	V355-C369 VanDerWaalsContact CA-O 3.28Å; V355-C369 WeakPolarHBondContact CA-O 3.45Å; V355-C369 WeakPolarHBondContact CG2-O 3.2Å; E356-C369 PolarHBondContact N-O 3.4Å; E356-C369 PolarHBondContact O-N 3.5Å; L358-C369 HydrophobicContact CD1-CB 3.76Å; L358-C369 HydrophobicContact CG-CB 4.27Å; C369-T376 HydrophobicContact CB-CG2 3.77Å; C369-Y377 WeakPolarHBondContact CA-O 3.34Å; C369-Y377 WeakPolarHBondContact CB-O 3.5Å; C369-E378 HydrophobicContact CB-CG 4.2Å
370	V	96.4	Very high	91.7	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	123.1	166.9	-175.3	0	0	0	0	107.8	L332 I347 L349 C354 V355 Y377 M379 I394	L332-V370 HydrophobicContact CD2-CG2 4.5Å; I347-V370 HydrophobicContact CG2-CG1 4.46Å; L349-V370 HydrophobicContact CD2-CG1 3.96Å; C354-V370 CarbonylContact O-C 3.56Å; C354-V370 WeakPolarHBondContact O-CA 3.31Å; V355-V370 HydrophobicContact CB-CG2 4.34Å; V355-V370 HydrophobicContact CG2-CG2 4.03Å; V370-Y377 PolarHBondContact N-O 2.78Å; V370-Y377 PolarHBondContact O-N 2.8Å; V370-M379 HydrophobicContact CG2-SD 4.1Å; V370-I394 HydrophobicContact CG2-CD1 4.01Å; V370-I394 HydrophobicContact CG2-CG2 4.1Å
371	K	94.7	Very high	91.9	Very high	73 Å²	73	53.3 Å²	53.3	32%	0.317	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	122.9	171.9	-54.6	-175.9	-173	160.6	0	108.3	C353 C354 E356 T376	C353-K371 WeakPolarHBondContact CA-O 3.31Å; C354-K371 PolarHBondContact N-O 3.42Å; C354-K371 PolarHBondContact O-N 2.97Å; E356-K371 WeakPolarHBondContact OE1-CE 3.47Å; E356-K371 IonicContact OE1-NZ 3.06Å; E356-K371 PolarHBondContact OE1-NZ 3.34Å; E356-K371 VanDerWaalsContact OE2-CE 3.29Å; E356-K371 WeakPolarHBondContact OE2-CE 3.46Å; E356-K371 IonicContact OE2-NZ 2.68Å; E356-K371 PolarHBondContact OE2-NZ 3.41Å; K371-T376 HydrophobicContact CG-CG2 4.12Å
372	T	93.6	Very high	92.3	Very high	15 Å²	15	49.4 Å²	49.4	9%	0.092	29%	0.286	C	S	.	.			trans	-104.3	167.2	166.6	75.7	0	0	0	0	109.5	I347 T374 R375 Y377	I347-T372 HydrophobicContact CG2-CG2 3.7Å; T372-T374 PolarHBondContact O-N 3.45Å; T372-T374 PolarHBondContact OG1-N 2.89Å; T372-T374 PolarHBondContact OG1-OG1 3.21Å; T372-R375 PolarHBondContact N-O 3.5Å; T372-R375 PolarHBondContact O-N 2.9Å; T372-R375 PolarHBondContact OG1-N 2.89Å; T372-R375 PolarHBondContact OG1-O 3.29Å; T372-Y377 HydrophobicContact CG2-CD2 4.3Å; T372-Y377 HydrophobicContact CG2-CE2 4Å
373	A	89.8	Confident	92.9	Very high	88 Å²	88	47.6 Å²	47.6	73%	0.727	28%	0.277	S	S	*	.	S	Bend	trans	-55.2	-21.4	176.8	0	0	0	0	0	114.6
374	T	87.4	Confident	93.5	Very high	128 Å²	128	47 Å²	47	79%	0.785	26%	0.256	S	S	*	.	S	Bend	trans	-107.8	-21.8	-179.3	55.4	0	0	0	0	114.3	T372	T372-T374 PolarHBondContact O-N 3.45Å; T372-T374 PolarHBondContact OG1-N 2.89Å; T372-T374 PolarHBondContact OG1-OG1 3.21Å
375	R	91	Very high	93.8	Very high	62 Å²	62	52.5 Å²	52.5	23%	0.234	28%	0.276	C	S	.	.			trans	-164.9	145.6	-168.5	174.8	171.2	166.2	-177.2	0.8	114.3	H315 T372 Y377	H315-R375 PolarHBondContact CD2-NE 3.04Å; T372-R375 PolarHBondContact N-O 3.5Å; T372-R375 PolarHBondContact O-N 2.9Å; T372-R375 PolarHBondContact OG1-N 2.89Å; T372-R375 PolarHBondContact OG1-O 3.29Å; R375-Y377 HydrophobicContact CB-CD2 4.35Å; R375-Y377 HydrophobicContact CB-CE2 3.71Å; R375-Y377 HydrophobicContact CG-CD2 3.92Å; R375-Y377 HydrophobicContact CG-CE2 3.57Å
376	T	93.1	Very high	93.9	Very high	66 Å²	66	46.1 Å²	46.1	41%	0.405	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	138.3	163.4	-57.7	0	0	0	0	111.9	C369 K371	C369-T376 HydrophobicContact CB-CG2 3.77Å; K371-T376 HydrophobicContact CG-CG2 4.12Å
377	Y	93.9	Very high	94	Very high	22 Å²	22	47.8 Å²	47.8	9%	0.086	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	99.8	178.8	-66.3	-103	0	0	0	109.5	I347 C369 V370 T372 R375	I347-Y377 HydrophobicContact CD1-CD1 3.48Å; I347-Y377 VanDerWaalsContact CD1-CD1 3.48Å; I347-Y377 HydrophobicContact CD1-CD2 4.38Å; I347-Y377 HydrophobicContact CD1-CE1 3.95Å; I347-Y377 HydrophobicContact CD1-CG 3.72Å; I347-Y377 HydrophobicContact CG1-CD1 3.73Å; I347-Y377 HydrophobicContact CG1-CE1 3.62Å; I347-Y377 HydrophobicContact CG1-CE2 4.44Å; I347-Y377 HydrophobicContact CG1-CG 4.19Å; I347-Y377 HydrophobicContact CG2-CD2 3.99Å; I347-Y377 HydrophobicContact CG2-CE2 3.91Å; I347-Y377 HydrophobicContact CG2-CG 4.39Å; C369-Y377 WeakPolarHBondContact CA-O 3.34Å; C369-Y377 WeakPolarHBondContact CB-O 3.5Å; V370-Y377 PolarHBondContact N-O 2.78Å; V370-Y377 PolarHBondContact O-N 2.8Å; T372-Y377 HydrophobicContact CG2-CD2 4.3Å; T372-Y377 HydrophobicContact CG2-CE2 4Å; R375-Y377 HydrophobicContact CB-CD2 4.35Å; R375-Y377 HydrophobicContact CB-CE2 3.71Å; R375-Y377 HydrophobicContact CG-CD2 3.92Å; R375-Y377 HydrophobicContact CG-CE2 3.57Å
378	E	94.3	Very high	94.1	Very high	61 Å²	61	53 Å²	53	29%	0.285	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	136.6	175.7	-67.6	169.8	-139	0	0	111.8	R313 W320 L358 C369	R313-E378 HydrophobicContact CB-CB 3.83Å; R313-E378 WeakPolarHBondContact CD-OE2 3.34Å; R313-E378 IonicContact CZ-OE2 3.03Å; R313-E378 PolarHBondContact N-O 2.86Å; R313-E378 IonicContact NE-OE2 2.65Å; R313-E378 IonicContact NH1-OE1 2.62Å; R313-E378 IonicContact NH1-OE2 3.04Å; R313-E378 PolarHBondContact NH1-OE2 3.34Å; W320-E378 HydrophobicContact CH2-CB 4.17Å; L358-E378 HydrophobicContact CD1-CG 4.01Å; C369-E378 HydrophobicContact CB-CG 4.2Å
379	M	95.3	Very high	94	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	153.3	-174.8	-76.7	141.3	157.8	0	0	111	W311 F325 L332 I347 M367 F368 V370	W311-M379 CarbonylContact O-C 3.52Å; W311-M379 VanDerWaalsContact O-CA 3.31Å; W311-M379 WeakPolarHBondContact O-CA 3.26Å; F325-M379 HydrophobicContact CD1-CE 4.01Å; F325-M379 HydrophobicContact CE1-CE 3.23Å; F325-M379 HydrophobicContact CZ-CE 3.57Å; L332-M379 HydrophobicContact CD2-CE 3.65Å; I347-M379 HydrophobicContact CD1-CE 3.71Å; M367-M379 VanDerWaalsContact CA-O 3.31Å; M367-M379 WeakPolarHBondContact CA-O 3.32Å; F368-M379 HydrophobicContact CD1-CB 4.07Å; F368-M379 HydrophobicContact CD2-CB 4.19Å; F368-M379 HydrophobicContact CD2-SD 4.31Å; F368-M379 HydrophobicContact CE1-CB 3.73Å; F368-M379 HydrophobicContact CE2-CB 3.85Å; F368-M379 HydrophobicContact CE2-CG 4.3Å; F368-M379 HydrophobicContact CE2-SD 3.58Å; F368-M379 VanDerWaalsContact CE2-SD 3.58Å; F368-M379 HydrophobicContact CG-CB 4.31Å; F368-M379 HydrophobicContact CZ-CB 3.62Å; F368-M379 HydrophobicContact CZ-CG 4.23Å; F368-M379 HydrophobicContact CZ-SD 3.98Å; F368-M379 PolarHBondContact N-O 3.41Å; F368-M379 PolarHBondContact O-N 3.33Å; V370-M379 HydrophobicContact CG2-SD 4.1Å
380	S	95.4	Very high	94.1	Very high	4 Å²	4	55.9 Å²	55.9	3%	0.028	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	127.7	174.3	164.8	0	0	0	0	108.6	W311 R365	W311-S380 PolarHBondContact N-O 3.43Å; W311-S380 PolarHBondContact O-N 2.89Å; R365-S380 PolarHBondContact O-OG 3.47Å
381	A	95.8	Very high	94.1	Very high	5 Å²	5	56.5 Å²	56.5	4%	0.041	30%	0.299	C	S	.	.			trans	-89.3	165.9	174.2	0	0	0	0	0	111	L310 C366 D383 Q386 R387	L310-A381 HydrophobicContact CD2-CB 3.87Å; C366-A381 PolarHBondContact O-N 3.25Å; A381-D383 VanDerWaalsContact C-N 3.26Å; A381-D383 PolarHBondContact O-N 3Å; A381-Q386 HydrophobicContact CB-CB 4.08Å; A381-R387 HydrophobicContact CB-CB 4.07Å
382	S	93.1	Very high	94.2	Very high	90 Å²	90	55.5 Å²	55.5	63%	0.629	31%	0.305	S	S	*	.	S	Bend	trans	-55.7	-40.3	171.7	43.4	0	0	0	0	112.9	Q386	S382-Q386 WeakPolarHBondContact OG-CG 3.5Å
383	D	94.6	Very high	94.3	Very high	59 Å²	59	55.6 Å²	55.6	32%	0.316	31%	0.307	S	S	.	.	S	Bend	trans	-157.3	172.6	-167.6	64.1	84	0	0	0	112.3	A381 R385 Q386 R387	A381-D383 VanDerWaalsContact C-N 3.26Å; A381-D383 PolarHBondContact O-N 3Å; D383-R385 VanDerWaalsContact C-N 3.33Å; D383-R385 PolarHBondContact O-N 3.07Å; D383-R385 WeakPolarHBondContact OD1-CA 3.48Å; D383-R385 VanDerWaalsContact OD1-CB 3.25Å; D383-R385 WeakPolarHBondContact OD1-CB 3.26Å; D383-R385 PolarHBondContact OD1-N 3.25Å; D383-Q386 PolarHBondContact OD1-N 2.93Å; D383-Q386 VanDerWaalsContact OD2-CG 3.23Å; D383-Q386 WeakPolarHBondContact OD2-CG 3.39Å; D383-R387 PolarHBondContact O-N 2.75Å
384	T	93.7	Very high	94.6	Very high	71 Å²	71	51.4 Å²	51.4	44%	0.436	27%	0.272	S	S	.	.	H	α-helix	trans	-63.3	-35.3	-177.6	-55.5	0	0	0	0	113.1	C366 Q388	C366-T384 PolarHBondContact SG-N 3.31Å; C366-T384 VanDerWaalsContact SG-N 3.4Å; T384-Q388 WeakPolarHBondContact O-CG 3.49Å; T384-Q388 PolarHBondContact O-N 2.99Å
385	R	94.8	Very high	94.9	Very high	162 Å²	162	50.5 Å²	50.5	61%	0.611	26%	0.259	S	S	*	.	H	α-helix	trans	-73.2	-49.6	-177.3	-160.3	-168.1	79.2	-161.1	2.8	109.6	D383 R387 Q388 E389	D383-R385 VanDerWaalsContact C-N 3.33Å; D383-R385 PolarHBondContact O-N 3.07Å; D383-R385 WeakPolarHBondContact OD1-CA 3.48Å; D383-R385 VanDerWaalsContact OD1-CB 3.25Å; D383-R385 WeakPolarHBondContact OD1-CB 3.26Å; D383-R385 PolarHBondContact OD1-N 3.25Å; R385-R387 VanDerWaalsContact C-N 3.29Å; R385-R387 PolarHBondContact O-N 3.37Å; R385-Q388 WeakPolarHBondContact O-CA 3.43Å; R385-Q388 WeakPolarHBondContact O-CB 3.48Å; R385-Q388 PolarHBondContact O-N 3.36Å; R385-E389 IonicContact CZ-OE1 2.72Å; R385-E389 IonicContact NE-OE1 3.53Å; R385-E389 PolarHBondContact NE-OE1 3.22Å; R385-E389 IonicContact NH2-OE1 3.34Å; R385-E389 PolarHBondContact NH2-OE1 3.47Å; R385-E389 WeakPolarHBondContact O-CG 3.4Å; R385-E389 PolarHBondContact O-N 3.26Å
386	Q	94.9	Very high	95.1	Very high	45 Å²	45	50.3 Å²	50.3	21%	0.21	26%	0.262	C	S	.	.	H	α-helix	trans	-57.5	-40.7	172.7	-75.3	-70.1	-10.4	0	0	111.7	A381 S382 D383 Q388 E389 W390	A381-Q386 HydrophobicContact CB-CB 4.08Å; S382-Q386 WeakPolarHBondContact OG-CG 3.5Å; D383-Q386 PolarHBondContact OD1-N 2.93Å; D383-Q386 VanDerWaalsContact OD2-CG 3.23Å; D383-Q386 WeakPolarHBondContact OD2-CG 3.39Å; Q386-Q388 PolarHBondContact O-N 3.39Å; Q386-E389 PolarHBondContact O-N 3.27Å; Q386-E389 PolarHBondContact OE1-OE2 3.08Å; Q386-W390 WeakPolarHBondContact O-CB 3.49Å; Q386-W390 PolarHBondContact O-N 3.4Å
387	R	95.8	Very high	95.1	Very high	47 Å²	47	47.2 Å²	47.2	18%	0.177	24%	0.242	C	C	.	.	H	α-helix	trans	-58.4	-47.1	172.2	-176.4	-171	66	-176.2	-3.1	111.9	V357 C366 M367 F368 A381 D383 R385 W390 T391	V357-R387 VanDerWaalsContact CG1-NH1 3.33Å; C366-R387 HydrophobicContact CB-CB 4.3Å; C366-R387 WeakPolarHBondContact O-CD 3.38Å; M367-R387 WeakPolarHBondContact O-CD 3.33Å; F368-R387 HydrophobicContact CB-CG 4.5Å; F368-R387 HydrophobicContact CD1-CG 4.04Å; A381-R387 HydrophobicContact CB-CB 4.07Å; D383-R387 PolarHBondContact O-N 2.75Å; R385-R387 VanDerWaalsContact C-N 3.29Å; R385-R387 PolarHBondContact O-N 3.37Å; R387-W390 PolarHBondContact O-N 3.4Å; R387-T391 HydrophobicContact CG-CG2 4.33Å; R387-T391 WeakPolarHBondContact O-CB 3.42Å; R387-T391 WeakPolarHBondContact O-CG2 3.45Å; R387-T391 PolarHBondContact O-N 2.91Å; R387-T391 PolarHBondContact O-OG1 2.68Å
388	Q	95.9	Very high	95.1	Very high	111 Å²	111	47 Å²	47	52%	0.519	24%	0.243	S	C	.	.	H	α-helix	trans	-62.4	-48.2	178.2	-76	169.1	-36.7	0	0	111.4	T384 R385 Q386 W390 T391 A392	T384-Q388 WeakPolarHBondContact O-CG 3.49Å; T384-Q388 PolarHBondContact O-N 2.99Å; R385-Q388 WeakPolarHBondContact O-CA 3.43Å; R385-Q388 WeakPolarHBondContact O-CB 3.48Å; R385-Q388 PolarHBondContact O-N 3.36Å; Q386-Q388 PolarHBondContact O-N 3.39Å; Q388-W390 PolarHBondContact O-N 2.98Å; Q388-T391 PolarHBondContact O-N 3.19Å; Q388-T391 PolarHBondContact O-OG1 2.67Å; Q388-T391 VanDerWaalsContact O-OG1 3.13Å; Q388-A392 VanDerWaalsContact O-CB 3.23Å; Q388-A392 WeakPolarHBondContact O-CB 3.23Å; Q388-A392 PolarHBondContact O-N 3.1Å
389	E	95.5	Very high	95	Very high	63 Å²	63	50.2 Å²	50.2	29%	0.294	25%	0.252	S	S	.	.	H	α-helix	trans	-56.4	-48	175.3	-67.3	169.6	-143.5	0	0	112.1	K306 R385 Q386 A393	K306-E389 HydrophobicContact CD-CB 4.11Å; K306-E389 IonicContact NZ-OE2 3.73Å; K306-E389 PolarHBondContact NZ-OE2 3.48Å; R385-E389 IonicContact CZ-OE1 2.72Å; R385-E389 IonicContact NE-OE1 3.53Å; R385-E389 PolarHBondContact NE-OE1 3.22Å; R385-E389 IonicContact NH2-OE1 3.34Å; R385-E389 PolarHBondContact NH2-OE1 3.47Å; R385-E389 WeakPolarHBondContact O-CG 3.4Å; R385-E389 PolarHBondContact O-N 3.26Å; Q386-E389 PolarHBondContact O-N 3.27Å; Q386-E389 PolarHBondContact OE1-OE2 3.08Å; E389-A393 VanDerWaalsContact O-CB 3.24Å; E389-A393 WeakPolarHBondContact O-CB 3.36Å; E389-A393 PolarHBondContact O-N 3Å
390	W	96.8	Very high	94.8	Very high	1 Å²	1	50.3 Å²	50.3	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-66	-47.2	179.3	-84.9	111.1	0	0	0	112.7	K306 L310 F325 L327 L332 F368 Q386 R387 Q388 A393 I394	K306-W390 HydrophobicContact CB-CE3 4.41Å; K306-W390 HydrophobicContact CB-CZ3 4.22Å; K306-W390 HydrophobicContact CD-CD2 3.85Å; K306-W390 HydrophobicContact CD-CE3 4.08Å; K306-W390 HydrophobicContact CD-CG 4.11Å; K306-W390 VanDerWaalsContact CE-CG 3.47Å; K306-W390 HydrophobicContact CG-CD2 4.2Å; K306-W390 HydrophobicContact CG-CE3 4.16Å; K306-W390 HydrophobicContact CG-CH2 4.2Å; K306-W390 HydrophobicContact CG-CZ2 4.23Å; K306-W390 HydrophobicContact CG-CZ3 4.16Å; L310-W390 HydrophobicContact CD1-CD2 3.84Å; L310-W390 HydrophobicContact CD1-CE3 4.22Å; L310-W390 HydrophobicContact CD1-CG 4.19Å; L310-W390 HydrophobicContact CD1-CH2 4.47Å; L310-W390 HydrophobicContact CD1-CZ2 4.1Å; L310-W390 HydrophobicContact CD2-CG 4.23Å; L310-W390 HydrophobicContact CG-CD2 4.39Å; L310-W390 HydrophobicContact CG-CZ2 4.22Å; F325-W390 HydrophobicContact CB-CH2 3.59Å; F325-W390 HydrophobicContact CB-CZ2 4.15Å; F325-W390 HydrophobicContact CB-CZ3 4.26Å; L327-W390 HydrophobicContact CB-CZ3 4.18Å; L332-W390 HydrophobicContact CD1-CZ3 4.05Å; F368-W390 HydrophobicContact CE1-CB 4.31Å; F368-W390 HydrophobicContact CZ-CB 3.96Å; F368-W390 HydrophobicContact CZ-CG 4.48Å; Q386-W390 WeakPolarHBondContact O-CB 3.49Å; Q386-W390 PolarHBondContact O-N 3.4Å; R387-W390 PolarHBondContact O-N 3.4Å; Q388-W390 PolarHBondContact O-N 2.98Å; W390-A393 PolarHBondContact O-N 2.83Å; W390-I394 HydrophobicContact CE3-CD1 4.42Å; W390-I394 WeakPolarHBondContact O-CB 3.48Å; W390-I394 WeakPolarHBondContact O-CD1 3.43Å; W390-I394 WeakPolarHBondContact O-CG1 3.49Å; W390-I394 PolarHBondContact O-N 3.44Å
391	T	96.6	Very high	94.6	Very high	13 Å²	13	52.8 Å²	52.8	8%	0.08	26%	0.264	C	S	.	.	H	α-helix	trans	-63.7	-42.7	178.3	52.6	0	0	0	0	111.8	V355 V357 F368 R387 Q388 I394 Q395	V355-T391 HydrophobicContact CG2-CG2 4.02Å; V357-T391 HydrophobicContact CG2-CG2 4.36Å; F368-T391 HydrophobicContact CB-CG2 3.75Å; F368-T391 HydrophobicContact CD1-CG2 4.39Å; F368-T391 HydrophobicContact CD2-CG2 3.94Å; F368-T391 HydrophobicContact CG-CG2 3.8Å; R387-T391 HydrophobicContact CG-CG2 4.33Å; R387-T391 WeakPolarHBondContact O-CB 3.42Å; R387-T391 WeakPolarHBondContact O-CG2 3.45Å; R387-T391 PolarHBondContact O-N 2.91Å; R387-T391 PolarHBondContact O-OG1 2.68Å; Q388-T391 PolarHBondContact O-N 3.19Å; Q388-T391 PolarHBondContact O-OG1 2.67Å; Q388-T391 VanDerWaalsContact O-OG1 3.13Å; T391-I394 PolarHBondContact O-N 2.83Å; T391-Q395 WeakPolarHBondContact O-CB 3.14Å; T391-Q395 VanDerWaalsContact O-CG 3.27Å; T391-Q395 WeakPolarHBondContact O-CG 3.42Å; T391-Q395 PolarHBondContact O-N 2.92Å
392	A	96.4	Very high	94.3	Very high	53 Å²	53	55.6 Å²	55.6	44%	0.438	29%	0.287	S	S	.	.	H	α-helix	trans	-64.7	-41.9	176.2	0	0	0	0	0	112.7	Q388 Q395 M396	Q388-A392 VanDerWaalsContact O-CB 3.23Å; Q388-A392 WeakPolarHBondContact O-CB 3.23Å; Q388-A392 PolarHBondContact O-N 3.1Å; A392-Q395 PolarHBondContact O-N 3.4Å; A392-M396 PolarHBondContact O-N 3.47Å
393	A	95.9	Very high	94.1	Very high	16 Å²	16	55.5 Å²	55.5	13%	0.132	28%	0.277	C	S	.	.	H	α-helix	trans	-64.5	-42.5	176.3	0	0	0	0	0	111.6	K306 L327 E389 W390 M396 A397	K306-A393 HydrophobicContact CB-CB 4.01Å; K306-A393 HydrophobicContact CD-CB 4.2Å; L327-A393 HydrophobicContact CD2-CB 3.64Å; L327-A393 WeakPolarHBondContact CD2-O 3.3Å; E389-A393 VanDerWaalsContact O-CB 3.24Å; E389-A393 WeakPolarHBondContact O-CB 3.36Å; E389-A393 PolarHBondContact O-N 3Å; W390-A393 PolarHBondContact O-N 2.83Å; A393-M396 WeakPolarHBondContact O-CB 3.4Å; A393-M396 PolarHBondContact O-N 3.39Å; A393-A397 PolarHBondContact O-N 3.05Å
394	I	95.9	Very high	93.6	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.2	-38.8	176.8	-65.8	163.5	0	0	0	111	L327 L332 V355 F368 V370 W390 T391 M396 A397 I398	L327-I394 HydrophobicContact CD1-CG1 4.13Å; L327-I394 HydrophobicContact CD2-CG1 4.02Å; L332-I394 HydrophobicContact CD2-CD1 3.84Å; L332-I394 HydrophobicContact CD2-CG1 4.29Å; V355-I394 HydrophobicContact CB-CG2 3.87Å; V355-I394 HydrophobicContact CG1-CB 4.14Å; V355-I394 HydrophobicContact CG1-CG2 3.83Å; V355-I394 HydrophobicContact CG2-CG2 4.26Å; F368-I394 HydrophobicContact CE2-CD1 3.77Å; F368-I394 HydrophobicContact CZ-CD1 4.43Å; V370-I394 HydrophobicContact CG2-CD1 4.01Å; V370-I394 HydrophobicContact CG2-CG2 4.1Å; W390-I394 HydrophobicContact CE3-CD1 4.42Å; W390-I394 WeakPolarHBondContact O-CB 3.48Å; W390-I394 WeakPolarHBondContact O-CD1 3.43Å; W390-I394 WeakPolarHBondContact O-CG1 3.49Å; W390-I394 PolarHBondContact O-N 3.44Å; T391-I394 PolarHBondContact O-N 2.83Å; I394-M396 VanDerWaalsContact C-N 3.32Å; I394-M396 PolarHBondContact O-N 2.92Å; I394-A397 PolarHBondContact O-N 3.37Å; I394-I398 HydrophobicContact CG2-CD1 3.84Å; I394-I398 VanDerWaalsContact O-CG1 3.31Å; I394-I398 WeakPolarHBondContact O-CG1 3Å; I394-I398 PolarHBondContact O-N 3.38Å
395	Q	95.3	Very high	93.1	Very high	109 Å²	109	53.1 Å²	53.1	51%	0.509	26%	0.262	S	S	.	.	H	α-helix	trans	-61.1	-39.7	171.3	-73.3	172.1	-3	0	0	111.9	V355 T391 A392 R399	V355-Q395 HydrophobicContact CG1-CB 4.5Å; V355-Q395 HydrophobicContact CG1-CG 3.41Å; V355-Q395 VanDerWaalsContact CG1-CG 3.41Å; T391-Q395 WeakPolarHBondContact O-CB 3.14Å; T391-Q395 VanDerWaalsContact O-CG 3.27Å; T391-Q395 WeakPolarHBondContact O-CG 3.42Å; T391-Q395 PolarHBondContact O-N 2.92Å; A392-Q395 PolarHBondContact O-N 3.4Å; Q395-R399 WeakPolarHBondContact O-CB 3.24Å; Q395-R399 PolarHBondContact O-N 3.1Å
396	M	93.8	Very high	92.3	Very high	59 Å²	59	51 Å²	51	29%	0.291	26%	0.258	S	S	.	.	H	α-helix	trans	-61.7	-46.3	174.4	-172.2	66.5	68	0	0	111.6	A392 A393 I394 R399 L400 L408	A392-M396 PolarHBondContact O-N 3.47Å; A393-M396 WeakPolarHBondContact O-CB 3.4Å; A393-M396 PolarHBondContact O-N 3.39Å; I394-M396 VanDerWaalsContact C-N 3.32Å; I394-M396 PolarHBondContact O-N 2.92Å; M396-R399 PolarHBondContact O-N 2.92Å; M396-R399 PolarHBondContact SD-NH2 3.23Å; M396-R399 VanDerWaalsContact SD-NH2 3.37Å; M396-L400 HydrophobicContact CG-CD1 4.18Å; M396-L400 VanDerWaalsContact O-CG 3.29Å; M396-L400 WeakPolarHBondContact O-CG 3.46Å; M396-L400 PolarHBondContact O-N 2.86Å; M396-L408 HydrophobicContact CG-CD2 4.17Å; M396-L408 HydrophobicContact SD-CD1 4.25Å
397	A	94.2	Very high	91.9	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.2	-48.2	177.4	0	0	0	0	0	112.1	L305 L327 L349 A393 I394 R399 L400 Q401	L305-A397 HydrophobicContact CD1-CB 3.89Å; L327-A397 HydrophobicContact CD1-CB 3.96Å; L327-A397 HydrophobicContact CD2-CB 4.28Å; L327-A397 HydrophobicContact CG-CB 4.3Å; L349-A397 HydrophobicContact CD1-CB 3.81Å; A393-A397 PolarHBondContact O-N 3.05Å; I394-A397 PolarHBondContact O-N 3.37Å; A397-R399 VanDerWaalsContact C-N 3.32Å; A397-R399 PolarHBondContact O-N 3.37Å; A397-L400 WeakPolarHBondContact O-CB 3.44Å; A397-L400 PolarHBondContact O-N 2.99Å; A397-Q401 PolarHBondContact O-N 2.83Å; A397-Q401 VanDerWaalsContact O-N 3.08Å
398	I	93.7	Very high	91.6	Very high	19 Å²	19	48.4 Å²	48.4	10%	0.097	25%	0.249	C	C	.	.	H	α-helix	trans	-58.6	-43.7	175.5	-68.4	164	0	0	0	110.9	L349 C353 V355 I394 L400 Q401 A402	L349-I398 HydrophobicContact CD2-CG1 4.42Å; C353-I398 HydrophobicContact CB-CD1 4.02Å; C353-I398 HydrophobicContact CB-CG1 4.09Å; C353-I398 WeakPolarHBondContact O-CG2 3.32Å; V355-I398 HydrophobicContact CG1-CD1 4.47Å; I394-I398 HydrophobicContact CG2-CD1 3.84Å; I394-I398 VanDerWaalsContact O-CG1 3.31Å; I394-I398 WeakPolarHBondContact O-CG1 3Å; I394-I398 PolarHBondContact O-N 3.38Å; I398-L400 PolarHBondContact O-N 2.86Å; I398-Q401 PolarHBondContact O-N 3.12Å; I398-A402 PolarHBondContact O-N 2.9Å
399	R	92.7	Very high	91.3	Very high	127 Å²	127	43.5 Å²	43.5	48%	0.479	23%	0.226	S	C	.	.	H	α-helix	trans	-64.7	-38.1	177.8	-158.8	-174.7	76.9	-150.7	-6.7	112.2	Q395 M396 A397 Q401 A402 E403	Q395-R399 WeakPolarHBondContact O-CB 3.24Å; Q395-R399 PolarHBondContact O-N 3.1Å; M396-R399 PolarHBondContact O-N 2.92Å; M396-R399 PolarHBondContact SD-NH2 3.23Å; M396-R399 VanDerWaalsContact SD-NH2 3.37Å; A397-R399 VanDerWaalsContact C-N 3.32Å; A397-R399 PolarHBondContact O-N 3.37Å; R399-Q401 VanDerWaalsContact C-N 3.33Å; R399-Q401 PolarHBondContact O-N 2.66Å; R399-A402 PolarHBondContact O-N 2.68Å; R399-E403 WeakPolarHBondContact CD-OE1 3.38Å; R399-E403 HydrophobicContact CG-CG 4.47Å; R399-E403 WeakPolarHBondContact CG-OE1 3.36Å; R399-E403 IonicContact CZ-OE1 2.69Å; R399-E403 IonicContact NE-OE1 2.63Å; R399-E403 PolarHBondContact NE-OE1 3.02Å; R399-E403 IonicContact NH2-OE1 2.85Å; R399-E403 WeakPolarHBondContact O-CB 3.41Å; R399-E403 WeakPolarHBondContact O-CG 3.29Å; R399-E403 PolarHBondContact O-N 3.36Å
400	L	90.9	Very high	90.9	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-62.9	-39.2	174.5	-70.3	162.5	0	0	0	111.6	L305 M396 A397 I398 E403 G404 K405 L408	L305-L400 HydrophobicContact CD1-CD1 4.3Å; M396-L400 HydrophobicContact CG-CD1 4.18Å; M396-L400 VanDerWaalsContact O-CG 3.29Å; M396-L400 WeakPolarHBondContact O-CG 3.46Å; M396-L400 PolarHBondContact O-N 2.86Å; A397-L400 WeakPolarHBondContact O-CB 3.44Å; A397-L400 PolarHBondContact O-N 2.99Å; I398-L400 PolarHBondContact O-N 2.86Å; L400-E403 CarbonylContact O-C 3.51Å; L400-G404 PolarHBondContact O-N 3.11Å; L400-K405 HydrophobicContact CB-CB 4.5Å; L400-K405 HydrophobicContact CD2-CB 3.99Å; L400-K405 HydrophobicContact CD2-CD 4.01Å; L400-K405 PolarHBondContact O-N 2.95Å; L400-L408 HydrophobicContact CD1-CB 3.86Å; L400-L408 HydrophobicContact CD1-CD1 4.33Å; L400-L408 HydrophobicContact CD2-CD1 4.25Å
401	Q	91.3	Very high	90.6	Very high	56 Å²	56	47 Å²	47	26%	0.262	24%	0.243	S	C	.	.	H	α-helix	trans	-65	-42.5	172.5	-64.5	-51.6	-51	0	0	112.5	P329 A397 I398 R399 G404	P329-Q401 WeakPolarHBondContact O-CG 3.37Å; P329-Q401 PolarHBondContact O-NE2 2.74Å; A397-Q401 PolarHBondContact O-N 2.83Å; A397-Q401 VanDerWaalsContact O-N 3.08Å; I398-Q401 PolarHBondContact O-N 3.12Å; R399-Q401 VanDerWaalsContact C-N 3.33Å; R399-Q401 PolarHBondContact O-N 2.66Å; Q401-G404 WeakPolarHBondContact O-CA 3.44Å; Q401-G404 PolarHBondContact O-N 2.85Å
402	A	89.1	Confident	90.3	Very high	65 Å²	65	49.9 Å²	49.9	54%	0.537	26%	0.257	S	S	.	.	H	α-helix	trans	-64.7	-40.3	176.5	0	0	0	0	0	112.9	A351 I398 R399 G404	A351-A402 HydrophobicContact CB-CB 3.89Å; I398-A402 PolarHBondContact O-N 2.9Å; R399-A402 PolarHBondContact O-N 2.68Å; A402-G404 PolarHBondContact O-N 3.36Å
403	E	88.3	Confident	90	Very high	87 Å²	87	48.5 Å²	48.5	41%	0.407	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-7.4	171.2	-69.1	175.7	-144.2	0	0	112.6	R399 L400 K405	R399-E403 WeakPolarHBondContact CD-OE1 3.38Å; R399-E403 HydrophobicContact CG-CG 4.47Å; R399-E403 WeakPolarHBondContact CG-OE1 3.36Å; R399-E403 IonicContact CZ-OE1 2.69Å; R399-E403 IonicContact NE-OE1 2.63Å; R399-E403 PolarHBondContact NE-OE1 3.02Å; R399-E403 IonicContact NH2-OE1 2.85Å; R399-E403 WeakPolarHBondContact O-CB 3.41Å; R399-E403 WeakPolarHBondContact O-CG 3.29Å; R399-E403 PolarHBondContact O-N 3.36Å; L400-E403 CarbonylContact O-C 3.51Å; E403-K405 HydrophobicContact CB-CD 3.74Å; E403-K405 HydrophobicContact CB-CG 4.1Å; E403-K405 WeakPolarHBondContact OE2-CD 3.37Å; E403-K405 WeakPolarHBondContact OE2-CE 3.28Å; E403-K405 IonicContact OE2-NZ 3.47Å; E403-K405 PolarHBondContact OE2-NZ 2.78Å
404	G	83.9	Confident	89.7	Confident	17 Å²	17	53.4 Å²	53.4	18%	0.175	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	19.8	176.8	0	0	0	0	0	115.4	R82 L400 Q401 A402	R82-G404 VanDerWaalsContact NH2-C 3.34Å; R82-G404 PolarHBondContact NH2-O 2.89Å; L400-G404 PolarHBondContact O-N 3.11Å; Q401-G404 WeakPolarHBondContact O-CA 3.44Å; Q401-G404 PolarHBondContact O-N 2.85Å; A402-G404 PolarHBondContact O-N 3.36Å
405	K	84.4	Confident	89.4	Confident	64 Å²	64	59 Å²	59	28%	0.278	29%	0.286	S	S	.	.			trans	-94.7	147	-172.1	-67.3	167.6	171.4	-169.9	0	112	L400 E403 D411	L400-K405 HydrophobicContact CB-CB 4.5Å; L400-K405 HydrophobicContact CD2-CB 3.99Å; L400-K405 HydrophobicContact CD2-CD 4.01Å; L400-K405 PolarHBondContact O-N 2.95Å; E403-K405 HydrophobicContact CB-CD 3.74Å; E403-K405 HydrophobicContact CB-CG 4.1Å; E403-K405 WeakPolarHBondContact OE2-CD 3.37Å; E403-K405 WeakPolarHBondContact OE2-CE 3.28Å; E403-K405 IonicContact OE2-NZ 3.47Å; E403-K405 PolarHBondContact OE2-NZ 2.78Å; K405-D411 WeakPolarHBondContact CD-OD2 3.48Å; K405-D411 WeakPolarHBondContact CE-OD2 3.27Å; K405-D411 IonicContact NZ-OD2 3.89Å; K405-D411 PolarHBondContact NZ-OD2 3.21Å
406	K	77.5	Confident	89.3	Confident	118 Å²	118	56.1 Å²	56.1	51%	0.513	27%	0.27	S	S	.	.	S	Bend	trans	-93.6	-32.6	-174.5	-68	-172.3	169.1	-173.1	0	114.3	S86 E169 P329	S86-K406 PolarHBondContact OG-NZ 2.68Å; E169-K406 WeakPolarHBondContact OE1-CD 3.31Å; E169-K406 IonicContact OE1-NZ 3.54Å; E169-K406 PolarHBondContact OE1-NZ 3.29Å; E169-K406 IonicContact OE2-NZ 3.14Å; E169-K406 PolarHBondContact OE2-NZ 3.24Å; P329-K406 WeakPolarHBondContact CG-O 3.42Å
407	S	86.2	Confident	89	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.021	27%	0.267	C	S	.	.			trans	-145.6	134.1	-173.9	165.8	0	0	0	0	109.6	D303 H409 K410	D303-S407 VanDerWaalsContact CG-OG 3.29Å; D303-S407 WeakPolarHBondContact OD1-CA 3.34Å; D303-S407 WeakPolarHBondContact OD1-CB 3.27Å; D303-S407 PolarHBondContact OD1-OG 2.87Å; D303-S407 VanDerWaalsContact OD2-CB 3.25Å; D303-S407 WeakPolarHBondContact OD2-CB 3.44Å; D303-S407 PolarHBondContact OD2-OG 3.44Å; S407-H409 VanDerWaalsContact C-N 3.31Å; S407-H409 PolarHBondContact OG-N 3.17Å; S407-K410 WeakPolarHBondContact OG-CG 3.5Å; S407-K410 PolarHBondContact OG-N 3.46Å
408	L	88.9	Confident	88.8	Confident	34 Å²	34	60.9 Å²	60.9	18%	0.178	29%	0.289	C	S	.	.	H	α-helix	trans	-67.4	-36.8	172.4	-178.9	59.3	0	0	0	111.1	L305 M396 L400 D411 L412	L305-L408 HydrophobicContact CD2-CB 3.82Å; L305-L408 HydrophobicContact CD2-CD2 3.91Å; M396-L408 HydrophobicContact CG-CD2 4.17Å; M396-L408 HydrophobicContact SD-CD1 4.25Å; L400-L408 HydrophobicContact CD1-CB 3.86Å; L400-L408 HydrophobicContact CD1-CD1 4.33Å; L400-L408 HydrophobicContact CD2-CD1 4.25Å; L408-D411 WeakPolarHBondContact O-CB 3.49Å; L408-L412 HydrophobicContact CD1-CD1 4.19Å; L408-L412 HydrophobicContact CD1-CG 4.34Å; L408-L412 HydrophobicContact CG-CD1 3.92Å; L408-L412 HydrophobicContact CG-CG 4.45Å; L408-L412 WeakPolarHBondContact O-CB 3.49Å; L408-L412 VanDerWaalsContact O-CG 3.29Å; L408-L412 WeakPolarHBondContact O-CG 3.17Å; L408-L412 PolarHBondContact O-N 2.99Å
409	H	90	Very high	88.7	Confident	7 Å²	7	64.1 Å²	64.1	3%	0.032	30%	0.304	C	S	.	.	H	α-helix	trans	-82.3	-31.4	-169.7	-59.1	-74.3	0	0	0	112	F214 E299 L300 D303 S407 L412 K413	F214-H409 HydrophobicContact CE1-CB 4.48Å; F214-H409 HydrophobicContact CZ-CB 3.98Å; E299-H409 VanDerWaalsContact CG-CE1 3.42Å; E299-H409 WeakPolarHBondContact CG-CE1 3.41Å; E299-H409 WeakPolarHBondContact CG-NE2 3.29Å; E299-H409 PolarHBondContact O-CD2 3.37Å; E299-H409 VanDerWaalsContact O-CD2 3.24Å; E299-H409 IonicContact OE1-CE1 3.63Å; E299-H409 PolarHBondContact OE1-CE1 3.43Å; E299-H409 IonicContact OE1-ND1 3.7Å; L300-H409 HydrophobicContact CD2-CB 3.84Å; L300-H409 VanDerWaalsContact CD2-ND1 3.3Å; L300-H409 WeakPolarHBondContact CD2-ND1 3.29Å; D303-H409 IonicContact OD1-CD2 3.6Å; S407-H409 VanDerWaalsContact C-N 3.31Å; S407-H409 PolarHBondContact OG-N 3.17Å; H409-L412 PolarHBondContact O-N 2.8Å; H409-K413 WeakPolarHBondContact O-CB 3.29Å; H409-K413 PolarHBondContact O-N 3.27Å
410	K	87.8	Confident	88.5	Confident	81 Å²	81	59.2 Å²	59.2	35%	0.352	29%	0.285	S	S	.	.	H	α-helix	trans	-62.9	-45.6	168	-66.4	-177.8	-176.9	-162.7	0	111.2	E93 F214 S407 K413 Q414	E93-K410 WeakPolarHBondContact OE1-CE 3.43Å; E93-K410 IonicContact OE1-NZ 3.1Å; E93-K410 PolarHBondContact OE1-NZ 3.4Å; E93-K410 IonicContact OE2-NZ 3.88Å; E93-K410 PolarHBondContact OE2-NZ 3.22Å; F214-K410 HydrophobicContact CE2-CG 3.74Å; F214-K410 HydrophobicContact CZ-CG 4.22Å; S407-K410 WeakPolarHBondContact OG-CG 3.5Å; S407-K410 PolarHBondContact OG-N 3.46Å; K410-K413 PolarHBondContact O-N 3.02Å; K410-Q414 WeakPolarHBondContact O-CB 3.48Å; K410-Q414 PolarHBondContact O-N 2.89Å
411	D	89	Confident	88.4	Confident	58 Å²	58	62.2 Å²	62.2	31%	0.31	30%	0.299	S	S	.	.	H	α-helix	trans	-56.9	-50	173.6	-107.5	61.1	0	0	0	112.3	K405 L408 Q414 K415	K405-D411 WeakPolarHBondContact CD-OD2 3.48Å; K405-D411 WeakPolarHBondContact CE-OD2 3.27Å; K405-D411 IonicContact NZ-OD2 3.89Å; K405-D411 PolarHBondContact NZ-OD2 3.21Å; L408-D411 WeakPolarHBondContact O-CB 3.49Å; D411-Q414 PolarHBondContact O-N 3.05Å; D411-K415 WeakPolarHBondContact O-CB 3.46Å; D411-K415 PolarHBondContact O-N 2.89Å
412	L	91.1	Very high	88.4	Confident	72 Å²	72	64.5 Å²	64.5	38%	0.377	31%	0.31	S	S	.	.	H	α-helix	trans	-65.9	-38.9	179.5	-72.6	172.9	0	0	0	112.4	L408 H409 K415 R416	L408-L412 HydrophobicContact CD1-CD1 4.19Å; L408-L412 HydrophobicContact CD1-CG 4.34Å; L408-L412 HydrophobicContact CG-CD1 3.92Å; L408-L412 HydrophobicContact CG-CG 4.45Å; L408-L412 WeakPolarHBondContact O-CB 3.49Å; L408-L412 VanDerWaalsContact O-CG 3.29Å; L408-L412 WeakPolarHBondContact O-CG 3.17Å; L408-L412 PolarHBondContact O-N 2.99Å; H409-L412 PolarHBondContact O-N 2.8Å; L412-K415 PolarHBondContact O-N 3.45Å; L412-R416 WeakPolarHBondContact O-CG 3.36Å; L412-R416 PolarHBondContact O-N 2.99Å
413	K	90.2	Very high	88.4	Confident	25 Å²	25	68.5 Å²	68.5	11%	0.109	31%	0.312	C	S	.	.	H	α-helix	trans	-62.6	-48.8	173.4	-171.9	-158.9	171.4	-175.7	0	110.9	F214 L215 S216 H409 K410 K415 R416 R417	F214-K413 WeakPolarHBondContact O-CD 3.36Å; F214-K413 WeakPolarHBondContact O-CE 3.49Å; F214-K413 PolarHBondContact O-NZ 3.19Å; L215-K413 HydrophobicContact CD2-CG 4.43Å; L215-K413 WeakPolarHBondContact O-CE 3.45Å; L215-K413 PolarHBondContact O-NZ 3.08Å; L215-K413 VanDerWaalsContact O-NZ 3.14Å; S216-K413 PolarHBondContact O-NZ 2.85Å; H409-K413 WeakPolarHBondContact O-CB 3.29Å; H409-K413 PolarHBondContact O-N 3.27Å; K410-K413 PolarHBondContact O-N 3.02Å; K413-K415 VanDerWaalsContact C-N 3.31Å; K413-K415 PolarHBondContact O-N 3.23Å; K413-R416 PolarHBondContact O-N 2.94Å; K413-R416 VanDerWaalsContact O-N 3.17Å; K413-R417 PolarHBondContact O-N 2.9Å
414	Q	88.9	Confident	88.3	Confident	118 Å²	118	70 Å²	70	55%	0.551	32%	0.319	S	S	*	.	H	α-helix	trans	-60.6	-42.6	178.9	177.3	162.5	-25.2	0	0	111.1	K410 D411 R416 R417 E418	K410-Q414 WeakPolarHBondContact O-CB 3.48Å; K410-Q414 PolarHBondContact O-N 2.89Å; D411-Q414 PolarHBondContact O-N 3.05Å; Q414-R416 VanDerWaalsContact C-N 3.34Å; Q414-R416 PolarHBondContact O-N 2.84Å; Q414-R417 WeakPolarHBondContact O-CB 3.25Å; Q414-R417 PolarHBondContact O-N 3.35Å; Q414-R417 VanDerWaalsContact O-N 3.12Å; Q414-E418 HydrophobicContact CG-CG 4.23Å; Q414-E418 VanDerWaalsContact CG-OE1 3.29Å; Q414-E418 WeakPolarHBondContact CG-OE1 3.45Å; Q414-E418 PolarHBondContact NE2-OE1 3.48Å; Q414-E418 WeakPolarHBondContact O-CG 3.29Å; Q414-E418 PolarHBondContact O-N 3.05Å
415	K	90.4	Very high	88.6	Confident	119 Å²	119	77.2 Å²	77.2	52%	0.517	34%	0.34	S	S	.	.	H	α-helix	trans	-61.3	-37.2	175.4	-171.4	173.7	-178.1	177	0	113.2	D411 L412 K413 Q419	D411-K415 WeakPolarHBondContact O-CB 3.46Å; D411-K415 PolarHBondContact O-N 2.89Å; L412-K415 PolarHBondContact O-N 3.45Å; K413-K415 VanDerWaalsContact C-N 3.31Å; K413-K415 PolarHBondContact O-N 3.23Å; K415-Q419 WeakPolarHBondContact O-CB 3.49Å; K415-Q419 VanDerWaalsContact O-CG 3.26Å; K415-Q419 WeakPolarHBondContact O-CG 3.09Å; K415-Q419 PolarHBondContact O-N 3.43Å; K415-Q419 VanDerWaalsContact O-N 3.1Å
416	R	92.6	Very high	89	Confident	48 Å²	48	81.6 Å²	81.6	18%	0.181	36%	0.355	C	S	.	.	H	α-helix	trans	-63.6	-45.6	171.4	-73.7	-166.4	-57.9	-92.3	8.3	111.5	E228 Y231 L412 K413 Q414 Q419 R420	E228-R416 IonicContact OE1-NE 2.65Å; E228-R416 PolarHBondContact OE1-NE 3.36Å; E228-R416 IonicContact OE2-CZ 3.97Å; E228-R416 IonicContact OE2-NE 3.69Å; E228-R416 PolarHBondContact OE2-NE 3.5Å; E228-R416 IonicContact OE2-NH2 2.68Å; E228-R416 PolarHBondContact OE2-NH2 2.92Å; Y231-R416 VanDerWaalsContact CE1-NH2 3.29Å; Y231-R416 VanDerWaalsContact CZ-NH1 3.27Å; L412-R416 WeakPolarHBondContact O-CG 3.36Å; L412-R416 PolarHBondContact O-N 2.99Å; K413-R416 PolarHBondContact O-N 2.94Å; K413-R416 VanDerWaalsContact O-N 3.17Å; Q414-R416 VanDerWaalsContact C-N 3.34Å; Q414-R416 PolarHBondContact O-N 2.84Å; R416-Q419 WeakPolarHBondContact O-CB 3.5Å; R416-Q419 PolarHBondContact O-N 3.3Å; R416-R420 WeakPolarHBondContact O-CG 3.47Å; R416-R420 PolarHBondContact O-N 2.66Å
417	R	88.8	Confident	89.5	Confident	58 Å²	58	84.3 Å²	84.3	22%	0.219	36%	0.362	C	S	.	.	H	α-helix	trans	-60.6	-46.6	177.9	-161.7	-163.2	-148.8	169.8	4.3	112.2	E217 D218 K413 Q414 Q419 R420 E421	E217-R417 IonicContact OE1-NE 2.66Å; E217-R417 IonicContact OE2-CZ 2.85Å; E217-R417 IonicContact OE2-NE 3.42Å; E217-R417 PolarHBondContact OE2-NE 3.09Å; E217-R417 IonicContact OE2-NH2 2.62Å; E217-R417 PolarHBondContact OE2-NH2 2.76Å; D218-R417 IonicContact OD2-CZ 2.66Å; D218-R417 VanDerWaalsContact OD2-CZ 3.26Å; D218-R417 IonicContact OD2-NH1 3.41Å; D218-R417 PolarHBondContact OD2-NH1 3.2Å; D218-R417 IonicContact OD2-NH2 2.78Å; D218-R417 PolarHBondContact OD2-NH2 2.94Å; K413-R417 PolarHBondContact O-N 2.9Å; Q414-R417 WeakPolarHBondContact O-CB 3.25Å; Q414-R417 PolarHBondContact O-N 3.35Å; Q414-R417 VanDerWaalsContact O-N 3.12Å; R417-Q419 VanDerWaalsContact C-N 3.29Å; R417-Q419 PolarHBondContact O-N 2.7Å; R417-R420 WeakPolarHBondContact O-CB 3.37Å; R417-R420 PolarHBondContact O-N 2.66Å; R417-R420 VanDerWaalsContact O-N 3.1Å; R417-E421 PolarHBondContact O-N 3.12Å
418	E	90.1	Very high	89.8	Confident	100 Å²	100	86.7 Å²	86.7	47%	0.467	38%	0.382	S	S	.	.	H	α-helix	trans	-60.7	-37.2	176.4	-72	169.7	179.2	0	0	111.9	Q414 Q422	Q414-E418 HydrophobicContact CG-CG 4.23Å; Q414-E418 VanDerWaalsContact CG-OE1 3.29Å; Q414-E418 WeakPolarHBondContact CG-OE1 3.45Å; Q414-E418 PolarHBondContact NE2-OE1 3.48Å; Q414-E418 WeakPolarHBondContact O-CG 3.29Å; Q414-E418 PolarHBondContact O-N 3.05Å; E418-Q422 VanDerWaalsContact O-CB 3.29Å; E418-Q422 WeakPolarHBondContact O-CB 3.18Å; E418-Q422 PolarHBondContact O-N 2.8Å
419	Q	89.9	Confident	90.1	Very high	87 Å²	87	87.6 Å²	87.6	41%	0.407	40%	0.395	S	S	.	.	H	α-helix	trans	-68	-39.3	172.5	-73.8	175.4	1.6	0	0	112.7	K415 R416 R417 Q422 R423	K415-Q419 WeakPolarHBondContact O-CB 3.49Å; K415-Q419 VanDerWaalsContact O-CG 3.26Å; K415-Q419 WeakPolarHBondContact O-CG 3.09Å; K415-Q419 PolarHBondContact O-N 3.43Å; K415-Q419 VanDerWaalsContact O-N 3.1Å; R416-Q419 WeakPolarHBondContact O-CB 3.5Å; R416-Q419 PolarHBondContact O-N 3.3Å; R417-Q419 VanDerWaalsContact C-N 3.29Å; R417-Q419 PolarHBondContact O-N 2.7Å; Q419-Q422 PolarHBondContact O-N 3.02Å; Q419-R423 VanDerWaalsContact O-CG 3.26Å; Q419-R423 WeakPolarHBondContact O-CG 3.34Å; Q419-R423 PolarHBondContact O-N 3Å
420	R	89.3	Confident	90.3	Very high	24 Å²	24	93.8 Å²	93.8	9%	0.091	42%	0.421	C	S	.	.	H	α-helix	trans	-62.3	-52.1	173.6	-72.2	-172.7	-78.1	111.3	-12.8	110.8	E217 D227 E228 R416 R417 Q422 R423 E424	E217-R420 IonicContact OE1-CZ 3.13Å; E217-R420 VanDerWaalsContact OE1-CZ 3.3Å; E217-R420 IonicContact OE1-NH1 2.75Å; E217-R420 PolarHBondContact OE1-NH1 3.2Å; E217-R420 IonicContact OE1-NH2 2.72Å; E217-R420 PolarHBondContact OE1-NH2 2.88Å; D227-R420 WeakPolarHBondContact OD2-CD 3.23Å; E228-R420 IonicContact OE1-CZ 2.73Å; E228-R420 IonicContact OE1-NE 2.73Å; E228-R420 PolarHBondContact OE1-NE 2.96Å; E228-R420 IonicContact OE1-NH2 3.72Å; E228-R420 PolarHBondContact OE1-NH2 2.99Å; R416-R420 WeakPolarHBondContact O-CG 3.47Å; R416-R420 PolarHBondContact O-N 2.66Å; R417-R420 WeakPolarHBondContact O-CB 3.37Å; R417-R420 PolarHBondContact O-N 2.66Å; R417-R420 VanDerWaalsContact O-N 3.1Å; R420-Q422 VanDerWaalsContact C-N 3.3Å; R420-Q422 PolarHBondContact O-N 2.92Å; R420-R423 WeakPolarHBondContact O-CB 3.29Å; R420-R423 PolarHBondContact O-N 3.31Å; R420-E424 WeakPolarHBondContact O-CG 3.47Å; R420-E424 PolarHBondContact O-N 3.34Å
421	E	88.8	Confident	90.5	Very high	65 Å²	65	95.3 Å²	95.3	30%	0.304	43%	0.43	S	S	.	.	H	α-helix	trans	-58.6	-38.7	175.6	-71.5	-173.8	-140.2	0	0	112.4	R417 E424 R425	R417-E421 PolarHBondContact O-N 3.12Å; E421-E424 PolarHBondContact O-N 3.17Å; E421-R425 WeakPolarHBondContact O-CB 3.47Å; E421-R425 WeakPolarHBondContact O-CG 3.47Å; E421-R425 PolarHBondContact O-N 2.85Å; E421-R425 IonicContact OE2-CZ 2.89Å; E421-R425 IonicContact OE2-NE 2.73Å; E421-R425 IonicContact OE2-NH2 3.33Å; E421-R425 PolarHBondContact OE2-NH2 2.93Å
422	Q	90.9	Very high	90.8	Very high	105 Å²	105	99.3 Å²	99.3	49%	0.491	45%	0.446	S	S	.	.	H	α-helix	trans	-68.1	-34.3	176.4	-167.6	-178.5	55.7	0	0	112.3	E418 Q419 R420 R426	E418-Q422 VanDerWaalsContact O-CB 3.29Å; E418-Q422 WeakPolarHBondContact O-CB 3.18Å; E418-Q422 PolarHBondContact O-N 2.8Å; Q419-Q422 PolarHBondContact O-N 3.02Å; R420-Q422 VanDerWaalsContact C-N 3.3Å; R420-Q422 PolarHBondContact O-N 2.92Å; Q422-R426 WeakPolarHBondContact O-CB 3.43Å; Q422-R426 WeakPolarHBondContact O-CG 3.38Å; Q422-R426 PolarHBondContact O-N 3.38Å; Q422-R426 VanDerWaalsContact O-N 3.15Å
423	R	89.3	Confident	90.9	Very high	149 Å²	149	101.6 Å²	101.6	56%	0.562	46%	0.455	S	S	*	.	H	α-helix	trans	-66.2	-45	172.7	-71.2	164.6	178.6	-174.3	-0.4	111.1	Q419 R420 R426 R427	Q419-R423 VanDerWaalsContact O-CG 3.26Å; Q419-R423 WeakPolarHBondContact O-CG 3.34Å; Q419-R423 PolarHBondContact O-N 3Å; R420-R423 WeakPolarHBondContact O-CB 3.29Å; R420-R423 PolarHBondContact O-N 3.31Å; R423-R426 PolarHBondContact O-N 3.3Å; R423-R427 PolarHBondContact O-N 2.83Å
424	E	86.8	Confident	91.2	Very high	119 Å²	119	105.9 Å²	105.9	56%	0.556	48%	0.479	S	S	*	.	H	α-helix	trans	-61.6	-50.8	177.5	-71.1	170.5	-178.2	0	0	111.6	R420 E421 R426 R427 A428	R420-E424 WeakPolarHBondContact O-CG 3.47Å; R420-E424 PolarHBondContact O-N 3.34Å; E421-E424 PolarHBondContact O-N 3.17Å; E424-R426 PolarHBondContact O-N 2.9Å; E424-R427 WeakPolarHBondContact O-CA 3.27Å; E424-R427 WeakPolarHBondContact O-CB 3.46Å; E424-R427 PolarHBondContact O-N 3.3Å; E424-A428 PolarHBondContact O-N 3.47Å
425	R	90.6	Very high	91.6	Very high	167 Å²	167	105.1 Å²	105.1	63%	0.63	48%	0.478	S	S	*	.	H	α-helix	trans	-58.3	-34.6	176.5	-66.7	170.1	-159.9	-158.8	10	112.4	E421 A429	E421-R425 WeakPolarHBondContact O-CB 3.47Å; E421-R425 WeakPolarHBondContact O-CG 3.47Å; E421-R425 PolarHBondContact O-N 2.85Å; E421-R425 IonicContact OE2-CZ 2.89Å; E421-R425 IonicContact OE2-NE 2.73Å; E421-R425 IonicContact OE2-NH2 3.33Å; E421-R425 PolarHBondContact OE2-NH2 2.93Å; R425-A429 VanDerWaalsContact O-CB 3.28Å; R425-A429 WeakPolarHBondContact O-CB 3.26Å; R425-A429 PolarHBondContact O-N 3.18Å
426	R	91.9	Very high	91.9	Very high	157 Å²	157	107.8 Å²	107.8	59%	0.592	49%	0.485	S	S	*	.	H	α-helix	trans	-74.7	-20	174.4	-75.1	175.2	-175.7	-169.3	6.7	114.3	Q422 R423 E424 K430	Q422-R426 WeakPolarHBondContact O-CB 3.43Å; Q422-R426 WeakPolarHBondContact O-CG 3.38Å; Q422-R426 PolarHBondContact O-N 3.38Å; Q422-R426 VanDerWaalsContact O-N 3.15Å; R423-R426 PolarHBondContact O-N 3.3Å; E424-R426 PolarHBondContact O-N 2.9Å; R426-K430 WeakPolarHBondContact O-CG 3.36Å
427	R	89	Confident	92.1	Very high	175 Å²	175	109.8 Å²	109.8	66%	0.66	50%	0.498	S	S	*	.	H	α-helix	trans	-80.9	-53.2	170.6	-73.3	178.7	177.5	178.3	-1.6	109.9	R423 E424 A429 K430 E431	R423-R427 PolarHBondContact O-N 2.83Å; E424-R427 WeakPolarHBondContact O-CA 3.27Å; E424-R427 WeakPolarHBondContact O-CB 3.46Å; E424-R427 PolarHBondContact O-N 3.3Å; R427-A429 VanDerWaalsContact C-N 3.31Å; R427-A429 PolarHBondContact O-N 3.08Å; R427-K430 WeakPolarHBondContact O-CA 3.41Å; R427-K430 WeakPolarHBondContact O-CB 3.22Å; R427-K430 PolarHBondContact O-N 2.95Å; R427-E431 WeakPolarHBondContact O-CG 3.47Å; R427-E431 PolarHBondContact O-N 2.9Å
428	A	92.4	Very high	92.4	Very high	52 Å²	52	111.6 Å²	111.6	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-54	-44.1	177.4	0	0	0	0	0	112.8	E424 K430 E431 E432	E424-A428 PolarHBondContact O-N 3.47Å; A428-K430 VanDerWaalsContact C-N 3.29Å; A428-K430 PolarHBondContact O-N 2.56Å; A428-E431 PolarHBondContact O-N 3.48Å; A428-E432 WeakPolarHBondContact O-CB 3.49Å; A428-E432 PolarHBondContact O-N 3.06Å
429	A	94.3	Very high	92.7	Very high	54 Å²	54	112.7 Å²	112.7	45%	0.446	51%	0.514	S	S	.	.	H	α-helix	trans	-63.7	-30.6	176.8	0	0	0	0	0	113.7	R425 R427 E433	R425-A429 VanDerWaalsContact O-CB 3.28Å; R425-A429 WeakPolarHBondContact O-CB 3.26Å; R425-A429 PolarHBondContact O-N 3.18Å; R427-A429 VanDerWaalsContact C-N 3.31Å; R427-A429 PolarHBondContact O-N 3.08Å; A429-E433 VanDerWaalsContact O-CB 3.32Å; A429-E433 WeakPolarHBondContact O-CB 3.42Å; A429-E433 PolarHBondContact O-N 3.17Å
430	K	94.4	Very high	93	Very high	137 Å²	137	113 Å²	113	60%	0.596	52%	0.519	S	S	*	.	H	α-helix	trans	-77.7	-35.8	174.1	-74.4	-178	171.8	-159.6	0	112.2	R426 R427 A428 E433 L434	R426-K430 WeakPolarHBondContact O-CG 3.36Å; R427-K430 WeakPolarHBondContact O-CA 3.41Å; R427-K430 WeakPolarHBondContact O-CB 3.22Å; R427-K430 PolarHBondContact O-N 2.95Å; A428-K430 VanDerWaalsContact C-N 3.29Å; A428-K430 PolarHBondContact O-N 2.56Å; K430-E433 PolarHBondContact O-N 3.02Å; K430-L434 WeakPolarHBondContact O-CB 3.37Å; K430-L434 VanDerWaalsContact O-CG 3.23Å; K430-L434 WeakPolarHBondContact O-CG 3.42Å; K430-L434 PolarHBondContact O-N 3.41Å
431	E	92.5	Very high	93.2	Very high	112 Å²	112	117.5 Å²	117.5	52%	0.523	54%	0.541	S	S	.	.	H	α-helix	trans	-65.6	-41.3	174.5	-70.5	154.3	-157	0	0	110.3	R427 A428 L434 L435	R427-E431 WeakPolarHBondContact O-CG 3.47Å; R427-E431 PolarHBondContact O-N 2.9Å; A428-E431 PolarHBondContact O-N 3.48Å; E431-L434 PolarHBondContact O-N 3.26Å; E431-L435 WeakPolarHBondContact O-CB 3.2Å; E431-L435 VanDerWaalsContact O-CG 3.27Å; E431-L435 WeakPolarHBondContact O-CG 3.43Å; E431-L435 PolarHBondContact O-N 2.76Å
432	E	94.4	Very high	93.6	Very high	142 Å²	142	118.2 Å²	118.2	66%	0.664	54%	0.544	S	S	*	.	H	α-helix	trans	-63.6	-43.4	171.3	-171.7	-179.3	174.3	0	0	112.4	A428 L435 R436	A428-E432 WeakPolarHBondContact O-CB 3.49Å; A428-E432 PolarHBondContact O-N 3.06Å; E432-L435 PolarHBondContact O-N 2.72Å; E432-R436 VanDerWaalsContact O-CB 3.32Å; E432-R436 WeakPolarHBondContact O-CB 3.35Å; E432-R436 PolarHBondContact O-N 3.17Å
433	E	94.3	Very high	93.8	Very high	121 Å²	121	117.8 Å²	117.8	57%	0.565	54%	0.542	S	S	*	.	H	α-helix	trans	-61.5	-43.9	174.5	-176.9	175.1	-154.2	0	0	112.1	A429 K430 R436 L437	A429-E433 VanDerWaalsContact O-CB 3.32Å; A429-E433 WeakPolarHBondContact O-CB 3.42Å; A429-E433 PolarHBondContact O-N 3.17Å; K430-E433 PolarHBondContact O-N 3.02Å; E433-R436 PolarHBondContact O-N 3.31Å; E433-L437 HydrophobicContact CG-CD1 4.29Å; E433-L437 VanDerWaalsContact O-CG 3.31Å; E433-L437 WeakPolarHBondContact O-CG 3.45Å; E433-L437 PolarHBondContact O-N 2.78Å
434	L	96.3	Very high	94.2	Very high	114 Å²	114	117.2 Å²	117.2	60%	0.597	54%	0.543	S	S	*	.	H	α-helix	trans	-65	-44.9	176.7	-74.8	168	0	0	0	112.2	K430 E431 R436 L437 Q438	K430-L434 WeakPolarHBondContact O-CB 3.37Å; K430-L434 VanDerWaalsContact O-CG 3.23Å; K430-L434 WeakPolarHBondContact O-CG 3.42Å; K430-L434 PolarHBondContact O-N 3.41Å; E431-L434 PolarHBondContact O-N 3.26Å; L434-R436 VanDerWaalsContact C-N 3.3Å; L434-R436 PolarHBondContact O-N 3.14Å; L434-L437 PolarHBondContact O-N 2.73Å; L434-Q438 PolarHBondContact O-N 2.82Å
435	L	96.6	Very high	94.6	Very high	102 Å²	102	117 Å²	117	53%	0.534	54%	0.542	S	S	.	.	H	α-helix	trans	-60.7	-40.4	175.1	-74.8	167.9	0	0	0	111.5	E431 E432 Q438 Q439	E431-L435 WeakPolarHBondContact O-CB 3.2Å; E431-L435 VanDerWaalsContact O-CG 3.27Å; E431-L435 WeakPolarHBondContact O-CG 3.43Å; E431-L435 PolarHBondContact O-N 2.76Å; E432-L435 PolarHBondContact O-N 2.72Å; L435-Q438 PolarHBondContact O-N 2.99Å; L435-Q439 WeakPolarHBondContact O-CG 3.32Å; L435-Q439 PolarHBondContact O-N 2.81Å
436	R	96.9	Very high	94.9	Very high	176 Å²	176	116.9 Å²	116.9	66%	0.664	54%	0.542	S	S	*	.	H	α-helix	trans	-66.7	-39	175.7	-174.6	177.2	-179.3	176.8	0.7	112.4	E432 E433 L434 Q439 L440	E432-R436 VanDerWaalsContact O-CB 3.32Å; E432-R436 WeakPolarHBondContact O-CB 3.35Å; E432-R436 PolarHBondContact O-N 3.17Å; E433-R436 PolarHBondContact O-N 3.31Å; L434-R436 VanDerWaalsContact C-N 3.3Å; L434-R436 PolarHBondContact O-N 3.14Å; R436-Q439 PolarHBondContact O-N 2.87Å; R436-L440 HydrophobicContact CG-CD1 4.4Å; R436-L440 VanDerWaalsContact O-CG 3.31Å; R436-L440 WeakPolarHBondContact O-CG 3.23Å; R436-L440 PolarHBondContact O-N 2.79Å; R436-L440 VanDerWaalsContact O-N 3.07Å
437	L	96.1	Very high	95.1	Very high	89 Å²	89	115.1 Å²	115.1	47%	0.466	54%	0.538	S	S	.	.	H	α-helix	trans	-65.5	-40.8	174.3	-74.1	169.4	0	0	0	111.6	E433 L434 L440 Q441	E433-L437 HydrophobicContact CG-CD1 4.29Å; E433-L437 VanDerWaalsContact O-CG 3.31Å; E433-L437 WeakPolarHBondContact O-CG 3.45Å; E433-L437 PolarHBondContact O-N 2.78Å; L434-L437 PolarHBondContact O-N 2.73Å; L437-L440 PolarHBondContact O-N 3.37Å; L437-Q441 WeakPolarHBondContact O-CG 3.2Å; L437-Q441 PolarHBondContact O-N 3.43Å
438	Q	96.2	Very high	95.5	Very high	97 Å²	97	111.1 Å²	111.1	45%	0.453	53%	0.53	S	S	.	.	H	α-helix	trans	-61.9	-47.1	174.2	-175.4	-174.8	-29	0	0	111.4	L434 L435 L440 Q441 E442	L434-Q438 PolarHBondContact O-N 2.82Å; L435-Q438 PolarHBondContact O-N 2.99Å; Q438-L440 VanDerWaalsContact C-N 3.29Å; Q438-L440 PolarHBondContact O-N 2.92Å; Q438-Q441 WeakPolarHBondContact O-CA 3.4Å; Q438-Q441 WeakPolarHBondContact O-CB 3.2Å; Q438-Q441 PolarHBondContact O-N 3.33Å; Q438-E442 WeakPolarHBondContact CG-OE1 3.44Å; Q438-E442 PolarHBondContact NE2-OE1 3.18Å; Q438-E442 PolarHBondContact O-N 3.29Å
439	Q	95.9	Very high	95.7	Very high	122 Å²	122	114.1 Å²	114.1	57%	0.57	54%	0.535	S	S	*	.	H	α-helix	trans	-57.9	-40.6	176	-73.9	170.5	-3.6	0	0	112.3	L435 R436 Q441 E442 E443	L435-Q439 WeakPolarHBondContact O-CG 3.32Å; L435-Q439 PolarHBondContact O-N 2.81Å; R436-Q439 PolarHBondContact O-N 2.87Å; Q439-Q441 VanDerWaalsContact C-N 3.34Å; Q439-E442 PolarHBondContact O-N 3.34Å; Q439-E443 WeakPolarHBondContact O-CB 3.38Å; Q439-E443 PolarHBondContact O-N 3.34Å
440	L	96.9	Very high	95.7	Very high	95 Å²	95	117.4 Å²	117.4	50%	0.497	54%	0.541	S	S	.	.	H	α-helix	trans	-68.8	-29.4	175.4	-71.3	169.8	0	0	0	113.1	R436 L437 Q438 K444	R436-L440 HydrophobicContact CG-CD1 4.4Å; R436-L440 VanDerWaalsContact O-CG 3.31Å; R436-L440 WeakPolarHBondContact O-CG 3.23Å; R436-L440 PolarHBondContact O-N 2.79Å; R436-L440 VanDerWaalsContact O-N 3.07Å; L437-L440 PolarHBondContact O-N 3.37Å; Q438-L440 VanDerWaalsContact C-N 3.29Å; Q438-L440 PolarHBondContact O-N 2.92Å; L440-K444 VanDerWaalsContact O-CB 3.29Å; L440-K444 WeakPolarHBondContact O-CB 3.42Å; L440-K444 PolarHBondContact O-N 2.99Å; L440-K444 VanDerWaalsContact O-N 3.13Å
441	Q	93	Very high	95.8	Very high	118 Å²	118	115.2 Å²	115.2	55%	0.551	54%	0.536	S	S	*	.	H	α-helix	trans	-70.7	-49	171.4	-73.7	171.4	-23.9	0	0	111	L437 Q438 Q439 E443 K444 E445	L437-Q441 WeakPolarHBondContact O-CG 3.2Å; L437-Q441 PolarHBondContact O-N 3.43Å; Q438-Q441 WeakPolarHBondContact O-CA 3.4Å; Q438-Q441 WeakPolarHBondContact O-CB 3.2Å; Q438-Q441 PolarHBondContact O-N 3.33Å; Q439-Q441 VanDerWaalsContact C-N 3.34Å; Q441-E443 VanDerWaalsContact C-N 3.34Å; Q441-E443 PolarHBondContact O-N 3.46Å; Q441-K444 WeakPolarHBondContact O-CB 3.24Å; Q441-K444 PolarHBondContact O-N 3.17Å; Q441-E445 WeakPolarHBondContact O-CG 3.46Å; Q441-E445 PolarHBondContact O-N 3.14Å
442	E	96.2	Very high	95.9	Very high	79 Å²	79	115.6 Å²	115.6	37%	0.369	54%	0.537	S	S	.	.	H	α-helix	trans	-60.2	-40.3	177.1	-69.9	178.5	-153.6	0	0	112.2	Q438 Q439 R446	Q438-E442 WeakPolarHBondContact CG-OE1 3.44Å; Q438-E442 PolarHBondContact NE2-OE1 3.18Å; Q438-E442 PolarHBondContact O-N 3.29Å; Q439-E442 PolarHBondContact O-N 3.34Å; E442-R446 WeakPolarHBondContact O-CD 3.5Å; E442-R446 WeakPolarHBondContact O-CG 3.22Å; E442-R446 PolarHBondContact O-N 2.94Å
443	E	95.6	Very high	96	Very high	97 Å²	97	114.4 Å²	114.4	45%	0.453	54%	0.535	S	S	.	.	H	α-helix	trans	-62.3	-42.7	171.6	-88.6	-161.8	-148	0	0	112.7	Q439 Q441 K447	Q439-E443 WeakPolarHBondContact O-CB 3.38Å; Q439-E443 PolarHBondContact O-N 3.34Å; Q441-E443 VanDerWaalsContact C-N 3.34Å; Q441-E443 PolarHBondContact O-N 3.46Å; E443-K447 WeakPolarHBondContact O-CB 3.42Å; E443-K447 WeakPolarHBondContact O-CD 3.41Å; E443-K447 VanDerWaalsContact O-CG 3.28Å; E443-K447 WeakPolarHBondContact O-CG 3.3Å; E443-K447 PolarHBondContact O-N 2.87Å; E443-K447 IonicContact OE2-NZ 3.59Å; E443-K447 PolarHBondContact OE2-NZ 3.03Å
444	K	97.1	Very high	96.1	Very high	136 Å²	136	114 Å²	114	59%	0.591	54%	0.536	S	S	*	.	H	α-helix	trans	-65.5	-42.2	179.6	-178.4	-168	172.7	-163.9	0	111	L440 Q441 K447 L448	L440-K444 VanDerWaalsContact O-CB 3.29Å; L440-K444 WeakPolarHBondContact O-CB 3.42Å; L440-K444 PolarHBondContact O-N 2.99Å; L440-K444 VanDerWaalsContact O-N 3.13Å; Q441-K444 WeakPolarHBondContact O-CB 3.24Å; Q441-K444 PolarHBondContact O-N 3.17Å; K444-K447 PolarHBondContact O-N 3.47Å; K444-L448 HydrophobicContact CG-CD1 4.17Å; K444-L448 WeakPolarHBondContact O-CG 3.48Å; K444-L448 PolarHBondContact O-N 3.26Å
445	E	95.3	Very high	96.1	Very high	114 Å²	114	112.2 Å²	112.2	53%	0.533	53%	0.525	S	S	.	.	H	α-helix	trans	-64.7	-44.1	177.9	-73.1	176.1	-175.1	0	0	111.5	Q441 K447 L448 Q449	Q441-E445 WeakPolarHBondContact O-CG 3.46Å; Q441-E445 PolarHBondContact O-N 3.14Å; E445-K447 PolarHBondContact O-N 3.37Å; E445-L448 PolarHBondContact O-N 3.22Å; E445-Q449 WeakPolarHBondContact O-CG 3.21Å; E445-Q449 PolarHBondContact O-N 3.41Å
446	R	97.4	Very high	96	Very high	166 Å²	166	111.9 Å²	111.9	63%	0.626	52%	0.52	S	S	*	.	H	α-helix	trans	-57.4	-46.2	172.4	-70.8	164.8	-173.6	-109	5.1	112.2	E442 L448 Q449 E450	E442-R446 WeakPolarHBondContact O-CD 3.5Å; E442-R446 WeakPolarHBondContact O-CG 3.22Å; E442-R446 PolarHBondContact O-N 2.94Å; R446-L448 VanDerWaalsContact C-N 3.31Å; R446-L448 PolarHBondContact O-N 3.41Å; R446-Q449 PolarHBondContact O-N 2.96Å; R446-E450 WeakPolarHBondContact O-CB 3.4Å; R446-E450 PolarHBondContact O-N 3.42Å
447	K	96.9	Very high	96	Very high	119 Å²	119	106.1 Å²	106.1	52%	0.517	51%	0.51	S	S	.	.	H	α-helix	trans	-66.1	-31	178.5	-73.2	162.8	-178.6	164.1	0	112.6	E443 K444 E445 L451	E443-K447 WeakPolarHBondContact O-CB 3.42Å; E443-K447 WeakPolarHBondContact O-CD 3.41Å; E443-K447 VanDerWaalsContact O-CG 3.28Å; E443-K447 WeakPolarHBondContact O-CG 3.3Å; E443-K447 PolarHBondContact O-N 2.87Å; E443-K447 IonicContact OE2-NZ 3.59Å; E443-K447 PolarHBondContact OE2-NZ 3.03Å; K444-K447 PolarHBondContact O-N 3.47Å; E445-K447 PolarHBondContact O-N 3.37Å; K447-L451 WeakPolarHBondContact O-CB 3.19Å; K447-L451 PolarHBondContact O-N 3.48Å; K447-L451 VanDerWaalsContact O-N 3.09Å
448	L	96.7	Very high	95.9	Very high	92 Å²	92	107.3 Å²	107.3	48%	0.482	51%	0.513	S	S	.	.	H	α-helix	trans	-72.4	-42.5	173.1	-74.8	168.7	0	0	0	112	K444 E445 R446 L451 E452	K444-L448 HydrophobicContact CG-CD1 4.17Å; K444-L448 WeakPolarHBondContact O-CG 3.48Å; K444-L448 PolarHBondContact O-N 3.26Å; E445-L448 PolarHBondContact O-N 3.22Å; R446-L448 VanDerWaalsContact C-N 3.31Å; R446-L448 PolarHBondContact O-N 3.41Å; L448-L451 PolarHBondContact O-N 3.38Å; L448-E452 WeakPolarHBondContact O-CB 3.3Å; L448-E452 PolarHBondContact O-N 3.34Å
449	Q	95.8	Very high	96	Very high	114 Å²	114	108.2 Å²	108.2	53%	0.533	51%	0.513	S	S	.	.	H	α-helix	trans	-62.5	-41.7	174.8	-70.4	166.8	0.1	0	0	111.7	E445 R446 E452 L453	E445-Q449 WeakPolarHBondContact O-CG 3.21Å; E445-Q449 PolarHBondContact O-N 3.41Å; R446-Q449 PolarHBondContact O-N 2.96Å; Q449-E452 PolarHBondContact O-N 2.91Å; Q449-L453 WeakPolarHBondContact O-CB 3.41Å; Q449-L453 VanDerWaalsContact O-CG 3.31Å; Q449-L453 WeakPolarHBondContact O-CG 3.32Å; Q449-L453 PolarHBondContact O-N 3.22Å
450	E	95.8	Very high	95.9	Very high	123 Å²	123	107.5 Å²	107.5	58%	0.575	51%	0.509	S	S	*	.	H	α-helix	trans	-62.2	-44.3	174.1	-174.9	174.9	-161.7	0	0	111.7	R446 E452 L453 L454	R446-E450 WeakPolarHBondContact O-CB 3.4Å; R446-E450 PolarHBondContact O-N 3.42Å; E450-E452 PolarHBondContact O-N 3.18Å; E450-L453 PolarHBondContact O-N 2.91Å; E450-L454 HydrophobicContact CG-CD1 4.33Å; E450-L454 WeakPolarHBondContact O-CB 3.34Å; E450-L454 VanDerWaalsContact O-CG 3.27Å; E450-L454 WeakPolarHBondContact O-CG 3.44Å; E450-L454 PolarHBondContact O-N 2.83Å
451	L	95.2	Very high	95.8	Very high	92 Å²	92	105.8 Å²	105.8	48%	0.482	51%	0.508	S	S	.	.	H	α-helix	trans	-62.7	-40.1	175.1	-167.8	84.4	0	0	0	112.3	K447 L448 L454 Q455	K447-L451 WeakPolarHBondContact O-CB 3.19Å; K447-L451 PolarHBondContact O-N 3.48Å; K447-L451 VanDerWaalsContact O-N 3.09Å; L448-L451 PolarHBondContact O-N 3.38Å; L451-L454 PolarHBondContact O-N 2.8Å; L451-Q455 WeakPolarHBondContact O-CG 3.41Å; L451-Q455 PolarHBondContact O-N 3.21Å
452	E	95.2	Very high	95.9	Very high	119 Å²	119	104.5 Å²	104.5	56%	0.556	50%	0.503	S	S	*	.	H	α-helix	trans	-65.6	-47.9	178.7	-174.7	162.9	-136.1	0	0	111.2	L448 Q449 E450 L454 Q455 E456	L448-E452 WeakPolarHBondContact O-CB 3.3Å; L448-E452 PolarHBondContact O-N 3.34Å; Q449-E452 PolarHBondContact O-N 2.91Å; E450-E452 PolarHBondContact O-N 3.18Å; E452-L454 VanDerWaalsContact C-N 3.31Å; E452-L454 PolarHBondContact O-N 3.16Å; E452-Q455 PolarHBondContact O-N 2.99Å; E452-Q455 VanDerWaalsContact O-N 3.13Å; E452-E456 WeakPolarHBondContact O-CG 3.37Å; E452-E456 PolarHBondContact O-N 2.92Å
453	L	97.5	Very high	95.9	Very high	118 Å²	118	107.5 Å²	107.5	62%	0.618	51%	0.51	S	S	*	.	H	α-helix	trans	-58.5	-40.4	174.2	-71.9	168.7	0	0	0	112.4	Q449 E450 E456 A457	Q449-L453 WeakPolarHBondContact O-CB 3.41Å; Q449-L453 VanDerWaalsContact O-CG 3.31Å; Q449-L453 WeakPolarHBondContact O-CG 3.32Å; Q449-L453 PolarHBondContact O-N 3.22Å; E450-L453 PolarHBondContact O-N 2.91Å; L453-E456 PolarHBondContact O-N 3.43Å; L453-A457 WeakPolarHBondContact O-CB 3.49Å; L453-A457 PolarHBondContact O-N 2.97Å
454	L	95.9	Very high	96	Very high	111 Å²	111	108.2 Å²	108.2	58%	0.581	52%	0.517	S	S	*	.	H	α-helix	trans	-65.4	-40.7	175.1	-73	169.1	0	0	0	112.1	E450 L451 E452 A457 Q458	E450-L454 HydrophobicContact CG-CD1 4.33Å; E450-L454 WeakPolarHBondContact O-CB 3.34Å; E450-L454 VanDerWaalsContact O-CG 3.27Å; E450-L454 WeakPolarHBondContact O-CG 3.44Å; E450-L454 PolarHBondContact O-N 2.83Å; L451-L454 PolarHBondContact O-N 2.8Å; E452-L454 VanDerWaalsContact C-N 3.31Å; E452-L454 PolarHBondContact O-N 3.16Å; L454-A457 PolarHBondContact O-N 2.66Å; L454-Q458 WeakPolarHBondContact O-CB 3.34Å; L454-Q458 PolarHBondContact O-N 2.87Å
455	Q	95.2	Very high	95.9	Very high	78 Å²	78	106.5 Å²	106.5	36%	0.364	51%	0.513	S	S	.	.	H	α-helix	trans	-65.9	-38.9	174.5	-73.9	-179.4	28.8	0	0	112.4	L451 E452 R459	L451-Q455 WeakPolarHBondContact O-CG 3.41Å; L451-Q455 PolarHBondContact O-N 3.21Å; E452-Q455 PolarHBondContact O-N 2.99Å; E452-Q455 VanDerWaalsContact O-N 3.13Å; Q455-R459 WeakPolarHBondContact O-CB 3.47Å; Q455-R459 VanDerWaalsContact O-CG 3.24Å; Q455-R459 WeakPolarHBondContact O-CG 3.31Å; Q455-R459 PolarHBondContact O-N 3.45Å
456	E	96.1	Very high	95.9	Very high	95 Å²	95	106.8 Å²	106.8	44%	0.444	52%	0.515	S	S	.	.	H	α-helix	trans	-66.3	-44.6	175.3	-69.1	-154.5	136.4	0	0	111.9	E452 L453 Q458 R459 Q460	E452-E456 WeakPolarHBondContact O-CG 3.37Å; E452-E456 PolarHBondContact O-N 2.92Å; L453-E456 PolarHBondContact O-N 3.43Å; E456-Q458 VanDerWaalsContact C-N 3.33Å; E456-Q458 PolarHBondContact O-N 3.46Å; E456-R459 CarbonylContact O-C 3.54Å; E456-R459 PolarHBondContact O-N 2.83Å; E456-Q460 VanDerWaalsContact O-CG 3.31Å; E456-Q460 WeakPolarHBondContact O-CG 3.45Å; E456-Q460 PolarHBondContact O-N 2.87Å
457	A	96.3	Very high	95.7	Very high	54 Å²	54	103.9 Å²	103.9	45%	0.446	51%	0.509	S	S	.	.	H	α-helix	trans	-59.6	-42.3	175.2	0	0	0	0	0	111.8	L453 L454 Q460 A461	L453-A457 WeakPolarHBondContact O-CB 3.49Å; L453-A457 PolarHBondContact O-N 2.97Å; L454-A457 PolarHBondContact O-N 2.66Å; A457-Q460 PolarHBondContact O-N 3.15Å; A457-A461 PolarHBondContact O-N 3.47Å
458	Q	94.6	Very high	95.5	Very high	114 Å²	114	102.8 Å²	102.8	53%	0.533	51%	0.505	S	S	.	.	H	α-helix	trans	-61.5	-49.1	173.7	-176.4	179.7	-21	0	0	111.6	L454 E456 Q460 A461 E462	L454-Q458 WeakPolarHBondContact O-CB 3.34Å; L454-Q458 PolarHBondContact O-N 2.87Å; E456-Q458 VanDerWaalsContact C-N 3.33Å; E456-Q458 PolarHBondContact O-N 3.46Å; Q458-Q460 PolarHBondContact O-N 3.35Å; Q458-A461 PolarHBondContact O-N 2.83Å; Q458-A461 VanDerWaalsContact O-N 3.15Å; Q458-E462 HydrophobicContact CG-CG 4.36Å; Q458-E462 WeakPolarHBondContact CG-OE1 3.46Å; Q458-E462 PolarHBondContact NE2-OE1 3.34Å; Q458-E462 WeakPolarHBondContact O-CB 3.43Å; Q458-E462 WeakPolarHBondContact O-CG 3.15Å; Q458-E462 PolarHBondContact O-N 3.31Å
459	R	96.8	Very high	95.3	Very high	117 Å²	117	102.4 Å²	102.4	44%	0.442	50%	0.501	S	S	.	.	H	α-helix	trans	-63.1	-19.8	176.4	-70.2	170.9	-168.6	132.2	9.5	113.7	Q455 E456 R463	Q455-R459 WeakPolarHBondContact O-CB 3.47Å; Q455-R459 VanDerWaalsContact O-CG 3.24Å; Q455-R459 WeakPolarHBondContact O-CG 3.31Å; Q455-R459 PolarHBondContact O-N 3.45Å; E456-R459 CarbonylContact O-C 3.54Å; E456-R459 PolarHBondContact O-N 2.83Å; R459-R463 PolarHBondContact O-NE 3.47Å; R459-R463 PolarHBondContact O-NH2 3.34Å
460	Q	95.3	Very high	95.1	Very high	107 Å²	107	103.4 Å²	103.4	50%	0.5	51%	0.506	S	S	.	.	H	α-helix	trans	-83.4	-45.5	172.4	-71.9	173.5	25.3	0	0	110.7	E456 A457 Q458 E462 R463 L464	E456-Q460 VanDerWaalsContact O-CG 3.31Å; E456-Q460 WeakPolarHBondContact O-CG 3.45Å; E456-Q460 PolarHBondContact O-N 2.87Å; A457-Q460 PolarHBondContact O-N 3.15Å; Q458-Q460 PolarHBondContact O-N 3.35Å; Q460-E462 PolarHBondContact O-N 3.1Å; Q460-R463 PolarHBondContact O-N 3.47Å; Q460-L464 WeakPolarHBondContact O-CG 3.21Å; Q460-L464 PolarHBondContact O-N 3.2Å
461	A	94.6	Very high	95	Very high	58 Å²	58	105.8 Å²	105.8	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-60.9	-41.9	176	0	0	0	0	0	112.6	A457 Q458 R463 L464 L465	A457-A461 PolarHBondContact O-N 3.47Å; Q458-A461 PolarHBondContact O-N 2.83Å; Q458-A461 VanDerWaalsContact O-N 3.15Å; A461-R463 VanDerWaalsContact C-N 3.34Å; A461-R463 PolarHBondContact O-N 3.08Å; A461-L464 PolarHBondContact O-N 2.98Å; A461-L465 WeakPolarHBondContact O-CB 3.38Å; A461-L465 PolarHBondContact O-N 2.66Å
462	E	94.4	Very high	94.9	Very high	92 Å²	92	108.6 Å²	108.6	43%	0.43	51%	0.514	S	S	.	.	H	α-helix	trans	-60.9	-40.4	175.3	-73.7	170.3	179.5	0	0	112.2	Q458 Q460 Q466	Q458-E462 HydrophobicContact CG-CG 4.36Å; Q458-E462 WeakPolarHBondContact CG-OE1 3.46Å; Q458-E462 PolarHBondContact NE2-OE1 3.34Å; Q458-E462 WeakPolarHBondContact O-CB 3.43Å; Q458-E462 WeakPolarHBondContact O-CG 3.15Å; Q458-E462 PolarHBondContact O-N 3.31Å; Q460-E462 PolarHBondContact O-N 3.1Å; E462-Q466 VanDerWaalsContact O-CG 3.29Å; E462-Q466 WeakPolarHBondContact O-CG 3.49Å; E462-Q466 PolarHBondContact O-N 2.81Å
463	R	96.6	Very high	94.8	Very high	141 Å²	141	110.1 Å²	110.1	53%	0.532	51%	0.514	S	S	.	.	H	α-helix	trans	-68.2	-45	175.4	-85.5	179.7	-78.5	-180	-4.3	112.4	R459 Q460 A461 L465 Q466 E467	R459-R463 PolarHBondContact O-NE 3.47Å; R459-R463 PolarHBondContact O-NH2 3.34Å; Q460-R463 PolarHBondContact O-N 3.47Å; A461-R463 VanDerWaalsContact C-N 3.34Å; A461-R463 PolarHBondContact O-N 3.08Å; R463-L465 VanDerWaalsContact C-N 3.28Å; R463-L465 PolarHBondContact O-N 3Å; R463-Q466 PolarHBondContact O-N 3.13Å; R463-E467 WeakPolarHBondContact O-CG 3.27Å; R463-E467 PolarHBondContact O-N 3.44Å
464	L	96.6	Very high	94.6	Very high	112 Å²	112	106.4 Å²	106.4	59%	0.586	50%	0.498	S	S	*	.	H	α-helix	trans	-61.5	-37	176.3	-70.9	171.4	0	0	0	112	Q460 A461 E467 E468	Q460-L464 WeakPolarHBondContact O-CG 3.21Å; Q460-L464 PolarHBondContact O-N 3.2Å; A461-L464 PolarHBondContact O-N 2.98Å; L464-E467 PolarHBondContact O-N 2.91Å; L464-E468 WeakPolarHBondContact O-CB 3.4Å; L464-E468 PolarHBondContact O-N 3.43Å
465	L	95.9	Very high	94.5	Very high	100 Å²	100	107 Å²	107	52%	0.524	50%	0.498	S	S	.	.	H	α-helix	trans	-69.6	-38.9	175.6	-173.5	147.1	0	0	0	111.9	A461 R463 E468 E469	A461-L465 WeakPolarHBondContact O-CB 3.38Å; A461-L465 PolarHBondContact O-N 2.66Å; R463-L465 VanDerWaalsContact C-N 3.28Å; R463-L465 PolarHBondContact O-N 3Å; L465-E468 PolarHBondContact O-N 2.85Å; L465-E469 HydrophobicContact CD2-CG 4.36Å; L465-E469 WeakPolarHBondContact O-CB 3.38Å; L465-E469 PolarHBondContact O-N 2.95Å
466	Q	94.3	Very high	94.3	Very high	121 Å²	121	109.4 Å²	109.4	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-62.4	-45.9	171.8	-74.1	168.9	0.9	0	0	111.7	E462 R463 E468 E469 E470	E462-Q466 VanDerWaalsContact O-CG 3.29Å; E462-Q466 WeakPolarHBondContact O-CG 3.49Å; E462-Q466 PolarHBondContact O-N 2.81Å; R463-Q466 PolarHBondContact O-N 3.13Å; Q466-E468 VanDerWaalsContact C-N 3.32Å; Q466-E468 PolarHBondContact O-N 2.91Å; Q466-E469 PolarHBondContact O-N 3.42Å; Q466-E470 WeakPolarHBondContact O-CG 3.35Å; Q466-E470 PolarHBondContact O-N 2.88Å
467	E	93.9	Very high	94.2	Very high	105 Å²	105	111.7 Å²	111.7	49%	0.491	51%	0.514	S	S	.	.	H	α-helix	trans	-61.1	-38.2	174.9	-72.7	175.8	-159.8	0	0	112.2	R463 L464 R471	R463-E467 WeakPolarHBondContact O-CG 3.27Å; R463-E467 PolarHBondContact O-N 3.44Å; L464-E467 PolarHBondContact O-N 2.91Å; E467-R471 WeakPolarHBondContact O-CB 3.4Å; E467-R471 VanDerWaalsContact O-CG 3.24Å; E467-R471 WeakPolarHBondContact O-CG 3.45Å; E467-R471 PolarHBondContact O-N 2.87Å
468	E	92.3	Very high	94.1	Very high	96 Å²	96	114.1 Å²	114.1	45%	0.449	52%	0.516	S	S	.	.	H	α-helix	trans	-70.6	-41.2	175.7	-152.4	-159.3	155.5	0	0	112	L464 L465 Q466 R471 R472	L464-E468 WeakPolarHBondContact O-CB 3.4Å; L464-E468 PolarHBondContact O-N 3.43Å; L465-E468 PolarHBondContact O-N 2.85Å; Q466-E468 VanDerWaalsContact C-N 3.32Å; Q466-E468 PolarHBondContact O-N 2.91Å; E468-R471 PolarHBondContact O-N 3.01Å; E468-R472 WeakPolarHBondContact O-CB 3.49Å; E468-R472 VanDerWaalsContact O-CG 3.27Å; E468-R472 WeakPolarHBondContact O-CG 3.39Å; E468-R472 PolarHBondContact O-N 3.41Å; E468-R472 IonicContact OE1-CZ 2.61Å; E468-R472 IonicContact OE1-NE 3.67Å; E468-R472 PolarHBondContact OE1-NE 3.14Å; E468-R472 IonicContact OE1-NH2 3.34Å; E468-R472 PolarHBondContact OE1-NH2 2.94Å; E468-R472 IonicContact OE2-NH2 2.74Å
469	E	92.3	Very high	94	Very high	83 Å²	83	114.4 Å²	114.4	39%	0.388	52%	0.52	S	S	.	.	H	α-helix	trans	-61.5	-45.3	173.4	-84.6	-156.3	-138.4	0	0	112.1	L465 Q466 R471 R472 R473	L465-E469 HydrophobicContact CD2-CG 4.36Å; L465-E469 WeakPolarHBondContact O-CB 3.38Å; L465-E469 PolarHBondContact O-N 2.95Å; Q466-E469 PolarHBondContact O-N 3.42Å; E469-R471 VanDerWaalsContact C-N 3.33Å; E469-R471 PolarHBondContact O-N 2.97Å; E469-R472 PolarHBondContact O-N 2.94Å; E469-R473 WeakPolarHBondContact O-CB 3.3Å; E469-R473 WeakPolarHBondContact O-CD 3.4Å; E469-R473 WeakPolarHBondContact O-CG 3.31Å; E469-R473 PolarHBondContact O-N 3.21Å; E469-R473 IonicContact OE2-CZ 2.72Å; E469-R473 IonicContact OE2-NE 2.63Å; E469-R473 PolarHBondContact OE2-NE 3.49Å; E469-R473 IonicContact OE2-NH2 3.86Å; E469-R473 PolarHBondContact OE2-NH2 2.69Å
470	E	91.9	Very high	93.7	Very high	136 Å²	136	113.5 Å²	113.5	64%	0.636	52%	0.521	S	S	*	.	H	α-helix	trans	-62.9	-39.5	176.3	-73.4	-164.1	159.6	0	0	112	Q466 R473 S474	Q466-E470 WeakPolarHBondContact O-CG 3.35Å; Q466-E470 PolarHBondContact O-N 2.88Å; E470-R473 PolarHBondContact O-N 3.14Å; E470-S474 WeakPolarHBondContact O-CB 3.38Å; E470-S474 PolarHBondContact O-N 3.24Å
471	R	93.9	Very high	93.6	Very high	173 Å²	173	114.8 Å²	114.8	65%	0.653	53%	0.527	S	S	*	.	H	α-helix	trans	-62	-48.7	172.8	-79.7	171.3	137.6	174.3	-4.1	112.4	E467 E468 E469 R473 S474 Q475	E467-R471 WeakPolarHBondContact O-CB 3.4Å; E467-R471 VanDerWaalsContact O-CG 3.24Å; E467-R471 WeakPolarHBondContact O-CG 3.45Å; E467-R471 PolarHBondContact O-N 2.87Å; E468-R471 PolarHBondContact O-N 3.01Å; E469-R471 VanDerWaalsContact C-N 3.33Å; E469-R471 PolarHBondContact O-N 2.97Å; R471-R473 VanDerWaalsContact C-N 3.32Å; R471-R473 PolarHBondContact O-N 3.24Å; R471-S474 PolarHBondContact O-N 2.85Å; R471-S474 VanDerWaalsContact O-N 3.15Å; R471-Q475 WeakPolarHBondContact O-CG 3.43Å; R471-Q475 PolarHBondContact O-N 2.87Å
472	R	93.8	Very high	93.5	Very high	151 Å²	151	114.6 Å²	114.6	57%	0.57	53%	0.525	S	S	*	.	H	α-helix	trans	-59.8	-41.7	175.8	-71	171.4	-179.7	-158.5	7.5	111.3	E468 E469 H476	E468-R472 WeakPolarHBondContact O-CB 3.49Å; E468-R472 VanDerWaalsContact O-CG 3.27Å; E468-R472 WeakPolarHBondContact O-CG 3.39Å; E468-R472 PolarHBondContact O-N 3.41Å; E468-R472 IonicContact OE1-CZ 2.61Å; E468-R472 IonicContact OE1-NE 3.67Å; E468-R472 PolarHBondContact OE1-NE 3.14Å; E468-R472 IonicContact OE1-NH2 3.34Å; E468-R472 PolarHBondContact OE1-NH2 2.94Å; E468-R472 IonicContact OE2-NH2 2.74Å; E469-R472 PolarHBondContact O-N 2.94Å; R472-H476 WeakPolarHBondContact O-CB 3.26Å; R472-H476 PolarHBondContact O-N 2.83Å
473	R	93.5	Very high	93.5	Very high	150 Å²	150	115 Å²	115	57%	0.566	53%	0.53	S	S	*	.	H	α-helix	trans	-67.1	-32.9	175	-68.5	165	-171.6	-152.7	6.1	112.6	E469 E470 R471 R477	E469-R473 WeakPolarHBondContact O-CB 3.3Å; E469-R473 WeakPolarHBondContact O-CD 3.4Å; E469-R473 WeakPolarHBondContact O-CG 3.31Å; E469-R473 PolarHBondContact O-N 3.21Å; E469-R473 IonicContact OE2-CZ 2.72Å; E469-R473 IonicContact OE2-NE 2.63Å; E469-R473 PolarHBondContact OE2-NE 3.49Å; E469-R473 IonicContact OE2-NH2 3.86Å; E469-R473 PolarHBondContact OE2-NH2 2.69Å; E470-R473 PolarHBondContact O-N 3.14Å; R471-R473 VanDerWaalsContact C-N 3.32Å; R471-R473 PolarHBondContact O-N 3.24Å; R473-R477 VanDerWaalsContact O-CG 3.32Å; R473-R477 WeakPolarHBondContact O-CG 3.34Å; R473-R477 PolarHBondContact O-N 3.3Å; R473-R477 PolarHBondContact O-NE 3.32Å
474	S	92.9	Very high	93.2	Very high	41 Å²	41	111.2 Å²	111.2	29%	0.287	52%	0.518	S	S	.	.	H	α-helix	trans	-69.6	-53.7	173.5	-153.4	0	0	0	0	110.9	E470 R471 H476 R477 E478	E470-S474 WeakPolarHBondContact O-CB 3.38Å; E470-S474 PolarHBondContact O-N 3.24Å; R471-S474 PolarHBondContact O-N 2.85Å; R471-S474 VanDerWaalsContact O-N 3.15Å; S474-H476 VanDerWaalsContact C-N 3.26Å; S474-H476 PolarHBondContact O-N 3.22Å; S474-R477 WeakPolarHBondContact O-CA 3.34Å; S474-R477 PolarHBondContact O-N 3.21Å; S474-E478 VanDerWaalsContact CB-OE1 3.24Å; S474-E478 WeakPolarHBondContact CB-OE1 3.31Å; S474-E478 WeakPolarHBondContact O-CG 3.47Å; S474-E478 PolarHBondContact O-N 3.31Å; S474-E478 PolarHBondContact OG-OE1 3.09Å
475	Q	93.1	Very high	93	Very high	124 Å²	124	107 Å²	107	58%	0.579	50%	0.502	S	S	*	.	H	α-helix	trans	-54.8	-39.7	177.4	-71.4	171.5	-15.6	0	0	112.7	R471 L479	R471-Q475 WeakPolarHBondContact O-CG 3.43Å; R471-Q475 PolarHBondContact O-N 2.87Å; Q475-L479 VanDerWaalsContact O-CB 3.25Å; Q475-L479 WeakPolarHBondContact O-CB 3.5Å; Q475-L479 PolarHBondContact O-N 2.98Å
476	H	92.1	Very high	92.7	Very high	128 Å²	128	108.3 Å²	108.3	59%	0.593	51%	0.505	S	S	*	.	H	α-helix	trans	-67.4	-40	176.2	-167.7	68.9	0	0	0	112.8	R472 S474 Q480	R472-H476 WeakPolarHBondContact O-CB 3.26Å; R472-H476 PolarHBondContact O-N 2.83Å; S474-H476 VanDerWaalsContact C-N 3.26Å; S474-H476 PolarHBondContact O-N 3.22Å; H476-Q480 WeakPolarHBondContact O-CB 3.35Å; H476-Q480 PolarHBondContact O-N 2.91Å
477	R	93.5	Very high	92.5	Very high	143 Å²	143	107 Å²	107	54%	0.54	50%	0.502	S	S	.	.	H	α-helix	trans	-68.3	-41.1	175.2	-73.8	176.3	-66	-176.6	5.1	112.1	R473 S474 Q480 Q481	R473-R477 VanDerWaalsContact O-CG 3.32Å; R473-R477 WeakPolarHBondContact O-CG 3.34Å; R473-R477 PolarHBondContact O-N 3.3Å; R473-R477 PolarHBondContact O-NE 3.32Å; S474-R477 WeakPolarHBondContact O-CA 3.34Å; S474-R477 PolarHBondContact O-N 3.21Å; R477-Q480 PolarHBondContact O-N 3.29Å; R477-Q481 WeakPolarHBondContact O-CB 3.04Å; R477-Q481 VanDerWaalsContact O-CG 3.28Å; R477-Q481 WeakPolarHBondContact O-CG 3.31Å; R477-Q481 PolarHBondContact O-N 3.24Å
478	E	93.4	Very high	92.4	Very high	104 Å²	104	108.2 Å²	108.2	49%	0.486	50%	0.502	S	S	.	.	H	α-helix	trans	-61.7	-45.4	175.1	-70.6	156.6	-134.5	0	0	111	S474 Q481 A482	S474-E478 VanDerWaalsContact CB-OE1 3.24Å; S474-E478 WeakPolarHBondContact CB-OE1 3.31Å; S474-E478 WeakPolarHBondContact O-CG 3.47Å; S474-E478 PolarHBondContact O-N 3.31Å; S474-E478 PolarHBondContact OG-OE1 3.09Å; E478-Q481 PolarHBondContact O-N 2.96Å; E478-A482 WeakPolarHBondContact O-CB 3.46Å; E478-A482 PolarHBondContact O-N 2.88Å
479	L	92.8	Very high	92.3	Very high	120 Å²	120	110 Å²	110	63%	0.628	51%	0.511	S	S	*	.	H	α-helix	trans	-63.8	-42	175.3	-178.2	63.8	0	0	0	112.1	Q475 A482 L483	Q475-L479 VanDerWaalsContact O-CB 3.25Å; Q475-L479 WeakPolarHBondContact O-CB 3.5Å; Q475-L479 PolarHBondContact O-N 2.98Å; L479-A482 PolarHBondContact O-N 3.14Å; L479-L483 WeakPolarHBondContact O-CB 3.36Å; L479-L483 PolarHBondContact O-N 3.18Å
480	Q	90.8	Very high	92.1	Very high	98 Å²	98	108 Å²	108	46%	0.458	51%	0.508	S	S	.	.	H	α-helix	trans	-62.6	-46.4	175.3	-175.7	-173.1	-30.2	0	0	111.2	H476 R477 A482 L483 E484	H476-Q480 WeakPolarHBondContact O-CB 3.35Å; H476-Q480 PolarHBondContact O-N 2.91Å; R477-Q480 PolarHBondContact O-N 3.29Å; Q480-A482 VanDerWaalsContact C-N 3.33Å; Q480-A482 PolarHBondContact O-N 3.45Å; Q480-L483 PolarHBondContact O-N 3.31Å; Q480-E484 PolarHBondContact NE2-OE1 3.44Å; Q480-E484 WeakPolarHBondContact O-CG 3.33Å; Q480-E484 PolarHBondContact O-N 2.78Å
481	Q	93.2	Very high	91.9	Very high	134 Å²	134	107.3 Å²	107.3	63%	0.626	51%	0.505	S	S	*	.	H	α-helix	trans	-62.8	-38.9	177.8	-74.4	174.8	-1.3	0	0	112.2	R477 E478 E484 G485	R477-Q481 WeakPolarHBondContact O-CB 3.04Å; R477-Q481 VanDerWaalsContact O-CG 3.28Å; R477-Q481 WeakPolarHBondContact O-CG 3.31Å; R477-Q481 PolarHBondContact O-N 3.24Å; E478-Q481 PolarHBondContact O-N 2.96Å; Q481-E484 PolarHBondContact O-N 2.95Å; Q481-G485 PolarHBondContact O-N 2.77Å
482	A	92.7	Very high	91.7	Very high	54 Å²	54	105.7 Å²	105.7	45%	0.446	51%	0.505	S	S	.	.	H	α-helix	trans	-64.4	-42	173.9	0	0	0	0	0	112.1	E478 L479 Q480 G485 Q486	E478-A482 WeakPolarHBondContact O-CB 3.46Å; E478-A482 PolarHBondContact O-N 2.88Å; L479-A482 PolarHBondContact O-N 3.14Å; Q480-A482 VanDerWaalsContact C-N 3.33Å; Q480-A482 PolarHBondContact O-N 3.45Å; A482-G485 PolarHBondContact O-N 2.75Å; A482-Q486 WeakPolarHBondContact O-CG 3.37Å; A482-Q486 PolarHBondContact O-N 2.87Å
483	L	93.3	Very high	91.4	Very high	100 Å²	100	101.1 Å²	101.1	52%	0.524	50%	0.499	S	S	.	.	H	α-helix	trans	-66.3	-42.4	176.5	-169.3	72.4	0	0	0	111.8	L479 Q480 G485 Q486 L487	L479-L483 WeakPolarHBondContact O-CB 3.36Å; L479-L483 PolarHBondContact O-N 3.18Å; Q480-L483 PolarHBondContact O-N 3.31Å; L483-G485 VanDerWaalsContact C-N 3.29Å; L483-G485 PolarHBondContact O-N 3.23Å; L483-Q486 PolarHBondContact O-N 2.91Å; L483-L487 HydrophobicContact CG-CD1 4.37Å; L483-L487 WeakPolarHBondContact O-CB 3.28Å; L483-L487 VanDerWaalsContact O-CG 3.31Å; L483-L487 WeakPolarHBondContact O-CG 3.14Å; L483-L487 PolarHBondContact O-N 2.99Å
484	E	91.2	Very high	91.2	Very high	62 Å²	62	102 Å²	102	29%	0.29	50%	0.502	S	S	.	.	H	α-helix	trans	-62.5	-35.2	172.5	-73.9	-177.9	-148.3	0	0	112.4	Q480 Q481 R488	Q480-E484 PolarHBondContact NE2-OE1 3.44Å; Q480-E484 WeakPolarHBondContact O-CG 3.33Å; Q480-E484 PolarHBondContact O-N 2.78Å; Q481-E484 PolarHBondContact O-N 2.95Å; E484-R488 VanDerWaalsContact O-CG 3.28Å; E484-R488 WeakPolarHBondContact O-CG 3.22Å; E484-R488 PolarHBondContact O-N 2.88Å; E484-R488 IonicContact OE2-CZ 2.79Å; E484-R488 IonicContact OE2-NH1 3.95Å; E484-R488 PolarHBondContact OE2-NH1 2.63Å; E484-R488 IonicContact OE2-NH2 2.64Å; E484-R488 PolarHBondContact OE2-NH2 2.6Å
485	G	91.8	Very high	91	Very high	24 Å²	24	102.6 Å²	102.6	25%	0.247	51%	0.51	C	S	.	.	H	α-helix	trans	-61.4	-54.3	171.9	0	0	0	0	0	111.7	Q481 A482 L483 L487 R488 E489	Q481-G485 PolarHBondContact O-N 2.77Å; A482-G485 PolarHBondContact O-N 2.75Å; L483-G485 VanDerWaalsContact C-N 3.29Å; L483-G485 PolarHBondContact O-N 3.23Å; G485-L487 VanDerWaalsContact C-N 3.28Å; G485-L487 PolarHBondContact O-N 3.2Å; G485-R488 PolarHBondContact O-N 2.92Å; G485-R488 VanDerWaalsContact O-N 3.14Å; G485-E489 WeakPolarHBondContact O-CG 3.33Å; G485-E489 PolarHBondContact O-N 3.38Å
486	Q	90.1	Very high	90.8	Very high	127 Å²	127	100.6 Å²	100.6	59%	0.593	51%	0.509	S	S	*	.	H	α-helix	trans	-59.8	-35.9	177.8	-71.7	178.3	-6.7	0	0	113	A482 L483 A490	A482-Q486 WeakPolarHBondContact O-CG 3.37Å; A482-Q486 PolarHBondContact O-N 2.87Å; L483-Q486 PolarHBondContact O-N 2.91Å; Q486-A490 VanDerWaalsContact O-CB 3.26Å; Q486-A490 WeakPolarHBondContact O-CB 3.48Å; Q486-A490 PolarHBondContact O-N 3.34Å
487	L	90.7	Very high	90.5	Very high	95 Å²	95	100 Å²	100	50%	0.497	51%	0.509	S	S	.	.	H	α-helix	trans	-64.6	-48	173.8	-76.4	167	0	0	0	111.5	L483 G485 E489 A490 E491	L483-L487 HydrophobicContact CG-CD1 4.37Å; L483-L487 WeakPolarHBondContact O-CB 3.28Å; L483-L487 VanDerWaalsContact O-CG 3.31Å; L483-L487 WeakPolarHBondContact O-CG 3.14Å; L483-L487 PolarHBondContact O-N 2.99Å; G485-L487 VanDerWaalsContact C-N 3.28Å; G485-L487 PolarHBondContact O-N 3.2Å; L487-E489 PolarHBondContact O-N 3.22Å; L487-A490 PolarHBondContact O-N 3.16Å; L487-E491 WeakPolarHBondContact O-CB 3.1Å; L487-E491 VanDerWaalsContact O-CG 3.3Å; L487-E491 WeakPolarHBondContact O-CG 3.08Å; L487-E491 PolarHBondContact O-N 3.2Å
488	R	90.6	Very high	90.1	Very high	130 Å²	130	98.7 Å²	98.7	49%	0.491	51%	0.508	S	S	.	.	H	α-helix	trans	-62.7	-39.9	177	-70.5	170.6	-171.1	120.2	10.5	112.2	E484 G485 E491 Q492	E484-R488 VanDerWaalsContact O-CG 3.28Å; E484-R488 WeakPolarHBondContact O-CG 3.22Å; E484-R488 PolarHBondContact O-N 2.88Å; E484-R488 IonicContact OE2-CZ 2.79Å; E484-R488 IonicContact OE2-NH1 3.95Å; E484-R488 PolarHBondContact OE2-NH1 2.63Å; E484-R488 IonicContact OE2-NH2 2.64Å; E484-R488 PolarHBondContact OE2-NH2 2.6Å; G485-R488 PolarHBondContact O-N 2.92Å; G485-R488 VanDerWaalsContact O-N 3.14Å; R488-E491 PolarHBondContact O-N 3.27Å; R488-Q492 WeakPolarHBondContact O-CB 3.48Å; R488-Q492 VanDerWaalsContact O-CG 3.26Å; R488-Q492 WeakPolarHBondContact O-CG 3.46Å; R488-Q492 PolarHBondContact O-N 2.8Å
489	E	90.6	Very high	89.8	Confident	134 Å²	134	96.4 Å²	96.4	63%	0.626	51%	0.507	S	S	*	.	H	α-helix	trans	-63.3	-43.8	174.1	-72.8	174.8	179.8	0	0	111.6	G485 L487 Q492 A493	G485-E489 WeakPolarHBondContact O-CG 3.33Å; G485-E489 PolarHBondContact O-N 3.38Å; L487-E489 PolarHBondContact O-N 3.22Å; E489-Q492 PolarHBondContact O-N 3.28Å; E489-A493 WeakPolarHBondContact O-CB 3.19Å; E489-A493 PolarHBondContact O-N 3.16Å
490	A	87.8	Confident	89.5	Confident	40 Å²	40	96.7 Å²	96.7	33%	0.331	51%	0.505	S	S	.	.	H	α-helix	trans	-67.6	-35.8	176.8	0	0	0	0	0	112.9	Q486 L487 R494	Q486-A490 VanDerWaalsContact O-CB 3.26Å; Q486-A490 WeakPolarHBondContact O-CB 3.48Å; Q486-A490 PolarHBondContact O-N 3.34Å; L487-A490 PolarHBondContact O-N 3.16Å; A490-R494 WeakPolarHBondContact O-CB 3.36Å; A490-R494 WeakPolarHBondContact O-CD 3.48Å; A490-R494 WeakPolarHBondContact O-CG 3.33Å; A490-R494 PolarHBondContact O-N 3.42Å
491	E	87.9	Confident	89	Confident	121 Å²	121	97.2 Å²	97.2	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-65.8	-45.5	173	-75.2	171.9	168.8	0	0	111.5	L487 R488 R494 A495	L487-E491 WeakPolarHBondContact O-CB 3.1Å; L487-E491 VanDerWaalsContact O-CG 3.3Å; L487-E491 WeakPolarHBondContact O-CG 3.08Å; L487-E491 PolarHBondContact O-N 3.2Å; R488-E491 PolarHBondContact O-N 3.27Å; E491-R494 PolarHBondContact O-N 3.4Å; E491-A495 WeakPolarHBondContact O-CB 3.24Å; E491-A495 PolarHBondContact O-N 3.44Å
492	Q	89.1	Confident	88.6	Confident	140 Å²	140	96.9 Å²	96.9	65%	0.654	51%	0.507	S	S	*	.	H	α-helix	trans	-63.5	-42.2	175.5	-72.9	174.1	14.3	0	0	112	R488 E489 R494 A495 S496	R488-Q492 WeakPolarHBondContact O-CB 3.48Å; R488-Q492 VanDerWaalsContact O-CG 3.26Å; R488-Q492 WeakPolarHBondContact O-CG 3.46Å; R488-Q492 PolarHBondContact O-N 2.8Å; E489-Q492 PolarHBondContact O-N 3.28Å; Q492-R494 PolarHBondContact O-N 3.25Å; Q492-A495 PolarHBondContact O-N 3.19Å; Q492-S496 WeakPolarHBondContact O-CB 3.49Å; Q492-S496 PolarHBondContact O-N 3.01Å
493	A	88.6	Confident	88.4	Confident	55 Å²	55	98.8 Å²	98.8	46%	0.455	51%	0.51	S	S	.	.	H	α-helix	trans	-63	-40	175.2	0	0	0	0	0	112.1	E489 M497	E489-A493 WeakPolarHBondContact O-CB 3.19Å; E489-A493 PolarHBondContact O-N 3.16Å; A493-M497 VanDerWaalsContact O-CB 3.28Å; A493-M497 WeakPolarHBondContact O-CB 3.21Å; A493-M497 PolarHBondContact O-N 3.24Å
494	R	89.3	Confident	87.9	Confident	168 Å²	168	98.7 Å²	98.7	63%	0.634	51%	0.505	S	S	*	.	H	α-helix	trans	-64.6	-47	173.8	-75.4	167.7	-177.5	-168.4	2	111.9	A490 E491 Q492 S496 M497 Q498	A490-R494 WeakPolarHBondContact O-CB 3.36Å; A490-R494 WeakPolarHBondContact O-CD 3.48Å; A490-R494 WeakPolarHBondContact O-CG 3.33Å; A490-R494 PolarHBondContact O-N 3.42Å; E491-R494 PolarHBondContact O-N 3.4Å; Q492-R494 PolarHBondContact O-N 3.25Å; R494-S496 VanDerWaalsContact C-N 3.34Å; R494-S496 PolarHBondContact O-N 2.98Å; R494-M497 PolarHBondContact O-N 3.45Å; R494-Q498 WeakPolarHBondContact O-CB 3.37Å; R494-Q498 VanDerWaalsContact O-CG 3.31Å; R494-Q498 WeakPolarHBondContact O-CG 3.46Å; R494-Q498 PolarHBondContact O-N 3.4Å; R494-Q498 PolarHBondContact O-OE1 3.21Å
495	A	88.4	Confident	87.4	Confident	54 Å²	54	101.6 Å²	101.6	45%	0.446	52%	0.518	S	S	.	.	H	α-helix	trans	-62.3	-41.2	178.1	0	0	0	0	0	111.9	E491 Q492 Q498 A499	E491-A495 WeakPolarHBondContact O-CB 3.24Å; E491-A495 PolarHBondContact O-N 3.44Å; Q492-A495 PolarHBondContact O-N 3.19Å; A495-Q498 PolarHBondContact O-N 3.33Å; A495-A499 PolarHBondContact O-N 3.47Å
496	S	89.8	Confident	87.1	Confident	81 Å²	81	105.7 Å²	105.7	57%	0.566	53%	0.531	S	S	*	.	H	α-helix	trans	-61.4	-42.9	173.5	-174.4	0	0	0	0	112.1	Q492 R494 A499 E500	Q492-S496 WeakPolarHBondContact O-CB 3.49Å; Q492-S496 PolarHBondContact O-N 3.01Å; R494-S496 VanDerWaalsContact C-N 3.34Å; R494-S496 PolarHBondContact O-N 2.98Å; S496-A499 PolarHBondContact O-N 2.78Å; S496-E500 PolarHBondContact O-N 3.42Å
497	M	85.9	Confident	86.9	Confident	117 Å²	117	103.2 Å²	103.2	58%	0.576	52%	0.52	S	S	*	.	H	α-helix	trans	-69.6	-33.7	178.4	-171.9	-173	-56.8	0	0	112.3	A493 R494 M501	A493-M497 VanDerWaalsContact O-CB 3.28Å; A493-M497 WeakPolarHBondContact O-CB 3.21Å; A493-M497 PolarHBondContact O-N 3.24Å; R494-M497 PolarHBondContact O-N 3.45Å; M497-M501 VanDerWaalsContact O-CB 3.3Å; M497-M501 WeakPolarHBondContact O-CB 3.39Å; M497-M501 PolarHBondContact O-N 2.88Å
498	Q	84.4	Confident	86.5	Confident	115 Å²	115	100 Å²	100	54%	0.537	51%	0.507	S	S	.	.	H	α-helix	trans	-66.8	-46.7	173.4	-75	172.6	-58.1	0	0	111.2	R494 A495 E500 M501 E502	R494-Q498 WeakPolarHBondContact O-CB 3.37Å; R494-Q498 VanDerWaalsContact O-CG 3.31Å; R494-Q498 WeakPolarHBondContact O-CG 3.46Å; R494-Q498 PolarHBondContact O-N 3.4Å; R494-Q498 PolarHBondContact O-OE1 3.21Å; A495-Q498 PolarHBondContact O-N 3.33Å; Q498-E500 VanDerWaalsContact C-N 3.32Å; Q498-E500 PolarHBondContact O-N 2.96Å; Q498-M501 WeakPolarHBondContact O-CB 3.45Å; Q498-M501 PolarHBondContact O-N 3.33Å; Q498-M501 VanDerWaalsContact O-N 3.11Å; Q498-E502 WeakPolarHBondContact O-CG 3.48Å; Q498-E502 PolarHBondContact O-N 3.43Å
499	A	86	Confident	86.2	Confident	55 Å²	55	95.8 Å²	95.8	46%	0.455	50%	0.5	S	S	.	.	H	α-helix	trans	-63	-36.1	176.2	0	0	0	0	0	112.8	A495 S496 L503	A495-A499 PolarHBondContact O-N 3.47Å; S496-A499 PolarHBondContact O-N 2.78Å; A499-L503 WeakPolarHBondContact O-CB 3.02Å; A499-L503 PolarHBondContact O-N 2.86Å
500	E	86.8	Confident	86	Confident	126 Å²	126	97.1 Å²	97.1	59%	0.589	50%	0.499	S	S	*	.	H	α-helix	trans	-66.9	-40.7	171.7	-173.2	175.5	-174.2	0	0	111.7	S496 Q498 L503 K504	S496-E500 PolarHBondContact O-N 3.42Å; Q498-E500 VanDerWaalsContact C-N 3.32Å; Q498-E500 PolarHBondContact O-N 2.96Å; E500-L503 PolarHBondContact O-N 2.86Å; E500-K504 VanDerWaalsContact O-CG 3.3Å; E500-K504 WeakPolarHBondContact O-CG 3.47Å; E500-K504 PolarHBondContact O-N 3.06Å
501	M	80.9	Confident	85.7	Confident	109 Å²	109	101.1 Å²	101.1	54%	0.537	51%	0.511	S	S	.	.	H	α-helix	trans	-63.5	-47	176.9	-172.2	179.6	-60.3	0	0	111.9	M497 Q498 L503 K504 E505	M497-M501 VanDerWaalsContact O-CB 3.3Å; M497-M501 WeakPolarHBondContact O-CB 3.39Å; M497-M501 PolarHBondContact O-N 2.88Å; Q498-M501 WeakPolarHBondContact O-CB 3.45Å; Q498-M501 PolarHBondContact O-N 3.33Å; Q498-M501 VanDerWaalsContact O-N 3.11Å; M501-L503 VanDerWaalsContact C-N 3.33Å; M501-L503 PolarHBondContact O-N 3.47Å; M501-K504 CarbonylContact O-C 3.55Å; M501-K504 PolarHBondContact O-N 3.43Å; M501-K504 VanDerWaalsContact O-N 3.08Å; M501-E505 WeakPolarHBondContact O-CG 3.47Å; M501-E505 PolarHBondContact O-N 3.03Å
502	E	85	Confident	85.6	Confident	127 Å²	127	102.4 Å²	102.4	59%	0.593	51%	0.511	S	S	*	.	H	α-helix	trans	-57	-45.5	176	-73.1	171.8	177.1	0	0	111.5	Q498 K504 E505 E506	Q498-E502 WeakPolarHBondContact O-CG 3.48Å; Q498-E502 PolarHBondContact O-N 3.43Å; E502-K504 VanDerWaalsContact C-N 3.31Å; E502-K504 PolarHBondContact O-N 3.28Å; E502-E505 PolarHBondContact O-N 2.95Å; E502-E506 PolarHBondContact O-N 3.32Å
503	L	88.1	Confident	85.3	Confident	95 Å²	95	101.9 Å²	101.9	50%	0.497	51%	0.508	S	S	.	.	H	α-helix	trans	-61.9	-37.8	175.6	-174.9	150.3	0	0	0	112	A499 E500 M501 E507	A499-L503 WeakPolarHBondContact O-CB 3.02Å; A499-L503 PolarHBondContact O-N 2.86Å; E500-L503 PolarHBondContact O-N 2.86Å; M501-L503 VanDerWaalsContact C-N 3.33Å; M501-L503 PolarHBondContact O-N 3.47Å; L503-E507 HydrophobicContact CD2-CG 4.47Å; L503-E507 WeakPolarHBondContact CD2-OE1 3.37Å; L503-E507 WeakPolarHBondContact O-CG 3.42Å; L503-E507 PolarHBondContact O-N 3.25Å
504	K	83.6	Confident	85.1	Confident	98 Å²	98	106.4 Å²	106.4	43%	0.426	51%	0.514	S	S	.	.	H	α-helix	trans	-72.4	-33.1	175.1	-68.1	-69.9	158.6	-137.1	0	112.9	E500 M501 E502 E507 A508	E500-K504 VanDerWaalsContact O-CG 3.3Å; E500-K504 WeakPolarHBondContact O-CG 3.47Å; E500-K504 PolarHBondContact O-N 3.06Å; M501-K504 CarbonylContact O-C 3.55Å; M501-K504 PolarHBondContact O-N 3.43Å; M501-K504 VanDerWaalsContact O-N 3.08Å; E502-K504 VanDerWaalsContact C-N 3.31Å; E502-K504 PolarHBondContact O-N 3.28Å; K504-E507 WeakPolarHBondContact CD-OE2 3.5Å; K504-E507 IonicContact NZ-OE1 2.87Å; K504-E507 PolarHBondContact NZ-OE1 2.78Å; K504-E507 IonicContact NZ-OE2 3.3Å; K504-E507 PolarHBondContact NZ-OE2 2.67Å; K504-E507 PolarHBondContact O-N 2.87Å; K504-A508 VanDerWaalsContact O-CB 3.32Å; K504-A508 WeakPolarHBondContact O-CB 3.27Å; K504-A508 PolarHBondContact O-N 2.93Å
505	E	80.6	Confident	84.8	Confident	122 Å²	122	102.7 Å²	102.7	57%	0.57	51%	0.505	S	S	*	.	H	α-helix	trans	-68.4	-37.3	172.7	-71	-158	151.9	0	0	112.1	M501 E502 A508 A509 R512	M501-E505 WeakPolarHBondContact O-CG 3.47Å; M501-E505 PolarHBondContact O-N 3.03Å; E502-E505 PolarHBondContact O-N 2.95Å; E505-A508 PolarHBondContact O-N 2.88Å; E505-A509 VanDerWaalsContact O-CB 3.27Å; E505-A509 WeakPolarHBondContact O-CB 3.39Å; E505-A509 PolarHBondContact O-N 3Å; E505-R512 PolarHBondContact O-NH2 2.81Å
506	E	85.8	Confident	84.6	Confident	110 Å²	110	105.7 Å²	105.7	51%	0.514	51%	0.509	S	S	.	.	H	α-helix	trans	-63	-47.9	170.7	-82.6	-157.4	-146.2	0	0	112.4	E502 A508 A509 R510	E502-E506 PolarHBondContact O-N 3.32Å; E506-A508 VanDerWaalsContact C-N 3.32Å; E506-A508 PolarHBondContact O-N 3.2Å; E506-A509 PolarHBondContact O-N 3.25Å; E506-R510 VanDerWaalsContact O-CG 3.27Å; E506-R510 WeakPolarHBondContact O-CG 3.44Å; E506-R510 PolarHBondContact O-N 2.86Å; E506-R510 IonicContact OE2-CZ 2.78Å; E506-R510 IonicContact OE2-NE 3.41Å; E506-R510 IonicContact OE2-NH2 2.64Å; E506-R510 PolarHBondContact OE2-NH2 3.03Å
507	E	84.8	Confident	84.3	Confident	75 Å²	75	105.9 Å²	105.9	35%	0.35	50%	0.5	S	S	.	.	H	α-helix	trans	-56.3	-47.4	174.4	-77.5	178.2	-171	0	0	111.1	L503 K504 A509 R510 Q511	L503-E507 HydrophobicContact CD2-CG 4.47Å; L503-E507 WeakPolarHBondContact CD2-OE1 3.37Å; L503-E507 WeakPolarHBondContact O-CG 3.42Å; L503-E507 PolarHBondContact O-N 3.25Å; K504-E507 WeakPolarHBondContact CD-OE2 3.5Å; K504-E507 IonicContact NZ-OE1 2.87Å; K504-E507 PolarHBondContact NZ-OE1 2.78Å; K504-E507 IonicContact NZ-OE2 3.3Å; K504-E507 PolarHBondContact NZ-OE2 2.67Å; K504-E507 PolarHBondContact O-N 2.87Å; E507-A509 VanDerWaalsContact C-N 3.35Å; E507-A509 PolarHBondContact O-N 2.73Å; E507-R510 PolarHBondContact O-N 3.48Å; E507-Q511 WeakPolarHBondContact O-CG 3.37Å; E507-Q511 PolarHBondContact O-N 3.48Å
508	A	82.2	Confident	84.2	Confident	27 Å²	27	104.5 Å²	104.5	22%	0.223	50%	0.495	C	S	.	.	H	α-helix	trans	-66.1	-33.4	177.2	0	0	0	0	0	112.7	K504 E505 E506 Q511 R512	K504-A508 VanDerWaalsContact O-CB 3.32Å; K504-A508 WeakPolarHBondContact O-CB 3.27Å; K504-A508 PolarHBondContact O-N 2.93Å; E505-A508 PolarHBondContact O-N 2.88Å; E506-A508 VanDerWaalsContact C-N 3.32Å; E506-A508 PolarHBondContact O-N 3.2Å; A508-Q511 PolarHBondContact O-N 3.42Å; A508-R512 WeakPolarHBondContact O-CB 3.3Å; A508-R512 VanDerWaalsContact O-CG 3.28Å; A508-R512 WeakPolarHBondContact O-CG 3.42Å; A508-R512 PolarHBondContact O-N 2.86Å; A508-R512 PolarHBondContact O-NE 3.45Å
509	A	84.4	Confident	84.2	Confident	43 Å²	43	104.2 Å²	104.2	36%	0.355	49%	0.494	S	S	.	.	H	α-helix	trans	-65.7	-45.1	175.2	0	0	0	0	0	111.5	E505 E506 E507 Q511 R512 Q513	E505-A509 VanDerWaalsContact O-CB 3.27Å; E505-A509 WeakPolarHBondContact O-CB 3.39Å; E505-A509 PolarHBondContact O-N 3Å; E506-A509 PolarHBondContact O-N 3.25Å; E507-A509 VanDerWaalsContact C-N 3.35Å; E507-A509 PolarHBondContact O-N 2.73Å; A509-Q511 VanDerWaalsContact C-N 3.31Å; A509-Q511 PolarHBondContact O-N 3.32Å; A509-R512 PolarHBondContact O-N 3.43Å; A509-Q513 WeakPolarHBondContact O-CB 3.29Å; A509-Q513 PolarHBondContact O-N 2.94Å
510	R	85.9	Confident	84.2	Confident	161 Å²	161	105 Å²	105	61%	0.608	49%	0.488	S	S	*	.	H	α-helix	trans	-61.2	-40	175	-63.1	164.3	-165.3	-172.5	5.2	111.2	E506 E507 R514	E506-R510 VanDerWaalsContact O-CG 3.27Å; E506-R510 WeakPolarHBondContact O-CG 3.44Å; E506-R510 PolarHBondContact O-N 2.86Å; E506-R510 IonicContact OE2-CZ 2.78Å; E506-R510 IonicContact OE2-NE 3.41Å; E506-R510 IonicContact OE2-NH2 2.64Å; E506-R510 PolarHBondContact OE2-NH2 3.03Å; E507-R510 PolarHBondContact O-N 3.48Å; R510-R514 PolarHBondContact O-N 2.65Å; R510-R514 VanDerWaalsContact O-N 3.08Å
511	Q	83.1	Confident	83.9	Confident	124 Å²	124	104.2 Å²	104.2	58%	0.579	49%	0.486	S	S	*	.	H	α-helix	trans	-65	-47.2	173.7	-70.6	174.1	11	0	0	112.5	E507 A508 A509 Q513 R514 I515	E507-Q511 WeakPolarHBondContact O-CG 3.37Å; E507-Q511 PolarHBondContact O-N 3.48Å; A508-Q511 PolarHBondContact O-N 3.42Å; A509-Q511 VanDerWaalsContact C-N 3.31Å; A509-Q511 PolarHBondContact O-N 3.32Å; Q511-Q513 VanDerWaalsContact C-N 3.34Å; Q511-Q513 PolarHBondContact O-N 2.97Å; Q511-R514 PolarHBondContact O-N 2.84Å; Q511-R514 VanDerWaalsContact O-N 3.16Å; Q511-I515 WeakPolarHBondContact O-CG1 3.21Å; Q511-I515 PolarHBondContact O-N 2.62Å
512	R	84.3	Confident	83.8	Confident	149 Å²	149	105 Å²	105	56%	0.562	49%	0.488	S	S	*	.	H	α-helix	trans	-59	-42.5	176.3	-76	177.1	-68.6	-122.2	1.9	112.1	E505 A508 A509 R514 I515 K516	E505-R512 PolarHBondContact O-NH2 2.81Å; A508-R512 WeakPolarHBondContact O-CB 3.3Å; A508-R512 VanDerWaalsContact O-CG 3.28Å; A508-R512 WeakPolarHBondContact O-CG 3.42Å; A508-R512 PolarHBondContact O-N 2.86Å; A508-R512 PolarHBondContact O-NE 3.45Å; A509-R512 PolarHBondContact O-N 3.43Å; R512-R514 VanDerWaalsContact C-N 3.35Å; R512-R514 PolarHBondContact O-N 2.83Å; R512-I515 PolarHBondContact O-N 3.08Å; R512-K516 PolarHBondContact O-N 2.84Å
513	Q	83.2	Confident	83.7	Confident	129 Å²	129	104.3 Å²	104.3	60%	0.603	48%	0.484	S	S	*	.	H	α-helix	trans	-62.3	-42.5	175.4	-176	170.2	-15.1	0	0	111.5	A509 Q511 I515 K516 E517	A509-Q513 WeakPolarHBondContact O-CB 3.29Å; A509-Q513 PolarHBondContact O-N 2.94Å; Q511-Q513 VanDerWaalsContact C-N 3.34Å; Q511-Q513 PolarHBondContact O-N 2.97Å; Q513-I515 PolarHBondContact O-N 3.07Å; Q513-K516 PolarHBondContact O-N 2.97Å; Q513-E517 WeakPolarHBondContact O-CG 3.38Å; Q513-E517 PolarHBondContact O-N 2.85Å
514	R	84	Confident	83.4	Confident	149 Å²	149	107.4 Å²	107.4	56%	0.562	49%	0.49	S	S	*	.	H	α-helix	trans	-66.3	-34.7	176.5	-173.6	53.2	168.8	-169.9	-1.6	113.5	R510 Q511 R512 E517 L518	R510-R514 PolarHBondContact O-N 2.65Å; R510-R514 VanDerWaalsContact O-N 3.08Å; Q511-R514 PolarHBondContact O-N 2.84Å; Q511-R514 VanDerWaalsContact O-N 3.16Å; R512-R514 VanDerWaalsContact C-N 3.35Å; R512-R514 PolarHBondContact O-N 2.83Å; R514-E517 WeakPolarHBondContact CD-OE2 3.45Å; R514-E517 IonicContact CZ-OE2 3.75Å; R514-E517 IonicContact NE-OE2 3.46Å; R514-E517 IonicContact NH1-OE2 3.31Å; R514-E517 PolarHBondContact NH1-OE2 2.92Å; R514-L518 WeakPolarHBondContact O-CG 3.46Å; R514-L518 PolarHBondContact O-N 3.49Å
515	I	83.7	Confident	83.2	Confident	90 Å²	90	108.4 Å²	108.4	46%	0.462	50%	0.499	S	S	.	.	H	α-helix	trans	-63.1	-48.1	172.5	-69.4	164.4	0	0	0	109.6	Q511 R512 Q513 E517 L518 E519	Q511-I515 WeakPolarHBondContact O-CG1 3.21Å; Q511-I515 PolarHBondContact O-N 2.62Å; R512-I515 PolarHBondContact O-N 3.08Å; Q513-I515 PolarHBondContact O-N 3.07Å; I515-E517 VanDerWaalsContact C-N 3.34Å; I515-E517 PolarHBondContact O-N 3.24Å; I515-L518 WeakPolarHBondContact O-CA 3.33Å; I515-L518 WeakPolarHBondContact O-CB 3.43Å; I515-L518 PolarHBondContact O-N 3.45Å; I515-E519 HydrophobicContact CG2-CG 4.26Å; I515-E519 WeakPolarHBondContact O-CG 3.32Å; I515-E519 PolarHBondContact O-N 3.46Å
516	K	83.7	Confident	83.1	Confident	118 Å²	118	107.7 Å²	107.7	51%	0.513	50%	0.496	S	S	.	.	H	α-helix	trans	-59.9	-40.4	178.9	-165	-171.7	180	-129.7	0	113.1	R512 Q513 L518 E519 E520	R512-K516 PolarHBondContact O-N 2.84Å; Q513-K516 PolarHBondContact O-N 2.97Å; K516-L518 PolarHBondContact O-N 2.87Å; K516-E519 PolarHBondContact O-N 3.23Å; K516-E520 WeakPolarHBondContact CE-OE1 3.1Å; K516-E520 IonicContact NZ-OE1 2.66Å; K516-E520 PolarHBondContact NZ-OE1 2.93Å; K516-E520 WeakPolarHBondContact O-CG 3.35Å; K516-E520 PolarHBondContact O-N 3.47Å
517	E	84.6	Confident	83	Confident	84 Å²	84	107 Å²	107	39%	0.393	49%	0.492	S	S	.	.	H	α-helix	trans	-57.9	-36.7	173.4	-73.6	172.3	-176.8	0	0	112.8	Q513 R514 I515 M521	Q513-E517 WeakPolarHBondContact O-CG 3.38Å; Q513-E517 PolarHBondContact O-N 2.85Å; R514-E517 WeakPolarHBondContact CD-OE2 3.45Å; R514-E517 IonicContact CZ-OE2 3.75Å; R514-E517 IonicContact NE-OE2 3.46Å; R514-E517 IonicContact NH1-OE2 3.31Å; R514-E517 PolarHBondContact NH1-OE2 2.92Å; I515-E517 VanDerWaalsContact C-N 3.34Å; I515-E517 PolarHBondContact O-N 3.24Å; E517-M521 WeakPolarHBondContact O-CB 3.33Å; E517-M521 PolarHBondContact O-N 2.9Å
518	L	84.3	Confident	82.7	Confident	88 Å²	88	106 Å²	106	46%	0.461	50%	0.498	S	S	.	.	H	α-helix	trans	-77.5	-37.2	178.7	-66.4	167.2	0	0	0	111.7	R514 I515 K516 M521 Q522	R514-L518 WeakPolarHBondContact O-CG 3.46Å; R514-L518 PolarHBondContact O-N 3.49Å; I515-L518 WeakPolarHBondContact O-CA 3.33Å; I515-L518 WeakPolarHBondContact O-CB 3.43Å; I515-L518 PolarHBondContact O-N 3.45Å; K516-L518 PolarHBondContact O-N 2.87Å; L518-M521 PolarHBondContact O-N 2.84Å; L518-Q522 WeakPolarHBondContact O-CB 3.48Å; L518-Q522 PolarHBondContact O-N 2.95Å
519	E	82.9	Confident	82.7	Confident	110 Å²	110	109.6 Å²	109.6	51%	0.514	51%	0.512	S	S	.	.	H	α-helix	trans	-63.7	-46.7	173.5	-69.1	171.5	158	0	0	111.5	I515 K516 M521 Q522 Q523	I515-E519 HydrophobicContact CG2-CG 4.26Å; I515-E519 WeakPolarHBondContact O-CG 3.32Å; I515-E519 PolarHBondContact O-N 3.46Å; K516-E519 PolarHBondContact O-N 3.23Å; E519-M521 VanDerWaalsContact C-N 3.27Å; E519-M521 PolarHBondContact O-N 3.23Å; E519-Q522 PolarHBondContact O-N 2.99Å; E519-Q523 PolarHBondContact O-N 2.88Å
520	E	86.9	Confident	82.5	Confident	72 Å²	72	113.6 Å²	113.6	34%	0.336	52%	0.524	S	S	.	.	H	α-helix	trans	-62.6	-33	175.2	-72.7	-174.2	-154.2	0	0	112.1	K516 R524	K516-E520 WeakPolarHBondContact CE-OE1 3.1Å; K516-E520 IonicContact NZ-OE1 2.66Å; K516-E520 PolarHBondContact NZ-OE1 2.93Å; K516-E520 WeakPolarHBondContact O-CG 3.35Å; K516-E520 PolarHBondContact O-N 3.47Å; E520-R524 VanDerWaalsContact O-CG 3.31Å; E520-R524 WeakPolarHBondContact O-CG 3.36Å; E520-R524 PolarHBondContact O-N 3.46Å; E520-R524 IonicContact OE2-NH2 3.7Å; E520-R524 PolarHBondContact OE2-NH2 3.21Å
521	M	79.9	Confident	82.3	Confident	109 Å²	109	112 Å²	112	54%	0.537	53%	0.526	S	S	.	.	H	α-helix	trans	-71	-43.8	173.6	-171.8	-173.4	-55.8	0	0	111.9	E517 L518 E519 Q523 R524 L525	E517-M521 WeakPolarHBondContact O-CB 3.33Å; E517-M521 PolarHBondContact O-N 2.9Å; L518-M521 PolarHBondContact O-N 2.84Å; E519-M521 VanDerWaalsContact C-N 3.27Å; E519-M521 PolarHBondContact O-N 3.23Å; M521-Q523 VanDerWaalsContact C-N 3.35Å; M521-Q523 PolarHBondContact O-N 3.3Å; M521-R524 PolarHBondContact O-N 3.05Å; M521-L525 HydrophobicContact CG-CD1 4.4Å; M521-L525 WeakPolarHBondContact O-CG 3.33Å; M521-L525 PolarHBondContact O-N 2.82Å; M521-L525 VanDerWaalsContact O-N 3.14Å
522	Q	78.7	Confident	82.1	Confident	126 Å²	126	111.5 Å²	111.5	59%	0.589	52%	0.524	S	S	*	.	H	α-helix	trans	-61.1	-43.8	177.1	-177.4	177.9	3.6	0	0	111.2	L518 E519 R524 L525 Q526	L518-Q522 WeakPolarHBondContact O-CB 3.48Å; L518-Q522 PolarHBondContact O-N 2.95Å; E519-Q522 PolarHBondContact O-N 2.99Å; Q522-R524 PolarHBondContact O-N 2.75Å; Q522-L525 PolarHBondContact O-N 2.92Å; Q522-Q526 WeakPolarHBondContact O-CB 3.34Å; Q522-Q526 PolarHBondContact O-N 3.33Å
523	Q	82.9	Confident	81.9	Confident	111 Å²	111	107.1 Å²	107.1	52%	0.519	51%	0.514	S	S	.	.	H	α-helix	trans	-60.7	-45.7	178.7	-173.9	178.5	-21.7	0	0	111.7	E519 M521 L525 Q526 E527	E519-Q523 PolarHBondContact O-N 2.88Å; M521-Q523 VanDerWaalsContact C-N 3.35Å; M521-Q523 PolarHBondContact O-N 3.3Å; Q523-L525 VanDerWaalsContact C-N 3.33Å; Q523-L525 PolarHBondContact O-N 3.41Å; Q523-Q526 WeakPolarHBondContact O-CB 3.31Å; Q523-Q526 PolarHBondContact O-N 2.94Å; Q523-Q526 VanDerWaalsContact O-N 3.08Å; Q523-E527 WeakPolarHBondContact CG-OE1 3.34Å; Q523-E527 PolarHBondContact NE2-OE1 3.01Å; Q523-E527 WeakPolarHBondContact O-CG 3.25Å; Q523-E527 PolarHBondContact O-N 3.3Å
524	R	82.4	Confident	81.7	Confident	161 Å²	161	107 Å²	107	61%	0.608	51%	0.511	S	S	*	.	H	α-helix	trans	-62.2	-37.9	177.4	-67.7	171.7	-159.3	177.4	10.7	112.6	E520 M521 Q522 Q526 A528	E520-R524 VanDerWaalsContact O-CG 3.31Å; E520-R524 WeakPolarHBondContact O-CG 3.36Å; E520-R524 PolarHBondContact O-N 3.46Å; E520-R524 IonicContact OE2-NH2 3.7Å; E520-R524 PolarHBondContact OE2-NH2 3.21Å; M521-R524 PolarHBondContact O-N 3.05Å; Q522-R524 PolarHBondContact O-N 2.75Å; R524-Q526 VanDerWaalsContact C-N 3.34Å; R524-A528 WeakPolarHBondContact O-CB 3.32Å; R524-A528 PolarHBondContact O-N 3.34Å
525	L	79.1	Confident	81.5	Confident	119 Å²	119	102.4 Å²	102.4	62%	0.623	51%	0.505	S	S	*	.	H	α-helix	trans	-66.2	-37.5	173.4	-72.1	166.8	0	0	0	111.8	M521 Q522 Q523 A528 L529	M521-L525 HydrophobicContact CG-CD1 4.4Å; M521-L525 WeakPolarHBondContact O-CG 3.33Å; M521-L525 PolarHBondContact O-N 2.82Å; M521-L525 VanDerWaalsContact O-N 3.14Å; Q522-L525 PolarHBondContact O-N 2.92Å; Q523-L525 VanDerWaalsContact C-N 3.33Å; Q523-L525 PolarHBondContact O-N 3.41Å; L525-A528 PolarHBondContact O-N 3.09Å; L525-L529 WeakPolarHBondContact O-CB 3.45Å; L525-L529 PolarHBondContact O-N 3.41Å
526	Q	78.3	Confident	81.1	Confident	107 Å²	107	104.9 Å²	104.9	50%	0.5	51%	0.508	S	S	.	.	H	α-helix	trans	-71.6	-37.2	179.6	-159.4	168.9	15.9	0	0	112.1	Q522 Q523 R524 Q530	Q522-Q526 WeakPolarHBondContact O-CB 3.34Å; Q522-Q526 PolarHBondContact O-N 3.33Å; Q523-Q526 WeakPolarHBondContact O-CB 3.31Å; Q523-Q526 PolarHBondContact O-N 2.94Å; Q523-Q526 VanDerWaalsContact O-N 3.08Å; R524-Q526 VanDerWaalsContact C-N 3.34Å; Q526-Q530 VanDerWaalsContact O-CG 3.31Å; Q526-Q530 WeakPolarHBondContact O-CG 3.48Å; Q526-Q530 PolarHBondContact O-N 2.81Å
527	E	82.9	Confident	80.8	Confident	94 Å²	94	107 Å²	107	44%	0.439	51%	0.513	S	S	.	.	H	α-helix	trans	-64.5	-45.1	171.2	-72.5	168.7	-171.6	0	0	111.5	Q523 L529 Q530 L531	Q523-E527 WeakPolarHBondContact CG-OE1 3.34Å; Q523-E527 PolarHBondContact NE2-OE1 3.01Å; Q523-E527 WeakPolarHBondContact O-CG 3.25Å; Q523-E527 PolarHBondContact O-N 3.3Å; E527-L529 PolarHBondContact O-N 2.86Å; E527-Q530 PolarHBondContact O-N 3.17Å; E527-L531 WeakPolarHBondContact O-CG 3.44Å; E527-L531 PolarHBondContact O-N 3.45Å
528	A	79.9	Confident	80.5	Confident	56 Å²	56	107 Å²	107	46%	0.463	52%	0.516	S	S	.	.	H	α-helix	trans	-59.9	-43.8	175.5	0	0	0	0	0	112.4	R524 L525 Q530 L531 E532	R524-A528 WeakPolarHBondContact O-CB 3.32Å; R524-A528 PolarHBondContact O-N 3.34Å; L525-A528 PolarHBondContact O-N 3.09Å; A528-Q530 VanDerWaalsContact C-N 3.34Å; A528-Q530 PolarHBondContact O-N 3.44Å; A528-L531 PolarHBondContact O-N 2.91Å; A528-E532 PolarHBondContact O-N 2.85Å; A528-E532 VanDerWaalsContact O-N 3.09Å
529	L	82.4	Confident	80	Confident	101 Å²	101	108.2 Å²	108.2	53%	0.529	52%	0.519	S	S	.	.	H	α-helix	trans	-63	-38.4	175.8	-178.5	63.4	0	0	0	112.2	L525 E527 L531 E532 V533	L525-L529 WeakPolarHBondContact O-CB 3.45Å; L525-L529 PolarHBondContact O-N 3.41Å; E527-L529 PolarHBondContact O-N 2.86Å; L529-L531 VanDerWaalsContact C-N 3.34Å; L529-E532 PolarHBondContact O-N 3.18Å; L529-V533 HydrophobicContact CD1-CG2 4.44Å; L529-V533 WeakPolarHBondContact O-CB 3.2Å; L529-V533 VanDerWaalsContact O-CG2 3.31Å; L529-V533 WeakPolarHBondContact O-CG2 3.32Å; L529-V533 PolarHBondContact O-N 2.93Å
530	Q	78.9	Confident	79.7	Confident	128 Å²	128	108.8 Å²	108.8	60%	0.598	52%	0.522	S	S	*	.	H	α-helix	trans	-65.9	-36.1	175.7	-74.5	176.5	27.6	0	0	112.5	Q526 E527 A528 K534	Q526-Q530 VanDerWaalsContact O-CG 3.31Å; Q526-Q530 WeakPolarHBondContact O-CG 3.48Å; Q526-Q530 PolarHBondContact O-N 2.81Å; E527-Q530 PolarHBondContact O-N 3.17Å; A528-Q530 VanDerWaalsContact C-N 3.34Å; A528-Q530 PolarHBondContact O-N 3.44Å; Q530-K534 WeakPolarHBondContact O-CB 3.34Å; Q530-K534 PolarHBondContact O-N 3.3Å
531	L	81.8	Confident	79.2	Confident	126 Å²	126	108.5 Å²	108.5	66%	0.66	53%	0.528	S	S	*	.	H	α-helix	trans	-66.2	-42.7	174.4	-69.5	170	0	0	0	111.9	E527 A528 L529 K534 A535	E527-L531 WeakPolarHBondContact O-CG 3.44Å; E527-L531 PolarHBondContact O-N 3.45Å; A528-L531 PolarHBondContact O-N 2.91Å; L529-L531 VanDerWaalsContact C-N 3.34Å; L531-K534 PolarHBondContact O-N 3.16Å; L531-A535 PolarHBondContact O-N 3Å
532	E	79.2	Confident	79.1	Confident	114 Å²	114	108 Å²	108	53%	0.533	53%	0.53	S	S	.	.	H	α-helix	trans	-63.4	-46.8	175.2	-170	-176.9	171.3	0	0	111.6	A528 L529 K534 A535 R536	A528-E532 PolarHBondContact O-N 2.85Å; A528-E532 VanDerWaalsContact O-N 3.09Å; L529-E532 PolarHBondContact O-N 3.18Å; E532-K534 PolarHBondContact O-N 2.94Å; E532-A535 PolarHBondContact O-N 2.84Å; E532-R536 WeakPolarHBondContact O-CG 3.49Å; E532-R536 PolarHBondContact O-N 3.33Å
533	V	80.8	Confident	79	Confident	57 Å²	57	110.6 Å²	110.6	35%	0.345	54%	0.535	S	S	.	.	H	α-helix	trans	-61.8	-32.7	176.8	169.1	0	0	0	0	112	L529 R537	L529-V533 HydrophobicContact CD1-CG2 4.44Å; L529-V533 WeakPolarHBondContact O-CB 3.2Å; L529-V533 VanDerWaalsContact O-CG2 3.31Å; L529-V533 WeakPolarHBondContact O-CG2 3.32Å; L529-V533 PolarHBondContact O-N 2.93Å; V533-R537 WeakPolarHBondContact O-CG 3.11Å; V533-R537 PolarHBondContact O-N 3.5Å
534	K	79.3	Confident	78.7	Confident	128 Å²	128	110.7 Å²	110.7	56%	0.557	54%	0.538	S	S	*	.	H	α-helix	trans	-68.4	-50.4	173.2	-172.7	-176.8	173.5	-173	0	111.3	Q530 L531 E532 R536 R537 D538	Q530-K534 WeakPolarHBondContact O-CB 3.34Å; Q530-K534 PolarHBondContact O-N 3.3Å; L531-K534 PolarHBondContact O-N 3.16Å; E532-K534 PolarHBondContact O-N 2.94Å; K534-R536 VanDerWaalsContact C-N 3.27Å; K534-R536 PolarHBondContact O-N 3.22Å; K534-R537 PolarHBondContact O-N 2.67Å; K534-D538 PolarHBondContact O-N 2.76Å
535	A	77.9	Confident	78.4	Confident	51 Å²	51	105.6 Å²	105.6	42%	0.421	53%	0.531	S	S	.	.	H	α-helix	trans	-55.9	-41.5	178.9	0	0	0	0	0	112.2	L531 E532 R537 D538 E539	L531-A535 PolarHBondContact O-N 3Å; E532-A535 PolarHBondContact O-N 2.84Å; A535-R537 PolarHBondContact O-N 2.85Å; A535-D538 PolarHBondContact O-N 3.01Å; A535-E539 WeakPolarHBondContact O-CG 3.32Å; A535-E539 PolarHBondContact O-N 3.12Å
536	R	75.8	Confident	78.2	Confident	143 Å²	143	106 Å²	106	54%	0.54	53%	0.529	S	S	.	.	H	α-helix	trans	-57.9	-44.8	173.7	-71.3	-66.3	-168.7	171.2	4.1	113.4	E532 K534 E539 E540	E532-R536 WeakPolarHBondContact O-CG 3.49Å; E532-R536 PolarHBondContact O-N 3.33Å; K534-R536 VanDerWaalsContact C-N 3.27Å; K534-R536 PolarHBondContact O-N 3.22Å; R536-E539 PolarHBondContact O-N 3.46Å; R536-E540 WeakPolarHBondContact O-CG 3.17Å; R536-E540 PolarHBondContact O-N 2.7Å
537	R	76.8	Confident	78	Confident	163 Å²	163	104.1 Å²	104.1	62%	0.615	53%	0.525	S	S	*	.	H	α-helix	trans	-68.4	-37.5	178.6	-72	170.5	178.1	157.7	1.2	112.1	V533 K534 A535 E540 S541	V533-R537 WeakPolarHBondContact O-CG 3.11Å; V533-R537 PolarHBondContact O-N 3.5Å; K534-R537 PolarHBondContact O-N 2.67Å; A535-R537 PolarHBondContact O-N 2.85Å; R537-E540 PolarHBondContact O-N 2.8Å; R537-S541 WeakPolarHBondContact O-CB 3.3Å; R537-S541 PolarHBondContact O-N 3.18Å
538	D	79.8	Confident	77.8	Confident	84 Å²	84	107.5 Å²	107.5	45%	0.449	53%	0.534	S	S	.	.	H	α-helix	trans	-64.5	-43.7	176.2	-64.8	-20	0	0	0	109.7	K534 A535 S541 V542	K534-D538 PolarHBondContact O-N 2.76Å; A535-D538 PolarHBondContact O-N 3.01Å; D538-S541 PolarHBondContact O-N 3.27Å; D538-S541 PolarHBondContact O-OG 2.69Å; D538-V542 PolarHBondContact O-N 3.07Å
539	E	72.9	Confident	77.6	Confident	113 Å²	113	110.1 Å²	110.1	53%	0.528	54%	0.539	S	S	.	.	H	α-helix	trans	-58.5	-46.8	171.3	-73.9	-176.6	163.7	0	0	113.4	A535 R536 S541 V542 R543	A535-E539 WeakPolarHBondContact O-CG 3.32Å; A535-E539 PolarHBondContact O-N 3.12Å; R536-E539 PolarHBondContact O-N 3.46Å; E539-S541 VanDerWaalsContact C-N 3.33Å; E539-S541 PolarHBondContact O-N 3.02Å; E539-V542 PolarHBondContact O-N 3.3Å; E539-R543 PolarHBondContact O-N 2.87Å
540	E	77.4	Confident	77.2	Confident	122 Å²	122	110.8 Å²	110.8	57%	0.57	54%	0.543	S	S	*	.	H	α-helix	trans	-63.1	-38.5	178.8	-75.4	174.9	170.1	0	0	111.9	R536 R537 V542 R543 L544	R536-E540 WeakPolarHBondContact O-CG 3.17Å; R536-E540 PolarHBondContact O-N 2.7Å; R537-E540 PolarHBondContact O-N 2.8Å; E540-V542 PolarHBondContact O-N 2.86Å; E540-R543 PolarHBondContact O-N 2.74Å; E540-L544 WeakPolarHBondContact O-CG 3.37Å; E540-L544 PolarHBondContact O-N 3Å
541	S	76.1	Confident	77	Confident	66 Å²	66	110.3 Å²	110.3	46%	0.462	54%	0.541	S	S	.	.	H	α-helix	trans	-63.1	-39.2	178.1	79.3	0	0	0	0	112.8	R537 D538 E539 L544 A545	R537-S541 WeakPolarHBondContact O-CB 3.3Å; R537-S541 PolarHBondContact O-N 3.18Å; D538-S541 PolarHBondContact O-N 3.27Å; D538-S541 PolarHBondContact O-OG 2.69Å; E539-S541 VanDerWaalsContact C-N 3.33Å; E539-S541 PolarHBondContact O-N 3.02Å; S541-L544 PolarHBondContact O-N 3.22Å; S541-A545 PolarHBondContact O-N 3.34Å
542	V	77.7	Confident	76.8	Confident	97 Å²	97	109 Å²	109	59%	0.588	53%	0.532	S	S	*	.	H	α-helix	trans	-66.3	-40.4	177.5	173.1	0	0	0	0	110.9	D538 E539 E540 A545 Q546	D538-V542 PolarHBondContact O-N 3.07Å; E539-V542 PolarHBondContact O-N 3.3Å; E540-V542 PolarHBondContact O-N 2.86Å; V542-A545 PolarHBondContact O-N 3.21Å; V542-Q546 PolarHBondContact O-N 3.4Å
543	R	76.4	Confident	76.5	Confident	182 Å²	182	109.3 Å²	109.3	69%	0.687	53%	0.533	S	S	*	.	H	α-helix	trans	-63	-44	175.2	-69.7	-175.9	179.6	-169.9	1.5	112.2	E539 E540 A545 Q546 T547	E539-R543 PolarHBondContact O-N 2.87Å; E540-R543 PolarHBondContact O-N 2.74Å; R543-A545 VanDerWaalsContact C-N 3.32Å; R543-A545 PolarHBondContact O-N 3.39Å; R543-Q546 WeakPolarHBondContact O-CB 3.2Å; R543-Q546 PolarHBondContact O-N 3.27Å; R543-T547 PolarHBondContact O-N 3.01Å
544	L	77.2	Confident	76.3	Confident	112 Å²	112	111.7 Å²	111.7	59%	0.586	54%	0.54	S	S	*	.	H	α-helix	trans	-67.5	-30.4	178.9	-71.7	169.3	0	0	0	113.1	E540 S541 T547	E540-L544 WeakPolarHBondContact O-CG 3.37Å; E540-L544 PolarHBondContact O-N 3Å; S541-L544 PolarHBondContact O-N 3.22Å; L544-T547 PolarHBondContact O-OG1 2.88Å
545	A	76.3	Confident	76.3	Confident	55 Å²	55	111.4 Å²	111.4	46%	0.455	54%	0.541	S	S	.	.	H	α-helix	trans	-69.4	-40.2	170.2	0	0	0	0	0	111.6	S541 V542 R543 L549	S541-A545 PolarHBondContact O-N 3.34Å; V542-A545 PolarHBondContact O-N 3.21Å; R543-A545 VanDerWaalsContact C-N 3.32Å; R543-A545 PolarHBondContact O-N 3.39Å; A545-L549 PolarHBondContact O-N 2.84Å
546	Q	73.9	Confident	76.2	Confident	127 Å²	127	113 Å²	113	59%	0.593	54%	0.538	S	S	*	.	H	α-helix	trans	-65.7	-39	179	-170.5	176.6	17	0	0	112.8	V542 R543 L550	V542-Q546 PolarHBondContact O-N 3.4Å; R543-Q546 WeakPolarHBondContact O-CB 3.2Å; R543-Q546 PolarHBondContact O-N 3.27Å; Q546-L550 WeakPolarHBondContact O-CG 3.42Å; Q546-L550 PolarHBondContact O-N 3.06Å
547	T	74.4	Confident	76.1	Confident	67 Å²	67	112.3 Å²	112.3	41%	0.411	54%	0.544	S	S	.	.	H	α-helix	trans	-67.1	-42.5	178.8	53.3	0	0	0	0	112.4	R543 L544 L549 L550 E551	R543-T547 PolarHBondContact O-N 3.01Å; L544-T547 PolarHBondContact O-OG1 2.88Å; T547-L549 VanDerWaalsContact C-N 3.33Å; T547-L549 PolarHBondContact O-N 2.84Å; T547-L550 WeakPolarHBondContact O-CB 3.43Å; T547-L550 PolarHBondContact O-N 2.79Å; T547-L550 VanDerWaalsContact O-N 3.08Å; T547-E551 WeakPolarHBondContact O-CG 3.38Å; T547-E551 PolarHBondContact O-N 3.33Å
548	R	79.1	Confident	76.3	Confident	166 Å²	166	109.4 Å²	109.4	63%	0.626	54%	0.537	S	S	*	.	H	α-helix	trans	-59.9	-41.5	177.9	-71.8	-176.7	-172.7	-179.5	3.6	112.9	L550 E551 E552	R548-L550 PolarHBondContact O-N 3.42Å; R548-E551 PolarHBondContact O-N 2.76Å; R548-E552 WeakPolarHBondContact O-CB 3.45Å; R548-E552 WeakPolarHBondContact O-CG 3.22Å; R548-E552 PolarHBondContact O-N 3.38Å
549	L	75.4	Confident	76.1	Confident	110 Å²	110	111.1 Å²	111.1	58%	0.576	54%	0.542	S	S	*	.	H	α-helix	trans	-64	-28.5	177.8	-72.5	170.6	0	0	0	112.6	A545 T547 E553	A545-L549 PolarHBondContact O-N 2.84Å; T547-L549 VanDerWaalsContact C-N 3.33Å; T547-L549 PolarHBondContact O-N 2.84Å; L549-E553 WeakPolarHBondContact O-CG 3.27Å; L549-E553 PolarHBondContact O-N 2.97Å
550	L	73.3	Confident	76	Confident	116 Å²	116	111.6 Å²	111.6	61%	0.607	55%	0.547	S	S	*	.	H	α-helix	trans	-75.9	-40.8	174	-65.7	169	0	0	0	111.6	Q546 T547 R548 E553 E554	Q546-L550 WeakPolarHBondContact O-CG 3.42Å; Q546-L550 PolarHBondContact O-N 3.06Å; T547-L550 WeakPolarHBondContact O-CB 3.43Å; T547-L550 PolarHBondContact O-N 2.79Å; T547-L550 VanDerWaalsContact O-N 3.08Å; R548-L550 PolarHBondContact O-N 3.42Å; L550-E553 PolarHBondContact O-N 3.46Å; L550-E554 PolarHBondContact O-N 2.98Å
551	E	75.9	Confident	75.7	Confident	118 Å²	118	111.2 Å²	111.2	55%	0.551	55%	0.547	S	S	*	.	H	α-helix	trans	-61.8	-46.1	175.1	-67	168.5	151.6	0	0	111.3	T547 R548 E553 E554 E555	T547-E551 WeakPolarHBondContact O-CG 3.38Å; T547-E551 PolarHBondContact O-N 3.33Å; R548-E551 PolarHBondContact O-N 2.76Å; E551-E553 VanDerWaalsContact C-N 3.29Å; E551-E553 PolarHBondContact O-N 2.9Å; E551-E554 PolarHBondContact O-N 3.4Å; E551-E555 PolarHBondContact O-N 2.67Å
552	E	77.9	Confident	75.7	Confident	99 Å²	99	114.2 Å²	114.2	46%	0.463	55%	0.553	S	S	.	*	H	α-helix	trans	-62.2	-30.2	177.6	-76.3	-177.5	-152.1	0	0	113.7	R548 K556	R548-E552 WeakPolarHBondContact O-CB 3.45Å; R548-E552 WeakPolarHBondContact O-CG 3.22Å; R548-E552 PolarHBondContact O-N 3.38Å; E552-K556 WeakPolarHBondContact O-CD 3.17Å; E552-K556 WeakPolarHBondContact O-CE 3.42Å; E552-K556 VanDerWaalsContact O-CG 3.24Å; E552-K556 WeakPolarHBondContact O-CG 3.34Å; E552-K556 PolarHBondContact O-NZ 3.11Å; E552-K556 VanDerWaalsContact O-NZ 3.11Å; E552-K556 IonicContact OE2-NZ 2.66Å
553	E	73.3	Confident	75.6	Confident	119 Å²	119	114.3 Å²	114.3	56%	0.556	55%	0.55	S	S	*	*	H	α-helix	trans	-80.9	-34.7	175	-69.5	-63.2	114.9	0	0	111.9	L549 L550 E551 K556 L557	L549-E553 WeakPolarHBondContact O-CG 3.27Å; L549-E553 PolarHBondContact O-N 2.97Å; L550-E553 PolarHBondContact O-N 3.46Å; E551-E553 VanDerWaalsContact C-N 3.29Å; E551-E553 PolarHBondContact O-N 2.9Å; E553-K556 PolarHBondContact O-N 3.15Å; E553-K556 WeakPolarHBondContact OE1-CD 3.16Å; E553-K556 IonicContact OE1-NZ 2.68Å; E553-K556 PolarHBondContact OE1-NZ 2.93Å; E553-L557 PolarHBondContact O-N 3.47Å; E553-L557 VanDerWaalsContact O-N 3.1Å
554	E	75.1	Confident	75.5	Confident	108 Å²	108	111 Å²	111	51%	0.505	54%	0.541	S	S	.	.	H	α-helix	trans	-65	-38.6	175.7	-161.5	-170.7	135.3	0	0	112	L550 E551 L557 K558	L550-E554 PolarHBondContact O-N 2.98Å; E551-E554 PolarHBondContact O-N 3.4Å; E554-L557 PolarHBondContact O-N 2.67Å; E554-K558 WeakPolarHBondContact O-CG 3.3Å; E554-K558 PolarHBondContact O-N 3.47Å; E554-K558 VanDerWaalsContact O-N 3.16Å; E554-K558 WeakPolarHBondContact OE1-CE 3.49Å; E554-K558 IonicContact OE1-NZ 2.69Å; E554-K558 PolarHBondContact OE1-NZ 3.3Å
555	E	78.9	Confident	75.5	Confident	122 Å²	122	109.4 Å²	109.4	57%	0.57	53%	0.53	S	S	*	.	H	α-helix	trans	-66	-42.9	176.2	-70.2	-163.3	155.7	0	0	112.8	E551 L557 K558 Q559	E551-E555 PolarHBondContact O-N 2.67Å; E555-L557 VanDerWaalsContact C-N 3.28Å; E555-L557 PolarHBondContact O-N 2.97Å; E555-K558 PolarHBondContact O-N 2.86Å; E555-Q559 WeakPolarHBondContact O-CG 3.49Å; E555-Q559 PolarHBondContact O-N 2.97Å; E555-Q559 VanDerWaalsContact O-N 3.1Å
556	K	77.3	Confident	75.5	Confident	84 Å²	84	112.9 Å²	112.9	37%	0.365	54%	0.537	S	S	.	.	H	α-helix	trans	-59.7	-40.4	174.9	-67.9	162.4	-164.1	136.8	0	111.2	E552 E553 Q559 L560	E552-K556 WeakPolarHBondContact O-CD 3.17Å; E552-K556 WeakPolarHBondContact O-CE 3.42Å; E552-K556 VanDerWaalsContact O-CG 3.24Å; E552-K556 WeakPolarHBondContact O-CG 3.34Å; E552-K556 PolarHBondContact O-NZ 3.11Å; E552-K556 VanDerWaalsContact O-NZ 3.11Å; E552-K556 IonicContact OE2-NZ 2.66Å; E553-K556 PolarHBondContact O-N 3.15Å; E553-K556 WeakPolarHBondContact OE1-CD 3.16Å; E553-K556 IonicContact OE1-NZ 2.68Å; E553-K556 PolarHBondContact OE1-NZ 2.93Å; K556-Q559 PolarHBondContact O-N 3.49Å; K556-L560 WeakPolarHBondContact O-CG 3.43Å; K556-L560 PolarHBondContact O-N 3.42Å; K556-L560 VanDerWaalsContact O-N 3.12Å
557	L	74.1	Confident	75.2	Confident	128 Å²	128	112.7 Å²	112.7	67%	0.67	54%	0.536	S	S	*	.	H	α-helix	trans	-62.9	-43.1	178.4	-154.5	81.2	0	0	0	112	E553 E554 E555 L560 M561	E553-L557 PolarHBondContact O-N 3.47Å; E553-L557 VanDerWaalsContact O-N 3.1Å; E554-L557 PolarHBondContact O-N 2.67Å; E555-L557 VanDerWaalsContact C-N 3.28Å; E555-L557 PolarHBondContact O-N 2.97Å; L557-L560 PolarHBondContact O-N 3.32Å; L557-M561 PolarHBondContact O-N 2.84Å; L557-M561 VanDerWaalsContact O-N 3.09Å
558	K	78.9	Confident	75.2	Confident	103 Å²	103	113.8 Å²	113.8	45%	0.448	54%	0.537	S	S	.	.	H	α-helix	trans	-63.3	-42.9	176.8	-71.2	166.2	-174.7	161.9	0	112.2	E554 E555 M561 Q562	E554-K558 WeakPolarHBondContact O-CG 3.3Å; E554-K558 PolarHBondContact O-N 3.47Å; E554-K558 VanDerWaalsContact O-N 3.16Å; E554-K558 WeakPolarHBondContact OE1-CE 3.49Å; E554-K558 IonicContact OE1-NZ 2.69Å; E554-K558 PolarHBondContact OE1-NZ 3.3Å; E555-K558 PolarHBondContact O-N 2.86Å; K558-M561 PolarHBondContact O-N 3.27Å; K558-Q562 WeakPolarHBondContact O-CG 3.4Å; K558-Q562 PolarHBondContact O-N 3.42Å; K558-Q562 VanDerWaalsContact O-N 3.08Å
559	Q	75.6	Confident	75.2	Confident	120 Å²	120	112 Å²	112	56%	0.561	53%	0.53	S	S	*	.	H	α-helix	trans	-62.3	-43.4	178.3	-68.8	171.7	19	0	0	111.8	E555 K556 M561 Q562 L563	E555-Q559 WeakPolarHBondContact O-CG 3.49Å; E555-Q559 PolarHBondContact O-N 2.97Å; E555-Q559 VanDerWaalsContact O-N 3.1Å; K556-Q559 PolarHBondContact O-N 3.49Å; Q559-M561 PolarHBondContact O-N 2.82Å; Q559-Q562 PolarHBondContact O-N 3.39Å; Q559-L563 PolarHBondContact O-N 3.22Å; Q559-L563 VanDerWaalsContact O-N 3.16Å
560	L	71.9	Confident	75.2	Confident	122 Å²	122	114.9 Å²	114.9	64%	0.639	53%	0.534	S	S	*	.	H	α-helix	trans	-64.1	-37.9	175.7	-72.2	170.2	0	0	0	112.7	K556 L557 L563 K564	K556-L560 WeakPolarHBondContact O-CG 3.43Å; K556-L560 PolarHBondContact O-N 3.42Å; K556-L560 VanDerWaalsContact O-N 3.12Å; L557-L560 PolarHBondContact O-N 3.32Å; L560-L563 PolarHBondContact O-N 3.15Å; L560-K564 PolarHBondContact O-N 3.41Å
561	M	70.1	Confident	75.3	Confident	114 Å²	114	113.8 Å²	113.8	56%	0.562	53%	0.528	S	S	*	.	H	α-helix	trans	-66.2	-42.9	178.5	-165	176.9	80.6	0	0	112.1	L557 K558 Q559 K564 E565	L557-M561 PolarHBondContact O-N 2.84Å; L557-M561 VanDerWaalsContact O-N 3.09Å; K558-M561 PolarHBondContact O-N 3.27Å; Q559-M561 PolarHBondContact O-N 2.82Å; M561-K564 PolarHBondContact O-N 3.01Å; M561-E565 PolarHBondContact O-N 3.22Å
562	Q	76	Confident	75.2	Confident	129 Å²	129	113.8 Å²	113.8	60%	0.603	53%	0.528	S	S	*	.	H	α-helix	trans	-61.8	-44.9	175.7	-72.1	177.1	-17.3	0	0	111.8	K558 Q559 K564 E565 E566	K558-Q562 WeakPolarHBondContact O-CG 3.4Å; K558-Q562 PolarHBondContact O-N 3.42Å; K558-Q562 VanDerWaalsContact O-N 3.08Å; Q559-Q562 PolarHBondContact O-N 3.39Å; Q562-K564 VanDerWaalsContact C-N 3.26Å; Q562-K564 PolarHBondContact O-N 2.85Å; Q562-E565 PolarHBondContact O-N 2.93Å; Q562-E566 PolarHBondContact O-N 3.36Å; Q562-E566 VanDerWaalsContact O-N 3.12Å
563	L	76.4	Confident	75.1	Confident	99 Å²	99	115.7 Å²	115.7	52%	0.518	53%	0.531	S	S	.	.	H	α-helix	trans	-62.2	-33.3	179.3	-143.7	83.8	0	0	0	112.7	Q559 L560 Q567	Q559-L563 PolarHBondContact O-N 3.22Å; Q559-L563 VanDerWaalsContact O-N 3.16Å; L560-L563 PolarHBondContact O-N 3.15Å; L563-Q567 WeakPolarHBondContact O-CG 3.49Å; L563-Q567 PolarHBondContact O-N 2.93Å
564	K	74.4	Confident	75	Confident	114 Å²	114	112.7 Å²	112.7	50%	0.496	53%	0.526	S	S	.	.	H	α-helix	trans	-66.9	-48.8	174.6	178.2	-177.8	171.2	-66.1	0	111.7	L560 M561 Q562 E566 Q567 E568	L560-K564 PolarHBondContact O-N 3.41Å; M561-K564 PolarHBondContact O-N 3.01Å; Q562-K564 VanDerWaalsContact C-N 3.26Å; Q562-K564 PolarHBondContact O-N 2.85Å; K564-E566 VanDerWaalsContact C-N 3.29Å; K564-E566 PolarHBondContact O-N 2.89Å; K564-Q567 PolarHBondContact O-N 3.14Å; K564-E568 WeakPolarHBondContact CE-OE1 3.23Å; K564-E568 IonicContact NZ-OE1 2.89Å; K564-E568 PolarHBondContact NZ-OE1 2.83Å; K564-E568 IonicContact NZ-OE2 2.68Å; K564-E568 PolarHBondContact NZ-OE2 3.02Å; K564-E568 PolarHBondContact O-N 3.34Å
565	E	77.6	Confident	74.7	Confident	78 Å²	78	113 Å²	113	36%	0.364	53%	0.528	S	S	.	.	H	α-helix	trans	-60.6	-37.9	179.3	-73.1	-172.1	-147.5	0	0	112.3	M561 Q562 E568 R569	M561-E565 PolarHBondContact O-N 3.22Å; Q562-E565 PolarHBondContact O-N 2.93Å; E565-E568 PolarHBondContact O-N 2.72Å; E565-R569 VanDerWaalsContact O-CG 3.23Å; E565-R569 WeakPolarHBondContact O-CG 3.34Å; E565-R569 PolarHBondContact O-N 3.19Å; E565-R569 VanDerWaalsContact O-N 3.09Å; E565-R569 IonicContact OE2-CZ 2.71Å; E565-R569 IonicContact OE2-NH2 2.78Å; E565-R569 PolarHBondContact OE2-NH2 3.23Å
566	E	77.1	Confident	74.4	Confident	127 Å²	127	113 Å²	113	59%	0.593	53%	0.528	S	S	*	.	H	α-helix	trans	-65.7	-36.5	176.9	-70.4	-169.1	155.9	0	0	112.9	Q562 K564 Y570	Q562-E566 PolarHBondContact O-N 3.36Å; Q562-E566 VanDerWaalsContact O-N 3.12Å; K564-E566 VanDerWaalsContact C-N 3.29Å; K564-E566 PolarHBondContact O-N 2.89Å; E566-Y570 PolarHBondContact O-N 3.23Å
567	Q	67.4	Low	74.2	Confident	124 Å²	124	115.1 Å²	115.1	58%	0.579	54%	0.539	S	S	*	.	H	α-helix	trans	-69.9	-42.6	175.1	-71.8	-175.2	9.8	0	0	112.2	L563 K564 R569 Y570 I571	L563-Q567 WeakPolarHBondContact O-CG 3.49Å; L563-Q567 PolarHBondContact O-N 2.93Å; K564-Q567 PolarHBondContact O-N 3.14Å; Q567-R569 PolarHBondContact O-N 2.77Å; Q567-Y570 WeakPolarHBondContact O-CB 3.3Å; Q567-Y570 PolarHBondContact O-N 3.04Å; Q567-I571 WeakPolarHBondContact O-CG1 3.39Å; Q567-I571 PolarHBondContact O-N 2.65Å
568	E	74	Confident	74	Confident	89 Å²	89	115.1 Å²	115.1	42%	0.416	53%	0.534	S	S	.	.	H	α-helix	trans	-60.3	-47.1	177.8	-72.9	173.5	148.7	0	0	111	K564 E565 Y570 I571 E572	K564-E568 WeakPolarHBondContact CE-OE1 3.23Å; K564-E568 IonicContact NZ-OE1 2.89Å; K564-E568 PolarHBondContact NZ-OE1 2.83Å; K564-E568 IonicContact NZ-OE2 2.68Å; K564-E568 PolarHBondContact NZ-OE2 3.02Å; K564-E568 PolarHBondContact O-N 3.34Å; E565-E568 PolarHBondContact O-N 2.72Å; E568-Y570 PolarHBondContact O-N 3.11Å; E568-Y570 VanDerWaalsContact O-N 3.11Å; E568-I571 PolarHBondContact O-N 3.48Å; E568-I571 VanDerWaalsContact O-N 3.12Å; E568-E572 PolarHBondContact O-N 3.06Å
569	R	78.1	Confident	73.5	Confident	129 Å²	129	115.9 Å²	115.9	49%	0.487	54%	0.539	S	S	.	.	H	α-helix	trans	-66.2	-9.4	174.1	-62.8	173.5	-156.9	170.2	3.7	114.4	E565 Q567 R573	E565-R569 VanDerWaalsContact O-CG 3.23Å; E565-R569 WeakPolarHBondContact O-CG 3.34Å; E565-R569 PolarHBondContact O-N 3.19Å; E565-R569 VanDerWaalsContact O-N 3.09Å; E565-R569 IonicContact OE2-CZ 2.71Å; E565-R569 IonicContact OE2-NH2 2.78Å; E565-R569 PolarHBondContact OE2-NH2 3.23Å; Q567-R569 PolarHBondContact O-N 2.77Å; R569-R573 PolarHBondContact O-NE 3.04Å; R569-R573 PolarHBondContact O-NH2 3.23Å
570	Y	76.8	Confident	73.4	Confident	170 Å²	170	116.6 Å²	116.6	67%	0.667	54%	0.542	S	S	*	.	H	α-helix	trans	-91.3	-38.8	172.5	-145.4	-74.3	0	0	0	110.9	E566 Q567 E568 A574	E566-Y570 PolarHBondContact O-N 3.23Å; Q567-Y570 WeakPolarHBondContact O-CB 3.3Å; Q567-Y570 PolarHBondContact O-N 3.04Å; E568-Y570 PolarHBondContact O-N 3.11Å; E568-Y570 VanDerWaalsContact O-N 3.11Å; Y570-A574 PolarHBondContact O-N 3.4Å
571	I	74.1	Confident	73.2	Confident	94 Å²	94	116 Å²	116	48%	0.482	54%	0.539	S	S	.	.	H	α-helix	trans	-65.9	-43.4	177	-66.8	165.4	0	0	0	110.9	Q567 E568 R573 A574 Q575	Q567-I571 WeakPolarHBondContact O-CG1 3.39Å; Q567-I571 PolarHBondContact O-N 2.65Å; E568-I571 PolarHBondContact O-N 3.48Å; E568-I571 VanDerWaalsContact O-N 3.12Å; I571-R573 PolarHBondContact O-N 3.11Å; I571-A574 PolarHBondContact O-N 2.9Å; I571-Q575 WeakPolarHBondContact O-CG 3.46Å; I571-Q575 PolarHBondContact O-N 2.84Å
572	E	73.5	Confident	73	Confident	117 Å²	117	116.2 Å²	116.2	55%	0.547	54%	0.539	S	S	.	.	H	α-helix	trans	-59.2	-45.8	179	-70.8	179.8	142.8	0	0	112.6	E568 A574 Q575 Q576	E568-E572 PolarHBondContact O-N 3.06Å; E572-A574 PolarHBondContact O-N 3Å; E572-Q575 WeakPolarHBondContact O-CB 3.44Å; E572-Q575 PolarHBondContact O-N 3.49Å; E572-Q575 VanDerWaalsContact O-N 3.15Å; E572-Q576 WeakPolarHBondContact O-CG 3.49Å; E572-Q576 PolarHBondContact O-N 2.91Å
573	R	76.1	Confident	72.7	Confident	140 Å²	140	116 Å²	116	53%	0.528	54%	0.537	S	S	.	.	H	α-helix	trans	-63.5	-42.7	177.8	-80.1	178.5	-74.9	166.5	-1.5	112.3	R569 I571 Q575 Q576 E577	R569-R573 PolarHBondContact O-NE 3.04Å; R569-R573 PolarHBondContact O-NH2 3.23Å; I571-R573 PolarHBondContact O-N 3.11Å; R573-Q575 PolarHBondContact O-N 3.41Å; R573-Q576 PolarHBondContact O-N 3.28Å; R573-E577 PolarHBondContact O-N 3.36Å; R573-E577 VanDerWaalsContact O-N 3.1Å
574	A	71.8	Confident	72.3	Confident	55 Å²	55	116.8 Å²	116.8	46%	0.455	54%	0.539	S	S	.	.	H	α-helix	trans	-66.7	-20.4	175.9	0	0	0	0	0	113.5	Y570 I571 E572	Y570-A574 PolarHBondContact O-N 3.4Å; I571-A574 PolarHBondContact O-N 2.9Å; E572-A574 PolarHBondContact O-N 3Å
575	Q	69.3	Low	71.7	Confident	114 Å²	114	117.6 Å²	117.6	53%	0.533	55%	0.546	S	S	.	.	H	α-helix	trans	-80	-42.2	170.4	-70.9	176.8	11.8	0	0	111.6	I571 E572 R573 K578 E579	I571-Q575 WeakPolarHBondContact O-CG 3.46Å; I571-Q575 PolarHBondContact O-N 2.84Å; E572-Q575 WeakPolarHBondContact O-CB 3.44Å; E572-Q575 PolarHBondContact O-N 3.49Å; E572-Q575 VanDerWaalsContact O-N 3.15Å; R573-Q575 PolarHBondContact O-N 3.41Å; Q575-K578 WeakPolarHBondContact O-CB 3.31Å; Q575-K578 PolarHBondContact O-N 3.48Å; Q575-E579 PolarHBondContact O-N 3.03Å; Q575-E579 VanDerWaalsContact O-N 3.1Å
576	Q	72.8	Confident	71.4	Confident	122 Å²	122	116 Å²	116	57%	0.57	55%	0.546	S	S	*	.	H	α-helix	trans	-61.6	-49.9	178.7	-71.9	172.4	-12.3	0	0	112.6	E572 R573 K578 E579 E580	E572-Q576 WeakPolarHBondContact O-CG 3.49Å; E572-Q576 PolarHBondContact O-N 2.91Å; R573-Q576 PolarHBondContact O-N 3.28Å; Q576-K578 PolarHBondContact O-N 2.91Å; Q576-K578 VanDerWaalsContact O-N 3.16Å; Q576-E579 PolarHBondContact O-N 2.94Å; Q576-E580 PolarHBondContact O-N 3.43Å; Q576-E580 VanDerWaalsContact O-N 3.12Å
577	E	72.3	Confident	71.1	Confident	129 Å²	129	116.4 Å²	116.4	60%	0.603	55%	0.548	S	S	*	.	H	α-helix	trans	-56.6	-33.9	176.9	-69	178.9	165	0	0	112.3	R573 L581	R573-E577 PolarHBondContact O-N 3.36Å; R573-E577 VanDerWaalsContact O-N 3.1Å; E577-L581 WeakPolarHBondContact O-CG 3.38Å; E577-L581 PolarHBondContact O-N 2.97Å
578	K	69.4	Low	70.8	Confident	129 Å²	129	116 Å²	116	56%	0.561	55%	0.546	S	S	*	.	H	α-helix	trans	-72.6	-36.4	177.9	-179.8	-170.5	171	-163.7	0	112.4	Q575 Q576 Q582	Q575-K578 WeakPolarHBondContact O-CB 3.31Å; Q575-K578 PolarHBondContact O-N 3.48Å; Q576-K578 PolarHBondContact O-N 2.91Å; Q576-K578 VanDerWaalsContact O-N 3.16Å; K578-Q582 WeakPolarHBondContact O-CG 3.23Å; K578-Q582 PolarHBondContact O-N 2.76Å; K578-Q582 VanDerWaalsContact O-N 3.15Å
579	E	68.4	Low	70.4	Confident	119 Å²	119	114.8 Å²	114.8	56%	0.556	55%	0.547	S	S	*	.	H	α-helix	trans	-70.8	-38.9	177.6	-71.5	-170.8	167.9	0	0	111.8	Q575 Q576 Q582 Q583	Q575-E579 PolarHBondContact O-N 3.03Å; Q575-E579 VanDerWaalsContact O-N 3.1Å; Q576-E579 PolarHBondContact O-N 2.94Å; E579-Q582 PolarHBondContact O-N 2.98Å; E579-Q583 WeakPolarHBondContact O-CG 3.39Å; E579-Q583 PolarHBondContact O-N 3.47Å
580	E	73.1	Confident	70.1	Confident	135 Å²	135	116.9 Å²	116.9	63%	0.631	56%	0.555	S	S	*	*	H	α-helix	trans	-60.6	-49.7	174.7	-67.2	-174.8	154.9	0	0	111.5	Q576 Q582 Q583 E584	Q576-E580 PolarHBondContact O-N 3.43Å; Q576-E580 VanDerWaalsContact O-N 3.12Å; E580-Q582 PolarHBondContact O-N 2.9Å; E580-Q583 PolarHBondContact O-N 3.46Å; E580-E584 PolarHBondContact O-N 2.88Å
581	L	69.3	Low	69.7	Low	109 Å²	109	112 Å²	112	57%	0.571	55%	0.546	S	S	*	.	H	α-helix	trans	-60.2	-31.8	175.8	-71.6	169.7	0	0	0	113.2	E577 M585	E577-L581 WeakPolarHBondContact O-CG 3.38Å; E577-L581 PolarHBondContact O-N 2.97Å; L581-M585 WeakPolarHBondContact O-CB 3.49Å; L581-M585 WeakPolarHBondContact O-CG 3.33Å; L581-M585 PolarHBondContact O-N 3.3Å
582	Q	66.4	Low	69.3	Low	119 Å²	119	112.9 Å²	112.9	56%	0.556	55%	0.551	S	S	*	*	H	α-helix	trans	-71.8	-34.1	173.5	-77	-173.8	-7.6	0	0	112.6	K578 E579 E580 A586	K578-Q582 WeakPolarHBondContact O-CG 3.23Å; K578-Q582 PolarHBondContact O-N 2.76Å; K578-Q582 VanDerWaalsContact O-N 3.15Å; E579-Q582 PolarHBondContact O-N 2.98Å; E580-Q582 PolarHBondContact O-N 2.9Å; Q582-A586 WeakPolarHBondContact O-CB 3.15Å; Q582-A586 PolarHBondContact O-N 3.03Å
583	Q	69.2	Low	69	Low	123 Å²	123	112.6 Å²	112.6	58%	0.575	55%	0.55	S	S	*	.	H	α-helix	trans	-70.1	-40.5	175.3	-69.5	-174.7	46	0	0	112.1	E579 E580 A586 Q587	E579-Q583 WeakPolarHBondContact O-CG 3.39Å; E579-Q583 PolarHBondContact O-N 3.47Å; E580-Q583 PolarHBondContact O-N 3.46Å; Q583-A586 PolarHBondContact O-N 2.73Å; Q583-Q587 WeakPolarHBondContact O-CG 3.49Å; Q583-Q587 PolarHBondContact O-N 3.04Å
584	E	67.9	Low	68.5	Low	117 Å²	117	112 Å²	112	55%	0.547	55%	0.553	S	S	.	*	H	α-helix	trans	-60.7	-47.7	173.7	-67.5	-161.9	137.1	0	0	111.8	E580 A586 Q587 Q588	E580-E584 PolarHBondContact O-N 2.88Å; E584-A586 VanDerWaalsContact C-N 3.27Å; E584-A586 PolarHBondContact O-N 3.24Å; E584-Q587 PolarHBondContact O-N 3.31Å; E584-Q587 VanDerWaalsContact O-N 3.11Å; E584-Q588 WeakPolarHBondContact O-CG 3.29Å; E584-Q588 PolarHBondContact O-N 3.36Å
585	M	62	Low	68	Low	131 Å²	131	111.8 Å²	111.8	65%	0.645	55%	0.551	S	S	*	*	H	α-helix	trans	-56.6	-39.7	173.7	-82.2	-71	-65.3	0	0	112.4	L581 S589	L581-M585 WeakPolarHBondContact O-CB 3.49Å; L581-M585 WeakPolarHBondContact O-CG 3.33Å; L581-M585 PolarHBondContact O-N 3.3Å; M585-S589 WeakPolarHBondContact O-CB 3.4Å; M585-S589 PolarHBondContact O-N 3.26Å
586	A	70.4	Confident	67.6	Low	43 Å²	43	112.3 Å²	112.3	36%	0.355	55%	0.554	S	S	.	*	H	α-helix	trans	-67.8	-35.3	176.9	0	0	0	0	0	112.7	Q582 Q583 E584 R590	Q582-A586 WeakPolarHBondContact O-CB 3.15Å; Q582-A586 PolarHBondContact O-N 3.03Å; Q583-A586 PolarHBondContact O-N 2.73Å; E584-A586 VanDerWaalsContact C-N 3.27Å; E584-A586 PolarHBondContact O-N 3.24Å; A586-R590 WeakPolarHBondContact O-CG 3.29Å; A586-R590 PolarHBondContact O-N 3.12Å
587	Q	70	Confident	67	Low	137 Å²	137	113 Å²	113	64%	0.64	56%	0.557	S	S	*	*	H	α-helix	trans	-69.6	-44.5	174.2	-68.7	-172.7	22.8	0	0	112	Q583 E584 S589 R590 S591	Q583-Q587 WeakPolarHBondContact O-CG 3.49Å; Q583-Q587 PolarHBondContact O-N 3.04Å; E584-Q587 PolarHBondContact O-N 3.31Å; E584-Q587 VanDerWaalsContact O-N 3.11Å; Q587-S589 VanDerWaalsContact C-N 3.3Å; Q587-S589 PolarHBondContact O-N 3.01Å; Q587-R590 PolarHBondContact O-N 3.29Å; Q587-R590 VanDerWaalsContact O-N 3.14Å; Q587-S591 PolarHBondContact O-N 2.58Å; Q587-S591 VanDerWaalsContact O-N 3.13Å
588	Q	63.1	Low	66.3	Low	116 Å²	116	113.3 Å²	113.3	54%	0.542	56%	0.558	S	S	.	*	H	α-helix	trans	-63.3	-34.9	176.4	-66.6	-176.5	21.3	0	0	112.4	E584 S591 L592	E584-Q588 WeakPolarHBondContact O-CG 3.29Å; E584-Q588 PolarHBondContact O-N 3.36Å; Q588-S591 PolarHBondContact O-OG 3.47Å; Q588-S591 VanDerWaalsContact O-OG 3.05Å; Q588-L592 PolarHBondContact O-N 3.46Å; Q588-L592 VanDerWaalsContact O-N 3.14Å
589	S	63.7	Low	66	Low	63 Å²	63	111.6 Å²	111.6	44%	0.441	56%	0.555	S	S	.	*	H	α-helix	trans	-64.3	-38.6	173.1	-172	0	0	0	0	112.5	M585 Q587 L592 Q593	M585-S589 WeakPolarHBondContact O-CB 3.4Å; M585-S589 PolarHBondContact O-N 3.26Å; Q587-S589 VanDerWaalsContact C-N 3.3Å; Q587-S589 PolarHBondContact O-N 3.01Å; S589-L592 PolarHBondContact O-N 3.49Å; S589-Q593 WeakPolarHBondContact O-CG 3.43Å; S589-Q593 PolarHBondContact O-N 2.57Å
590	R	72.5	Confident	65.8	Low	172 Å²	172	110.5 Å²	110.5	65%	0.649	55%	0.549	S	S	*	.	H	α-helix	trans	-69.1	-40	178.3	-72.4	172.3	-174.7	-173.7	3.4	112.9	A586 Q587 Q593 Q594	A586-R590 WeakPolarHBondContact O-CG 3.29Å; A586-R590 PolarHBondContact O-N 3.12Å; Q587-R590 PolarHBondContact O-N 3.29Å; Q587-R590 VanDerWaalsContact O-N 3.14Å; R590-Q593 PolarHBondContact O-N 3.43Å; R590-Q594 PolarHBondContact O-N 2.92Å
591	S	68.6	Low	65.6	Low	68 Å²	68	110.6 Å²	110.6	48%	0.476	55%	0.55	S	S	.	*	H	α-helix	trans	-68.1	-35.9	175.4	60	0	0	0	0	112	Q587 Q588 Q594 A595	Q587-S591 PolarHBondContact O-N 2.58Å; Q587-S591 VanDerWaalsContact O-N 3.13Å; Q588-S591 PolarHBondContact O-OG 3.47Å; Q588-S591 VanDerWaalsContact O-OG 3.05Å; S591-Q594 PolarHBondContact O-N 3.5Å; S591-A595 PolarHBondContact O-N 3.33Å
592	L	66.4	Low	65.4	Low	112 Å²	112	110.4 Å²	110.4	59%	0.586	55%	0.553	S	S	*	*	H	α-helix	trans	-60.4	-41.5	169.3	-89.4	164.3	0	0	0	112.8	Q588 S589 A595 Q596	Q588-L592 PolarHBondContact O-N 3.46Å; Q588-L592 VanDerWaalsContact O-N 3.14Å; S589-L592 PolarHBondContact O-N 3.49Å; L592-A595 PolarHBondContact O-N 3.27Å; L592-Q596 WeakPolarHBondContact O-CG 3.45Å; L592-Q596 PolarHBondContact O-N 3.49Å
593	Q	66.9	Low	65.2	Low	112 Å²	112	111.4 Å²	111.4	52%	0.523	55%	0.552	S	S	.	*	H	α-helix	trans	-65.8	-38.9	175.7	-76.1	-177.6	-27.7	0	0	112.8	S589 R590 Q596 Q597	S589-Q593 WeakPolarHBondContact O-CG 3.43Å; S589-Q593 PolarHBondContact O-N 2.57Å; R590-Q593 PolarHBondContact O-N 3.43Å; Q593-Q596 WeakPolarHBondContact O-CB 3.29Å; Q593-Q596 PolarHBondContact O-N 2.88Å; Q593-Q597 WeakPolarHBondContact O-CG 3.48Å; Q593-Q597 PolarHBondContact O-N 3.25Å
594	Q	64.7	Low	64.9	Low	126 Å²	126	110.7 Å²	110.7	59%	0.589	55%	0.548	S	S	*	.	H	α-helix	trans	-65.9	-38.4	174.8	-72.2	177.7	-24.2	0	0	112	R590 S591 Q596 Q597 Q598	R590-Q594 PolarHBondContact O-N 2.92Å; S591-Q594 PolarHBondContact O-N 3.5Å; Q594-Q596 VanDerWaalsContact C-N 3.33Å; Q594-Q596 PolarHBondContact O-N 3.3Å; Q594-Q597 PolarHBondContact O-N 2.97Å; Q594-Q598 PolarHBondContact O-N 3.32Å
595	A	61.4	Low	64.5	Low	51 Å²	51	109.5 Å²	109.5	42%	0.421	55%	0.546	S	S	.	.	H	α-helix	trans	-64.3	-36.2	171.9	0	0	0	0	0	112.4	S591 L592 L599	S591-A595 PolarHBondContact O-N 3.33Å; L592-A595 PolarHBondContact O-N 3.27Å; A595-L599 PolarHBondContact O-N 3.27Å; A595-L599 VanDerWaalsContact O-N 3.17Å
596	Q	61.7	Low	64.7	Low	126 Å²	126	111 Å²	111	59%	0.589	54%	0.544	S	S	*	.	H	α-helix	trans	-65.5	-40.2	173.6	-75.5	175.8	-13.8	0	0	112.6	L592 Q593 Q594 Q598 L599 E600	L592-Q596 WeakPolarHBondContact O-CG 3.45Å; L592-Q596 PolarHBondContact O-N 3.49Å; Q593-Q596 WeakPolarHBondContact O-CB 3.29Å; Q593-Q596 PolarHBondContact O-N 2.88Å; Q594-Q596 VanDerWaalsContact C-N 3.33Å; Q594-Q596 PolarHBondContact O-N 3.3Å; Q596-Q598 PolarHBondContact O-N 2.98Å; Q596-L599 PolarHBondContact O-N 3.46Å; Q596-E600 PolarHBondContact O-N 2.94Å
597	Q	60.2	Low	64.1	Low	135 Å²	135	113.5 Å²	113.5	63%	0.631	55%	0.548	S	S	*	.	H	α-helix	trans	-59.7	-45.2	176.2	-73.9	177.8	-39.6	0	0	112	Q593 Q594 L599 E600 E601	Q593-Q597 WeakPolarHBondContact O-CG 3.48Å; Q593-Q597 PolarHBondContact O-N 3.25Å; Q594-Q597 PolarHBondContact O-N 2.97Å; Q597-L599 VanDerWaalsContact C-N 3.3Å; Q597-L599 PolarHBondContact O-N 2.67Å; Q597-E600 PolarHBondContact O-N 3.22Å; Q597-E601 PolarHBondContact O-N 3.27Å; Q597-E601 VanDerWaalsContact O-N 3.14Å
598	Q	58.2	Low	63.6	Low	137 Å²	137	114.9 Å²	114.9	64%	0.64	55%	0.548	S	S	*	.	H	α-helix	trans	-63.3	-35	176.1	-68.9	-179.1	-16.3	0	0	112.6	Q594 Q596 V602	Q594-Q598 PolarHBondContact O-N 3.32Å; Q596-Q598 PolarHBondContact O-N 2.98Å; Q598-V602 WeakPolarHBondContact O-CG2 3.27Å; Q598-V602 PolarHBondContact O-N 3.43Å
599	L	61.4	Low	63.4	Low	93 Å²	93	112 Å²	112	49%	0.487	54%	0.544	S	S	.	.	H	α-helix	trans	-71.8	-32	178.5	-140.8	159.5	0	0	0	111.9	A595 Q596 Q597 R603	A595-L599 PolarHBondContact O-N 3.27Å; A595-L599 VanDerWaalsContact O-N 3.17Å; Q596-L599 PolarHBondContact O-N 3.46Å; Q597-L599 VanDerWaalsContact C-N 3.3Å; Q597-L599 PolarHBondContact O-N 2.67Å; L599-R603 HydrophobicContact CD2-CG 4.38Å; L599-R603 WeakPolarHBondContact O-CG 3.39Å; L599-R603 PolarHBondContact O-N 2.92Å; L599-R603 VanDerWaalsContact O-N 3.13Å
600	E	65.5	Low	63.3	Low	95 Å²	95	112.7 Å²	112.7	44%	0.444	54%	0.543	S	S	.	.	H	α-helix	trans	-77.9	-35.3	178.9	-147.8	66.7	-171.9	0	0	112.8	Q596 Q597 V602 R603 Q604	Q596-E600 PolarHBondContact O-N 2.94Å; Q597-E600 PolarHBondContact O-N 3.22Å; E600-V602 VanDerWaalsContact C-N 3.32Å; E600-V602 PolarHBondContact O-N 2.9Å; E600-R603 WeakPolarHBondContact O-CB 3.44Å; E600-R603 PolarHBondContact O-N 3.14Å; E600-R603 WeakPolarHBondContact OE2-CD 3.28Å; E600-R603 IonicContact OE2-CZ 3.65Å; E600-R603 IonicContact OE2-NE 3.81Å; E600-R603 IonicContact OE2-NH1 2.72Å; E600-R603 PolarHBondContact OE2-NH1 3.19Å; E600-Q604 PolarHBondContact O-N 2.86Å; E600-Q604 VanDerWaalsContact O-N 3.09Å
601	E	67.9	Low	62.4	Low	138 Å²	138	110.9 Å²	110.9	65%	0.645	54%	0.542	S	S	*	.	H	α-helix	trans	-58.8	-42.6	169.2	-81.2	-165.8	120.6	0	0	112.1	Q597 R603 N605	Q597-E601 PolarHBondContact O-N 3.27Å; Q597-E601 VanDerWaalsContact O-N 3.14Å; E601-R603 VanDerWaalsContact C-N 3.32Å; E601-R603 PolarHBondContact O-N 3.34Å; E601-N605 PolarHBondContact O-N 2.89Å; E601-N605 VanDerWaalsContact O-N 3.16Å; E601-N605 PolarHBondContact O-ND2 2.56Å
602	V	64.8	Low	61.9	Low	105 Å²	105	113.6 Å²	113.6	64%	0.636	55%	0.551	S	S	*	*	H	α-helix	trans	-64.8	-37.2	176	171.8	0	0	0	0	111.1	Q598 E600 R606	Q598-V602 WeakPolarHBondContact O-CG2 3.27Å; Q598-V602 PolarHBondContact O-N 3.43Å; E600-V602 VanDerWaalsContact C-N 3.32Å; E600-V602 PolarHBondContact O-N 2.9Å; V602-R606 PolarHBondContact O-N 3.32Å
603	R	62.6	Low	61.6	Low	140 Å²	140	112.3 Å²	112.3	53%	0.528	55%	0.547	S	S	.	.	H	α-helix	trans	-66.9	-40.8	178.3	-80.1	165.5	168.3	177.4	-0.8	113.8	L599 E600 E601 R606 Q607	L599-R603 HydrophobicContact CD2-CG 4.38Å; L599-R603 WeakPolarHBondContact O-CG 3.39Å; L599-R603 PolarHBondContact O-N 2.92Å; L599-R603 VanDerWaalsContact O-N 3.13Å; E600-R603 WeakPolarHBondContact O-CB 3.44Å; E600-R603 PolarHBondContact O-N 3.14Å; E600-R603 WeakPolarHBondContact OE2-CD 3.28Å; E600-R603 IonicContact OE2-CZ 3.65Å; E600-R603 IonicContact OE2-NE 3.81Å; E600-R603 IonicContact OE2-NH1 2.72Å; E600-R603 PolarHBondContact OE2-NH1 3.19Å; E601-R603 VanDerWaalsContact C-N 3.32Å; E601-R603 PolarHBondContact O-N 3.34Å; R603-R606 WeakPolarHBondContact O-CB 3.24Å; R603-R606 PolarHBondContact O-N 3.29Å; R603-Q607 PolarHBondContact O-N 3.19Å; R603-Q607 VanDerWaalsContact O-N 3.07Å
604	Q	62.9	Low	61.1	Low	107 Å²	107	112.5 Å²	112.5	50%	0.5	55%	0.548	S	S	.	.	H	α-helix	trans	-91.5	-17	-176.3	-66.5	-150.5	-47.3	0	0	115	E600 R606 Q607 R608	E600-Q604 PolarHBondContact O-N 2.86Å; E600-Q604 VanDerWaalsContact O-N 3.09Å; Q604-R606 VanDerWaalsContact C-N 3.25Å; Q604-Q607 HydrophobicContact CB-CB 4.49Å; Q604-Q607 HydrophobicContact CG-CB 4.48Å; Q604-Q607 PolarHBondContact O-N 3.21Å; Q604-R608 WeakPolarHBondContact O-CG 3.31Å; Q604-R608 PolarHBondContact O-N 3.47Å
605	N	60.2	Low	60.7	Low	92 Å²	92	108.9 Å²	108.9	49%	0.492	54%	0.54	S	S	.	.	H	α-helix	trans	-63.5	-33.6	158.6	-81.5	-44.7	0	0	0	111.8	E601 R608	E601-N605 PolarHBondContact O-N 2.89Å; E601-N605 VanDerWaalsContact O-N 3.16Å; E601-N605 PolarHBondContact O-ND2 2.56Å; N605-R608 PolarHBondContact OD1-NH1 3Å
606	R	64.8	Low	60.1	Low	164 Å²	164	109.4 Å²	109.4	62%	0.619	54%	0.544	S	S	*	.	H	α-helix	trans	-67.1	-42.5	168.1	-172.2	-153	142	119.8	15.4	111.9	V602 R603 Q604 R608 A609 D610	V602-R606 PolarHBondContact O-N 3.32Å; R603-R606 WeakPolarHBondContact O-CB 3.24Å; R603-R606 PolarHBondContact O-N 3.29Å; Q604-R606 VanDerWaalsContact C-N 3.25Å; R606-R608 VanDerWaalsContact C-N 3.3Å; R606-R608 PolarHBondContact O-N 2.97Å; R606-A609 WeakPolarHBondContact O-CA 3.33Å; R606-A609 WeakPolarHBondContact O-CB 3.35Å; R606-A609 PolarHBondContact O-N 3.28Å; R606-D610 IonicContact CZ-OD1 4Å; R606-D610 IonicContact CZ-OD2 3.28Å; R606-D610 VanDerWaalsContact CZ-OD2 3.28Å; R606-D610 IonicContact NE-OD2 2.78Å; R606-D610 PolarHBondContact NE-OD2 3.36Å; R606-D610 IonicContact NH2-OD1 3.18Å; R606-D610 PolarHBondContact NH2-OD1 3.13Å; R606-D610 IonicContact NH2-OD2 2.87Å; R606-D610 PolarHBondContact NH2-OD2 3.24Å; R606-D610 PolarHBondContact O-N 2.87Å
607	Q	58.1	Low	59.6	Low	94 Å²	94	109.5 Å²	109.5	44%	0.439	55%	0.545	S	S	.	.	H	α-helix	trans	-63.4	-34	-178.7	-164.1	168.5	-4.1	0	0	113.1	R603 Q604 A609 D610 E611	R603-Q607 PolarHBondContact O-N 3.19Å; R603-Q607 VanDerWaalsContact O-N 3.07Å; Q604-Q607 HydrophobicContact CB-CB 4.49Å; Q604-Q607 HydrophobicContact CG-CB 4.48Å; Q604-Q607 PolarHBondContact O-N 3.21Å; Q607-A609 VanDerWaalsContact C-N 3.32Å; Q607-A609 PolarHBondContact O-N 3Å; Q607-D610 PolarHBondContact O-N 3.45Å; Q607-E611 PolarHBondContact O-N 3.38Å
608	R	60.8	Low	59.1	Low	167 Å²	167	113 Å²	113	63%	0.63	55%	0.552	S	S	*	*	H	α-helix	trans	-57.6	-43.8	168.1	-69.1	167.6	-177.1	160.7	-1.7	111.9	Q604 N605 R606 E611 D612	Q604-R608 WeakPolarHBondContact O-CG 3.31Å; Q604-R608 PolarHBondContact O-N 3.47Å; N605-R608 PolarHBondContact OD1-NH1 3Å; R606-R608 VanDerWaalsContact C-N 3.3Å; R606-R608 PolarHBondContact O-N 2.97Å; R608-E611 PolarHBondContact O-N 2.95Å; R608-D612 PolarHBondContact O-N 3.14Å
609	A	59	Low	58.2	Low	55 Å²	55	114.9 Å²	114.9	46%	0.455	56%	0.558	S	S	.	*	H	α-helix	trans	-70.5	-30.1	179	0	0	0	0	0	113.7	R606 Q607 V613	R606-A609 WeakPolarHBondContact O-CA 3.33Å; R606-A609 WeakPolarHBondContact O-CB 3.35Å; R606-A609 PolarHBondContact O-N 3.28Å; Q607-A609 VanDerWaalsContact C-N 3.32Å; Q607-A609 PolarHBondContact O-N 3Å; A609-V613 WeakPolarHBondContact O-CG2 3.36Å
610	D	60.1	Low	56.9	Low	78 Å²	78	117.7 Å²	117.7	42%	0.417	57%	0.573	S	S	.	*	H	α-helix	trans	-72.5	-32.9	176	-75.2	-42.7	0	0	0	111.8	R606 Q607 V613	R606-D610 IonicContact CZ-OD1 4Å; R606-D610 IonicContact CZ-OD2 3.28Å; R606-D610 VanDerWaalsContact CZ-OD2 3.28Å; R606-D610 IonicContact NE-OD2 2.78Å; R606-D610 PolarHBondContact NE-OD2 3.36Å; R606-D610 IonicContact NH2-OD1 3.18Å; R606-D610 PolarHBondContact NH2-OD1 3.13Å; R606-D610 IonicContact NH2-OD2 2.87Å; R606-D610 PolarHBondContact NH2-OD2 3.24Å; R606-D610 PolarHBondContact O-N 2.87Å; Q607-D610 PolarHBondContact O-N 3.45Å; D610-V613 PolarHBondContact O-N 3.24Å
611	E	54	Low	56.3	Low	134 Å²	134	122.2 Å²	122.2	63%	0.626	59%	0.586	S	S	*	*	H	α-helix	trans	-76.6	-34.3	176.5	-74.5	-178.3	-171.5	0	0	113.6	Q607 R608 V613 E614 A615	Q607-E611 PolarHBondContact O-N 3.38Å; R608-E611 PolarHBondContact O-N 2.95Å; E611-V613 PolarHBondContact O-N 3.36Å; E611-E614 WeakPolarHBondContact O-CB 3.39Å; E611-E614 PolarHBondContact O-N 3.45Å; E611-A615 PolarHBondContact O-N 3.19Å
612	D	59	Low	55.3	Low	124 Å²	124	123 Å²	123	66%	0.663	59%	0.59	S	S	*	*	H	α-helix	trans	-61.8	-21.9	171.4	-82.9	-33	0	0	0	112.6	R608 A615	R608-D612 PolarHBondContact O-N 3.14Å; D612-A615 WeakPolarHBondContact O-CB 3.44Å
613	V	60.2	Low	53.8	Low	86 Å²	86	122.2 Å²	122.2	52%	0.521	59%	0.594	S	S	.	*	H	α-helix	trans	-77.1	-32	172.1	172.9	0	0	0	0	112.2	A609 D610 E611 A615 A616	A609-V613 WeakPolarHBondContact O-CG2 3.36Å; D610-V613 PolarHBondContact O-N 3.24Å; E611-V613 PolarHBondContact O-N 3.36Å; V613-A615 VanDerWaalsContact C-N 3.3Å; V613-A615 PolarHBondContact O-N 2.95Å; V613-A616 PolarHBondContact O-N 3.02Å
614	E	55.8	Low	52.3	Low	116 Å²	116	121 Å²	121	54%	0.542	61%	0.607	S	S	.	*	H	α-helix	trans	-68.2	-29.9	173.5	-103.8	-136	-152.2	0	0	112.5	E611 A616 Q617 R618	E611-E614 WeakPolarHBondContact O-CB 3.39Å; E611-E614 PolarHBondContact O-N 3.45Å; E614-A616 PolarHBondContact O-N 3.15Å; E614-Q617 PolarHBondContact O-N 3.45Å; E614-R618 IonicContact OE2-CZ 3.62Å; E614-R618 IonicContact OE2-NE 3.73Å; E614-R618 IonicContact OE2-NH2 2.7Å; E614-R618 PolarHBondContact OE2-NH2 2.97Å
615	A	55.4	Low	50.9	Low	50 Å²	50	121.9 Å²	121.9	41%	0.413	62%	0.619	S	S	.	*	H	α-helix	trans	-59	-13.6	177.1	0	0	0	0	0	114.6	E611 D612 V613 K619	E611-A615 PolarHBondContact O-N 3.19Å; D612-A615 WeakPolarHBondContact O-CB 3.44Å; V613-A615 VanDerWaalsContact C-N 3.3Å; V613-A615 PolarHBondContact O-N 2.95Å; A615-K619 WeakPolarHBondContact O-CD 3.35Å; A615-K619 WeakPolarHBondContact O-CE 3.37Å; A615-K619 PolarHBondContact O-NZ 3.43Å
616	A	50.3	Low	49.6	Very low	61 Å²	61	123.9 Å²	123.9	50%	0.504	63%	0.63	S	S	.	*	H	α-helix	trans	-94.7	-41.9	179.8	0	0	0	0	0	114.3	V613 E614	V613-A616 PolarHBondContact O-N 3.02Å; E614-A616 PolarHBondContact O-N 3.15Å
617	Q	49.6	Very low	48	Very low	129 Å²	129	121.6 Å²	121.6	60%	0.603	63%	0.634	S	S	*	*	H	α-helix	trans	-79.3	-35.1	-164.3	-61.1	-161.4	17	0	0	114.2	E614 K619 L620	E614-Q617 PolarHBondContact O-N 3.45Å; Q617-K619 VanDerWaalsContact C-N 3.28Å; Q617-K619 PolarHBondContact O-N 3.26Å; Q617-L620 PolarHBondContact O-N 3.03Å
618	R	49.8	Very low	46.8	Very low	207 Å²	207	126 Å²	126	78%	0.781	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-18.6	177.9	-105	-175.6	-75.6	178.2	-4	114.4	E614 L620	E614-R618 IonicContact OE2-CZ 3.62Å; E614-R618 IonicContact OE2-NE 3.73Å; E614-R618 IonicContact OE2-NH2 2.7Å; E614-R618 PolarHBondContact OE2-NH2 2.97Å; R618-L620 VanDerWaalsContact C-N 3.33Å
619	K	39.9	Very low	45.4	Very low	178 Å²	178	125.3 Å²	125.3	77%	0.774	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-18.8	172.7	-69.7	173	-176.6	141	0	113.2	A615 Q617	A615-K619 WeakPolarHBondContact O-CD 3.35Å; A615-K619 WeakPolarHBondContact O-CE 3.37Å; A615-K619 PolarHBondContact O-NZ 3.43Å; Q617-K619 VanDerWaalsContact C-N 3.28Å; Q617-K619 PolarHBondContact O-N 3.26Å
620	L	35.2	Very low	43.9	Very low	151 Å²	151	131.6 Å²	131.6	79%	0.791	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	-27.3	-164.1	-158.4	71.5	0	0	0	114	Q617 R618 Q622	Q617-L620 PolarHBondContact O-N 3.03Å; R618-L620 VanDerWaalsContact C-N 3.33Å; L620-Q622 PolarHBondContact O-N 3.08Å
621	R	50.9	Low	42.8	Very low	191 Å²	191	133.7 Å²	133.7	72%	0.721	68%	0.679	S	S	*	*	S	Bend	trans	-92	93.6	-176.8	-71.3	-162.3	-179.5	-170.5	2.8	113.1
622	Q	48.5	Very low	42	Very low	155 Å²	155	131.9 Å²	131.9	72%	0.724	68%	0.677	S	S	*	*			trans	62.9	93.5	149.2	-65.2	128.5	-11.5	0	0	115.4	L620	L620-Q622 PolarHBondContact O-N 3.08Å
623	A	33.4	Very low	40.6	Very low	88 Å²	88	133.5 Å²	133.5	73%	0.727	68%	0.68	S	S	*	*			cis	51.3	108.9	28.4	0	0	0	0	0	113.1
624	S	29.5	Very low	38.8	Very low	114 Å²	114	137 Å²	137	80%	0.797	69%	0.693	S	S	*	*			trans	60.8	78	175.3	-178.5	0	0	0	0	116.6
625	T	34.6	Very low	37.9	Very low	125 Å²	125	138.3 Å²	138.3	77%	0.767	70%	0.703	S	S	*	*				-151.4	106.6	122.8	22	0	0	0	0	111.2
626	N	31.8	Very low	37.8	Very low	134 Å²	134	147 Å²	147	72%	0.717	73%	0.725	S	S	*	*			trans	35.9	119.7	146.1	-54.6	-31.6	0	0	0	119.8
627	V	32.7	Very low	37.4	Very low	116 Å²	116	151.5 Å²	151.5	70%	0.703	74%	0.741	S	S	*	*				67.8	112.4	61.7	177.3	0	0	0	0	113.1
628	K	32.1	Very low	36.9	Very low	187 Å²	187	152.8 Å²	152.8	81%	0.813	75%	0.748	S	S	*	*			trans	72.1	144.6	175.7	-58	157.9	-172.4	174.8	0	113.6
629	H	31.5	Very low	37	Very low	152 Å²	152	150.6 Å²	150.6	70%	0.704	75%	0.747	S	S	*	*			cis	-152.7	150.7	7.9	-153.5	47.9	0	0	0	111.2
630	W	27.4	Very low	37.2	Very low	188 Å²	188	147 Å²	147	71%	0.712	74%	0.741	S	S	*	*			trans	49.7	130.5	145.3	-98.7	60	0	0	0	122.6
631	N	36.7	Very low	38	Very low	122 Å²	122	147.6 Å²	147.6	65%	0.652	74%	0.744	S	S	*	*				148.8	101.3	109	-162.7	51.4	0	0	0	108.9
632	V	36.8	Very low	37.4	Very low	96 Å²	96	147 Å²	147	58%	0.582	75%	0.749	S	S	*	*			cis	73.8	134.2	46.4	-170.3	0	0	0	0	113.2
633	Q	29.8	Very low	37	Very low	158 Å²	158	145 Å²	145	74%	0.738	75%	0.749	S	S	*	*			trans	63.5	122.7	172.7	-93.2	-177.6	-31.1	0	0	119.8
634	M	22.3	Very low	37.1	Very low	160 Å²	160	144.3 Å²	144.3	79%	0.788	75%	0.751	S	S	*	*	S	Bend	trans	64.5	176.9	147.7	-68.9	-177.4	66.5	0	0	118.7	R636	M634-R636 PolarHBondContact O-N 3.22Å
635	N	38.6	Very low	37.5	Very low	142 Å²	142	145.1 Å²	145.1	76%	0.759	75%	0.747	S	S	*	*			trans	-46.6	121.9	170.4	-54.9	-72.7	0	0	0	113
636	R	51.9	Low	37.9	Very low	232 Å²	232	147.2 Å²	147.2	88%	0.875	75%	0.745	S	S	*	*			trans	-176.7	111.3	141.1	-101.5	150.2	-180	177	-0.6	113.3	M634	M634-R636 PolarHBondContact O-N 3.22Å
637	L	41.5	Very low	38.5	Very low	157 Å²	157	152.2 Å²	152.2	82%	0.822	75%	0.754	S	S	*	*			trans	60	123.7	140.6	-59.9	171.7	0	0	0	121.5
638	M	39.9	Very low	39.3	Very low	156 Å²	156	151.7 Å²	151.7	77%	0.768	75%	0.753	S	S	*	*			trans	82.5	129.3	147.9	-61	-75.4	-85.4	0	0	121.5
639	H	51.5	Low	39.6	Very low	161 Å²	161	148.4 Å²	148.4	75%	0.745	75%	0.748	S	S	*	*			trans	18.6	162.7	131.3	-68.6	105.7	0	0	0	122.6
640	P	43.8	Very low	39.9	Very low	102 Å²	102	147.4 Å²	147.4	66%	0.662	75%	0.753	S	S	*	*			cis	-140.1	168.8	-3.7	26.6	-1.8	0	0	0	118.6
641	I	52	Low	39.9	Very low	164 Å²	164	143.2 Å²	143.2	84%	0.841	75%	0.752	S	S	*	*			trans	46	122.1	141.4	-56.9	162.5	0	0	0	122.1
642	E	38.8	Very low	39.4	Very low	177 Å²	177	141.9 Å²	141.9	83%	0.827	75%	0.753	S	S	*	*			trans	-164.7	173.6	148.7	-118	-155.1	-172.3	0	0	109.3
643	P	40.5	Very low	38.9	Very low	113 Å²	113	142.6 Å²	142.6	73%	0.734	76%	0.762	S	S	*	*			cis	-125.4	164.4	-43.6	34.4	-19.3	0	0	0	112.7
644	G	36.2	Very low	38.8	Very low	74 Å²	74	143.8 Å²	143.8	76%	0.763	77%	0.765	S	S	*	*			trans	171.7	112.8	168.3	0	0	0	0	0	120.6
645	D	38.1	Very low	39.1	Very low	132 Å²	132	142.2 Å²	142.2	71%	0.706	77%	0.765	S	S	*	*				67.5	136.2	126	-131.3	35.1	0	0	0	124
646	K	41.3	Very low	38.8	Very low	169 Å²	169	138.6 Å²	138.6	74%	0.735	76%	0.76	S	S	*	*			trans	72.4	142.2	159.2	-66	167.6	178.7	101.1	0	121.1
647	R	45.3	Very low	37.7	Very low	238 Å²	238	135.8 Å²	135.8	90%	0.898	76%	0.755	S	S	*	*			trans	61.9	-170.9	162.5	-74.9	-178.9	177.5	-177.5	0.4	111.9
648	P	48.3	Very low	37	Very low	106 Å²	106	135.8 Å²	135.8	69%	0.688	75%	0.751	S	S	*	*			cis	-124.4	158	-11.8	11.7	13.7	0	0	0	116.2
649	V	38.8	Very low	37.1	Very low	118 Å²	118	133.5 Å²	133.5	72%	0.715	75%	0.747	S	S	*	*				32.1	146.6	123.2	-158.4	0	0	0	0	119.8
650	T	37.4	Very low	36.9	Very low	131 Å²	131	131 Å²	131	80%	0.804	75%	0.746	S	S	*	*			trans	83.1	148.3	170.9	81.4	0	0	0	0	114.3
651	S	28.2	Very low	36.2	Very low	99 Å²	99	133.5 Å²	133.5	69%	0.692	75%	0.753	S	S	*	*			cis	-146.7	157.8	-1.8	45.7	0	0	0	0	112.4
652	S	26.8	Very low	35.7	Very low	95 Å²	95	133.7 Å²	133.7	66%	0.664	76%	0.755	S	S	*	*			trans	32.9	141.1	144.3	65.5	0	0	0	0	123.4
653	S	26	Very low	36.1	Very low	111 Å²	111	130.1 Å²	130.1	78%	0.776	76%	0.755	S	S	*	*			trans	76	153.8	137.8	-70.1	0	0	0	0	119.6
654	F	27.6	Very low	35.5	Very low	183 Å²	183	135.9 Å²	135.9	80%	0.803	76%	0.762	S	S	*	*			cis	-167.8	173.7	-27.2	-156.6	-105.8	0	0	0	108.7
655	T	29.1	Very low	35.3	Very low	127 Å²	127	142.2 Å²	142.2	78%	0.779	76%	0.763	S	S	*	*			trans	65	153.8	178.6	72.3	0	0	0	0	115.9
656	G	32.7	Very low	34.8	Very low	65 Å²	65	141.9 Å²	141.9	67%	0.67	76%	0.762	S	S	*	*			cis	-162.4	174.5	-7.4	0	0	0	0	0	108.2
657	F	27	Very low	34.4	Very low	173 Å²	173	138.5 Å²	138.5	76%	0.759	76%	0.759	S	S	*	*			cis	-139.6	132.8	15.7	-98.7	-110.9	0	0	0	107.8
658	Q	28.1	Very low	33.7	Very low	158 Å²	158	131.5 Å²	131.5	74%	0.738	75%	0.747	S	S	*	*				67.9	155.4	89.1	-77	-161.2	-8.2	0	0	115.9
659	P	42.2	Very low	32.9	Very low	107 Å²	107	132.9 Å²	132.9	70%	0.695	75%	0.747	S	S	*	*			cis	-141.4	-158.2	-38.4	43.3	-25.2	0	0	0	110.6
660	P	47.8	Very low	32.9	Very low	110 Å²	110	136.6 Å²	136.6	71%	0.714	75%	0.754	S	S	*	*			cis	-126.3	138.2	-18.6	27.3	-6.2	0	0	0	115.9
661	L	28.1	Very low	32.3	Very low	154 Å²	154	140.1 Å²	140.1	81%	0.806	75%	0.752	S	S	*	*			trans	35.2	93.5	139.7	-57.4	178.4	0	0	0	121.8
662	L	41.5	Very low	32.4	Very low	168 Å²	168	142.4 Å²	142.4	88%	0.88	76%	0.756	S	S	*	*				54.5	101.7	116.4	-64.6	173.1	0	0	0	121
663	A	46.7	Very low	32.4	Very low	102 Å²	102	143.6 Å²	143.6	84%	0.843	76%	0.76	S	S	*	*			trans	-152.2	159.4	162.5	0	0	0	0	0	108.4
664	R	27.8	Very low	32.5	Very low	233 Å²	233	149.4 Å²	149.4	88%	0.879	77%	0.765	S	S	*	*			cis	-155.3	169.7	-25.3	-174.2	166.8	-176.6	-98.1	4.6	107.7
665	R	31.7	Very low	32.5	Very low	208 Å²	208	152.8 Å²	152.8	79%	0.785	77%	0.772	S	S	*	*			trans	-74.2	173.5	-172.2	-153.5	-172	-166.6	151	3.4	114.8
666	D	28.3	Very low	32.5	Very low	125 Å²	125	150 Å²	150	67%	0.668	77%	0.769	S	S	*	*			trans	84.6	150.4	153.6	-62.9	-43.5	0	0	0	118.6
667	S	32.4	Very low	32.2	Very low	98 Å²	98	152.4 Å²	152.4	69%	0.685	78%	0.775	S	S	*	*			cis	-174.3	172.6	-15.5	175.4	0	0	0	0	112.1
668	S	31	Very low	32.4	Very low	91 Å²	91	153.3 Å²	153.3	64%	0.636	78%	0.782	S	S	*	*			trans	90	120	144.2	-69.4	0	0	0	0	124
669	L	32.2	Very low	32.6	Very low	134 Å²	134	148.6 Å²	148.6	70%	0.702	78%	0.776	S	S	*	*			trans	61.2	146.5	131.2	-63.7	161.6	0	0	0	119.2	R671	L669-R671 HydrophobicContact CD2-CB 4.33Å
670	K	37.5	Very low	32	Very low	196 Å²	196	149.9 Å²	149.9	85%	0.852	78%	0.777	S	S	*	*			cis	-140.6	155.6	31.8	-57.4	159.8	-173.6	168.9	0	108.9
671	R	25.6	Very low	31.1	Very low	205 Å²	205	154.1 Å²	154.1	77%	0.774	78%	0.778	S	S	*	*			cis	72	99.6	32.4	-167.7	-163.7	-74.7	-149.5	0.2	115.7	L669	L669-R671 HydrophobicContact CD2-CB 4.33Å
672	L	29.7	Very low	31.3	Very low	148 Å²	148	152.4 Å²	152.4	78%	0.775	77%	0.774	S	S	*	*			trans	-165.6	118.8	134.2	-121.9	73.5	0	0	0	107.3
673	T	28	Very low	31.4	Very low	119 Å²	119	149.8 Å²	149.8	73%	0.73	77%	0.768	S	S	*	*				56.6	140.3	108.6	68.2	0	0	0	0	116
674	R	26.7	Very low	30.7	Very low	234 Å²	234	150.3 Å²	150.3	88%	0.883	77%	0.765	S	S	*	*			cis	-161.7	145.2	42.6	175.3	166.7	-178.2	174.1	2.7	114
675	W	27.8	Very low	31.8	Very low	254 Å²	254	144 Å²	144	96%	0.962	75%	0.754	S	S	*	*			trans	-73.9	136.3	160	-90	-42.9	0	0	0	111.9
676	G	29.9	Very low	31.6	Very low	69 Å²	69	141 Å²	141	71%	0.711	75%	0.754	S	S	*	*			trans	-170.4	113.6	166.5	0	0	0	0	0	107.9
677	S	27.2	Very low	31.7	Very low	114 Å²	114	140 Å²	140	80%	0.797	76%	0.757	S	S	*	*			cis	70.2	89.1	18.7	-158.5	0	0	0	0	115.4
678	Q	30.6	Very low	31.6	Very low	193 Å²	193	141.5 Å²	141.5	90%	0.902	76%	0.757	S	S	*	*			trans	164.8	152.8	141.3	-91.1	174	14.7	0	0	107.7
679	G	31.5	Very low	31.7	Very low	59 Å²	59	143.7 Å²	143.7	61%	0.608	76%	0.757	S	S	*	*			cis	-167.7	147	-3.3	0	0	0	0	0	108.2
680	N	29.9	Very low	31.8	Very low	134 Å²	134	144.4 Å²	144.4	72%	0.717	76%	0.757	S	S	*	*				51.3	126.7	81.1	-75.2	-36.9	0	0	0	113.1
681	R	28.5	Very low	31.5	Very low	199 Å²	199	144 Å²	144	75%	0.751	76%	0.758	S	S	*	*			cis	-155.4	155	4	-101.3	161.8	-169.4	-163.9	-5.5	107.9
682	T	32.1	Very low	32.1	Very low	117 Å²	117	144.1 Å²	144.1	72%	0.718	76%	0.764	S	S	*	*				41.9	157	79.5	91.9	0	0	0	0	114.3
683	P	44.6	Very low	32	Very low	114 Å²	114	142.9 Å²	142.9	74%	0.74	77%	0.768	S	S	*	*			cis	-123.1	-170.6	6.8	15.7	12.1	0	0	0	112.1
684	S	32.1	Very low	32.3	Very low	113 Å²	113	144.7 Å²	144.7	79%	0.79	77%	0.772	S	S	*	*			cis	-165.9	173.4	-19.8	-97	0	0	0	0	108.4
685	P	50.3	Low	32.6	Very low	101 Å²	101	141.5 Å²	141.5	66%	0.656	77%	0.773	S	S	*	*			trans	-120.8	-167.5	-163	44.6	-33.9	0	0	0	116
686	N	28.6	Very low	32.7	Very low	145 Å²	145	133.3 Å²	133.3	78%	0.775	77%	0.767	S	S	*	*			trans	77.3	148.5	165.5	-58.5	-2.2	0	0	0	115.9
687	S	29.7	Very low	32.7	Very low	104 Å²	104	133.1 Å²	133.1	73%	0.727	77%	0.765	S	S	*	*			cis	-154.1	171.9	35.1	-53.3	0	0	0	0	115.5
688	N	30.9	Very low	32.9	Very low	129 Å²	129	135.4 Å²	135.4	69%	0.69	77%	0.769	S	S	*	*			trans	7.9	154.1	137.2	-59.6	45.3	0	0	0	119.9
689	E	33.5	Very low	33	Very low	137 Å²	137	135.2 Å²	135.2	64%	0.64	77%	0.768	S	S	*	*			cis	-166.3	174.4	-5.9	-113.9	-179.2	113.2	0	0	112.1
690	Q	33.7	Very low	33.1	Very low	148 Å²	148	136.7 Å²	136.7	69%	0.692	77%	0.774	S	S	*	*			trans	-5.6	141.1	157	-44.2	173.9	30.5	0	0	120.5
691	Q	31.3	Very low	34.2	Very low	188 Å²	188	136 Å²	136	88%	0.879	78%	0.776	S	S	*	*				-176.4	176.3	107.3	-100.5	-173	4.7	0	0	115
692	K	37.1	Very low	34.6	Very low	207 Å²	207	132.9 Å²	132.9	90%	0.9	78%	0.779	S	S	*	*			trans	-99.2	162.6	-177.7	-68.7	178	173.6	179.2	0	113.1
693	S	28.9	Very low	35.7	Very low	122 Å²	122	132.8 Å²	132.8	85%	0.853	78%	0.781	S	S	*	*			trans	-149.7	171.4	153.5	52.8	0	0	0	0	112.4
694	L	33.8	Very low	35	Very low	157 Å²	157	131.3 Å²	131.3	82%	0.822	78%	0.779	S	S	*	*			trans	-137.3	179	-166.3	-83.8	164.7	0	0	0	112.7
695	N	32.5	Very low	35	Very low	167 Å²	167	130.8 Å²	130.8	89%	0.893	78%	0.775	S	S	*	*			trans	75.9	153.7	174.5	-50.6	-10.3	0	0	0	114.9
696	G	29.6	Very low	34.1	Very low	83 Å²	83	132.5 Å²	132.5	86%	0.856	78%	0.783	S	S	*	*			cis	164.9	165.6	-2.6	0	0	0	0	0	109
697	G	29.6	Very low	35.1	Very low	64 Å²	64	130.3 Å²	130.3	66%	0.66	78%	0.777	S	S	*	*			cis	174.8	163.7	-3.3	0	0	0	0	0	110.9
698	D	32	Very low	35.1	Very low	163 Å²	163	133 Å²	133	87%	0.872	78%	0.778	S	S	*	*			trans	62.9	161.7	163.6	-49.2	-44.2	0	0	0	118.7
699	E	32.5	Very low	35.2	Very low	189 Å²	189	134 Å²	134	88%	0.883	78%	0.779	S	S	*	*			cis	-148.6	-165.9	-2.4	-142.2	-177.2	159.3	0	0	111.9
700	A	34.1	Very low	35.2	Very low	89 Å²	89	133 Å²	133	74%	0.736	78%	0.778	S	S	*	*			trans	-123.7	-129.2	-173.5	0	0	0	0	0	114.3
701	P	53.7	Low	35.2	Very low	119 Å²	119	133.5 Å²	133.5	77%	0.773	78%	0.778	S	S	*	*				-119	-167.5	-69	39	-28.3	0	0	0	115.8
702	V	35.8	Very low	35.4	Very low	134 Å²	134	132.7 Å²	132.7	81%	0.812	78%	0.779	S	S	*	*			trans	-70.9	-176.6	163.4	-120.1	0	0	0	0	112.2
703	P	55	Low	35.5	Very low	115 Å²	115	129.8 Å²	129.8	75%	0.747	77%	0.773	S	S	*	*			cis	-143.7	-165.7	-5.2	38	-14.3	0	0	0	117.4
704	A	30.5	Very low	37	Very low	84 Å²	84	129.4 Å²	129.4	69%	0.694	77%	0.768	S	S	*	*			trans	86.2	116.1	135.5	0	0	0	0	0	125.5
705	S	31.1	Very low	37.5	Very low	102 Å²	102	126.1 Å²	126.1	71%	0.713	76%	0.763	S	S	*	*				55.1	110.9	119.1	-47.3	0	0	0	0	126.1
706	T	33	Very low	39.1	Very low	136 Å²	136	123.3 Å²	123.3	83%	0.834	75%	0.754	S	S	*	*			trans	61.3	179	136	58.6	0	0	0	0	118.8
707	P	47.8	Very low	40.4	Very low	99 Å²	99	128.2 Å²	128.2	64%	0.643	75%	0.754	S	S	*	*			cis	-136.8	-174.2	-1.6	45.4	-28	0	0	0	116.9
708	Q	31.3	Very low	41.2	Very low	161 Å²	161	136.4 Å²	136.4	75%	0.752	78%	0.783	S	S	*	*			trans	58.8	168.3	150.4	-78.6	-171.3	-71.9	0	0	120.8
709	E	32.9	Very low	41.7	Very low	149 Å²	149	135.1 Å²	135.1	70%	0.696	78%	0.779	S	S	*	*			cis	168	132.9	-36.2	-104	-169.5	132.3	0	0	106.5
710	D	32.8	Very low	42.2	Very low	117 Å²	117	132.2 Å²	132.2	63%	0.626	77%	0.773	S	S	*	*			trans	154.6	115.5	143.8	-94.2	11.8	0	0	0	111.3
711	K	34.3	Very low	42.6	Very low	159 Å²	159	134.6 Å²	134.6	69%	0.691	78%	0.775	S	S	*	*				83.9	123.1	81.1	-80	-165.6	-160.3	78	0	114.2
712	L	34.1	Very low	42	Very low	171 Å²	171	135.5 Å²	135.5	90%	0.895	78%	0.775	S	S	*	*				175.1	129.6	113.9	-94.5	160.9	0	0	0	113.8
713	D	40.6	Very low	42.4	Very low	146 Å²	146	135.6 Å²	135.6	78%	0.781	77%	0.773	S	S	*	*			trans	-78.6	-177	163.2	-81.6	-68	0	0	0	111.1
714	P	60.3	Low	41.5	Very low	114 Å²	114	137 Å²	137	74%	0.74	78%	0.775	S	S	*	*			cis	-145.4	169.4	17	43.8	-23.9	0	0	0	120.1
715	A	44.8	Very low	42.3	Very low	88 Å²	88	140.8 Å²	140.8	73%	0.727	78%	0.78	S	S	*	*				18	172.3	128.5	0	0	0	0	0	122.5
716	P	66.4	Low	43.2	Very low	107 Å²	107	143.8 Å²	143.8	70%	0.695	79%	0.786	S	S	*	*			cis	-139.6	175.2	6.5	44.1	-25.8	0	0	0	118.5
717	E	54.8	Low	44	Very low	186 Å²	186	144.4 Å²	144.4	87%	0.869	78%	0.781	S	S	*	*			trans	13.1	134.8	145.4	-57.8	176.1	142.1	0	0	122
718	N	48.3	Very low	43.7	Very low	236 Å²	236	148.5 Å²	148.5	100%	1.262	79%	0.794	S	S	*	*				-156.8	0	101.9	-150.1	23.5	0	0	0	111

Retrieved 718 of 718 residues in 307.5 ms (Link to these results)

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