A0A096N794_PAPAN Loading...

Proton-coupled zinc antiporter SLC30A9, mitochondrial

Mitochondrial proton-coupled zinc ion antiporter mediating the export of zinc from the mitochondria and involved in zinc homeostasis, zinc mobilization as well as mitochondrial morphology and health. In nucleus, functions as a secondary coactivator for nuclear receptors by cooperating with p160 coactivators subtypes. Plays a role in transcriptional activation of Wnt-responsive genes.

AlphaFold DB , UniProt , Accession A0A096N794, Species PAPAN (Papio anubis, Olive baboon), Gene SLC30A9, Length 569 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34	Very low	29.3	Very low	251 Å²	251	127.3 Å²	127.3	100%	1.236	84%	0.843	S	S	*	*				0	94.4	0	-76.7	172.4	166.1	0	0	108.2
2	L	26.7	Very low	29.3	Very low	168 Å²	168	129.7 Å²	129.7	88%	0.88	83%	0.833	S	S	*	*			trans	-79.9	173.6	155.7	-88.3	152.3	0	0	0	107.9
3	P	39.5	Very low	29.1	Very low	128 Å²	128	136.1 Å²	136.1	83%	0.831	83%	0.831	S	S	*	*			cis	-136	-174.4	12.9	24.7	2.4	0	0	0	112.4
4	G	28.5	Very low	28.9	Very low	62 Å²	62	135.3 Å²	135.3	64%	0.639	83%	0.832	S	S	*	*			cis	167.6	-178.8	7.6	0	0	0	0	0	111.6
5	L	28.9	Very low	28.7	Very low	174 Å²	174	133.1 Å²	133.1	91%	0.911	82%	0.824	S	S	*	*			trans	96.9	89.6	175	-67.6	151.2	0	0	0	115.3
6	A	28.8	Very low	28.6	Very low	98 Å²	98	139.3 Å²	139.3	81%	0.81	83%	0.827	S	S	*	*				71.2	129.6	66.2	0	0	0	0	0	112.9
7	A	27.7	Very low	28.4	Very low	99 Å²	99	136.1 Å²	136.1	82%	0.818	81%	0.814	S	S	*	*			cis	-162.6	159.1	35	0	0	0	0	0	115.7
8	A	26.3	Very low	28.3	Very low	92 Å²	92	134.6 Å²	134.6	76%	0.76	81%	0.811	S	S	*	*			trans	58.4	113	150.1	0	0	0	0	0	120.4
9	V	28.1	Very low	28.2	Very low	146 Å²	146	135.8 Å²	135.8	89%	0.885	81%	0.812	S	S	*	*				77.9	129.4	57.7	179.9	0	0	0	0	115.7
10	A	25.8	Very low	28.3	Very low	96 Å²	96	134.9 Å²	134.9	79%	0.793	81%	0.811	S	S	*	*			trans	88.5	149.5	165.9	0	0	0	0	0	117.6
11	A	28	Very low	28.2	Very low	86 Å²	86	139.8 Å²	139.8	71%	0.711	82%	0.815	S	S	*	*			cis	-177.2	149.9	-32.8	0	0	0	0	0	106.2
12	H	28.8	Very low	27.7	Very low	156 Å²	156	136.1 Å²	136.1	72%	0.722	80%	0.799	S	S	*	*			trans	66.4	119.3	148.6	-92.2	-91.5	0	0	0	124.9
13	R	27.8	Very low	27.7	Very low	213 Å²	213	139.8 Å²	139.8	80%	0.804	80%	0.802	S	S	*	*				50.9	137.7	126.8	-72.6	-170.5	-173.4	-170.7	0.8	124.2
14	C	25.8	Very low	27	Very low	125 Å²	125	142 Å²	142	85%	0.845	81%	0.805	S	S	*	*			trans	130.9	116.3	143.1	-77.2	0	0	0	0	111
15	S	26.1	Very low	26.8	Very low	102 Å²	102	150.9 Å²	150.9	71%	0.713	82%	0.819	S	S	*	*				84.5	145.4	56.2	-166.3	0	0	0	0	115.1
16	W	27	Very low	26.6	Very low	232 Å²	232	148.4 Å²	148.4	88%	0.879	82%	0.815	S	S	*	*			trans	98.4	112.5	168.8	-67.7	67.5	0	0	0	115.5
17	S	24.8	Very low	26.5	Very low	85 Å²	85	155.4 Å²	155.4	59%	0.594	82%	0.821	S	S	*	*				102.2	148.6	50.2	70.3	0	0	0	0	111.6
18	S	26.9	Very low	26.4	Very low	110 Å²	110	155.4 Å²	155.4	77%	0.769	82%	0.821	S	S	*	*			trans	80	141.4	170.9	73.1	0	0	0	0	117
19	L	27.2	Very low	26.3	Very low	158 Å²	158	155.9 Å²	155.9	83%	0.827	83%	0.825	S	S	*	*			cis	-163.8	158.4	15	-118.2	153.2	0	0	0	112.1
20	C	29	Very low	26.2	Very low	116 Å²	116	153.4 Å²	153.4	78%	0.784	82%	0.819	S	S	*	*			trans	-12.4	144.6	173.7	-71.2	0	0	0	0	125
21	R	26.1	Very low	26.2	Very low	239 Å²	239	161.1 Å²	161.1	90%	0.902	83%	0.828	S	S	*	*			trans	-67.6	145.3	153.5	-69.5	173.4	-123.6	-121.5	-4.1	111.5
22	L	24.6	Very low	26.1	Very low	173 Å²	173	160.5 Å²	160.5	91%	0.906	83%	0.83	S	S	*	*			trans	-139.1	129.4	143.9	-128	106.3	0	0	0	110.3
23	R	25.8	Very low	26.4	Very low	246 Å²	246	159.4 Å²	159.4	93%	0.928	84%	0.837	S	S	*	*			trans	-84.1	132.9	173.1	-88.9	176.7	169.7	166.2	-4.3	109
24	L	25.8	Very low	26.4	Very low	173 Å²	173	154.3 Å²	154.3	91%	0.906	83%	0.834	S	S	*	*			trans	-102.6	136.5	159.5	-91.9	155.1	0	0	0	109.2
25	R	24.3	Very low	26.5	Very low	249 Å²	249	154.5 Å²	154.5	94%	0.94	83%	0.827	S	S	*	*			trans	-110.2	116	175.4	-157.7	-179.7	-170.7	-176.9	2.8	106.9
26	C	25.2	Very low	26.6	Very low	122 Å²	122	158.6 Å²	158.6	82%	0.824	83%	0.827	S	S	*	*			trans	-88.3	149.5	173.4	-79.3	0	0	0	0	112
27	R	24.8	Very low	26.6	Very low	246 Å²	246	154 Å²	154	93%	0.928	82%	0.815	S	S	*	*			trans	-143.8	103.2	151.9	-105.6	-176.3	171.1	-179.4	-3.2	105.6
28	A	25.4	Very low	26.7	Very low	98 Å²	98	157.6 Å²	157.6	81%	0.81	82%	0.822	S	S	*	*				78.3	110.1	84.4	0	0	0	0	0	114.1
29	A	25.7	Very low	26.7	Very low	103 Å²	103	162.4 Å²	162.4	85%	0.851	82%	0.824	S	S	*	*				167.5	134.5	117.4	0	0	0	0	0	115.7
30	A	26.2	Very low	26.7	Very low	93 Å²	93	162.8 Å²	162.8	77%	0.769	82%	0.821	S	S	*	*			trans	72.7	113.4	139.5	0	0	0	0	0	125.3
31	R	26.1	Very low	26.6	Very low	258 Å²	258	164.4 Å²	164.4	97%	0.974	82%	0.822	S	S	*	*			trans	35.2	128.5	131.4	-60.5	177.1	-178.3	176.3	-0.2	118.4
32	G	24.7	Very low	26.6	Very low	74 Å²	74	159 Å²	159	76%	0.763	81%	0.81	S	S	*	*			cis	130.6	173.7	33.9	0	0	0	0	0	107.5
33	P	36	Very low	26.9	Very low	133 Å²	133	157.6 Å²	157.6	86%	0.864	81%	0.809	S	S	*	*			cis	-127.7	-172.6	-31.8	40.7	-22.7	0	0	0	114.3
34	S	27.5	Very low	27	Very low	106 Å²	106	154.1 Å²	154.1	74%	0.741	80%	0.8	S	S	*	*			trans	97.1	98	157.6	-163.2	0	0	0	0	118.3
35	D	27.2	Very low	27	Very low	129 Å²	129	155.5 Å²	155.5	69%	0.69	80%	0.799	S	S	*	*				78.1	135.3	112	-91.3	12.4	0	0	0	114.3
36	R	27.6	Very low	28.4	Very low	188 Å²	188	147 Å²	147	71%	0.709	79%	0.79	S	S	*	*			cis	-172.3	149.8	13	-121.8	168.6	-157.6	-129.9	7.3	109
37	Q	27.8	Very low	29.1	Very low	136 Å²	136	146.8 Å²	146.8	64%	0.636	79%	0.789	S	S	*	*			trans	59.7	142	147.5	-71.7	166.5	-77.2	0	0	119
38	E	26.4	Very low	29.3	Very low	159 Å²	159	144.5 Å²	144.5	74%	0.743	79%	0.786	S	S	*	*			cis	-166.2	171.6	15.2	-126.6	160.5	-149.5	0	0	110.6
39	W	27.1	Very low	29.4	Very low	212 Å²	212	144.5 Å²	144.5	80%	0.803	78%	0.78	S	S	*	*			trans	-80	161.5	-164.5	-64.2	75.1	0	0	0	114.5
40	Q	26.6	Very low	29.5	Very low	165 Å²	165	147.7 Å²	147.7	77%	0.771	78%	0.783	S	S	*	*				-179.3	136.1	82.6	-80.3	177	-0.9	0	0	112.8
41	N	27.6	Very low	29.5	Very low	151 Å²	151	149.9 Å²	149.9	81%	0.807	78%	0.779	S	S	*	*				163.4	142	119.7	-85	-31.9	0	0	0	113
42	L	26.5	Very low	29.7	Very low	125 Å²	125	144 Å²	144	65%	0.654	77%	0.771	S	S	*	*			trans	-125.6	127.5	-158.6	-162.8	135.6	0	0	0	110	K44	L42-K44 HydrophobicContact CD2-CG 3.98Å
43	V	31	Very low	29.9	Very low	144 Å²	144	145.9 Å²	145.9	87%	0.873	77%	0.77	S	S	*	*			trans	-119.8	128.5	175.1	-179.9	0	0	0	0	109.5
44	K	27.4	Very low	29.4	Very low	172 Å²	172	145.9 Å²	145.9	75%	0.748	77%	0.772	S	S	*	*			trans	-100.8	141.3	-173.9	-72.6	-179.1	176	178.2	0	112.3	L42	L42-K44 HydrophobicContact CD2-CG 3.98Å
45	F	25.3	Very low	29.4	Very low	203 Å²	203	147.1 Å²	147.1	89%	0.89	78%	0.775	S	S	*	*			trans	-142.6	114	158.3	-112.7	-87	0	0	0	109.3
46	G	54.6	Low	29.3	Very low	71 Å²	71	149.3 Å²	149.3	73%	0.732	78%	0.781	S	S	*	*	S	Bend	trans	59.7	-176.1	168.3	0	0	0	0	0	117.7	F48	G46-F48 PolarHBondContact O-N 2.91Å; G46-F48 VanDerWaalsContact O-N 3.15Å
47	S	38.8	Very low	29.3	Very low	116 Å²	116	145.2 Å²	145.2	81%	0.811	78%	0.778	S	S	*	*	S	Bend	trans	-88.3	74.5	-172.7	-171.7	0	0	0	0	111.4
48	F	29.2	Very low	29.1	Very low	198 Å²	198	149.3 Å²	149.3	87%	0.868	79%	0.79	S	S	*	*			trans	167	122.4	143.5	-94.4	-71.1	0	0	0	108.4	G46	G46-F48 PolarHBondContact O-N 2.91Å; G46-F48 VanDerWaalsContact O-N 3.15Å
49	S	28.7	Very low	29.2	Very low	98 Å²	98	148.7 Å²	148.7	69%	0.685	79%	0.79	S	S	*	*			trans	-106.8	133	-172.8	-36.7	0	0	0	0	109.6
50	N	27	Very low	29	Very low	170 Å²	170	141.8 Å²	141.8	91%	0.909	79%	0.785	S	S	*	*			trans	-147.1	127.5	163.6	-87.4	-34.5	0	0	0	110.2
51	M	27.3	Very low	28.9	Very low	139 Å²	139	139.8 Å²	139.8	69%	0.685	78%	0.784	S	S	*	*			trans	-85.2	135.8	-177.8	-84.9	174	150.1	0	0	111.8
52	V	30.6	Very low	28.9	Very low	135 Å²	135	141 Å²	141	82%	0.818	79%	0.79	S	S	*	*			trans	-112.8	124.5	167.6	178.3	0	0	0	0	107.7
53	P	27.8	Very low	28.8	Very low	113 Å²	113	140.1 Å²	140.1	73%	0.734	79%	0.794	S	S	*	*			trans	-78.6	128.6	178.1	26.9	-29.4	0	0	0	112.3
54	C	26.1	Very low	28.5	Very low	133 Å²	133	142.4 Å²	142.4	90%	0.899	80%	0.795	S	S	*	*			trans	-71.5	125.2	166.3	-68.2	0	0	0	0	109.9
55	T	28.1	Very low	28.3	Very low	132 Å²	132	139.3 Å²	139.3	81%	0.81	79%	0.79	S	S	*	*			trans	-122.7	117.8	163.1	40.5	0	0	0	0	108.9
56	H	25.1	Very low	28.3	Very low	176 Å²	176	137 Å²	137	82%	0.815	78%	0.78	S	S	*	*			trans	-91.8	119.8	166.9	-134.2	-61.9	0	0	0	106.6
57	P	26.8	Very low	26.7	Very low	101 Å²	101	142.9 Å²	142.9	66%	0.656	79%	0.786	S	S	*	*			trans	-94.5	114.2	160.4	28.9	-20.9	0	0	0	109	I59	P57-I59 PolarHBondContact O-N 3.19Å
58	Y	24.4	Very low	26	Very low	223 Å²	223	146.8 Å²	146.8	88%	0.875	78%	0.784	S	S	*	*			trans	-67.5	114.9	149.7	-96.7	-97.7	0	0	0	107.5
59	I	26.9	Very low	25.7	Very low	146 Å²	146	142.1 Å²	142.1	75%	0.749	78%	0.776	S	S	*	*			trans	-131.6	105.2	157.1	-63.6	179	0	0	0	106	P57	P57-I59 PolarHBondContact O-N 3.19Å
60	G	23.6	Very low	25.5	Very low	67 Å²	67	143.6 Å²	143.6	69%	0.691	78%	0.781	S	S	*	*			trans	-81.3	128.5	158	0	0	0	0	0	108.7
61	T	24.7	Very low	25.4	Very low	122 Å²	122	142.8 Å²	142.8	75%	0.748	78%	0.776	S	S	*	*			trans	-168.5	116.7	135.3	38.4	0	0	0	0	109.3
62	L	28.4	Very low	25.3	Very low	178 Å²	178	142.4 Å²	142.4	93%	0.932	78%	0.782	S	S	*	*			trans	24	100.6	136.7	-76	151	0	0	0	118.4
63	S	24	Very low	25	Very low	106 Å²	106	145.1 Å²	145.1	74%	0.741	79%	0.785	S	S	*	*			trans	-159.7	101.4	138.2	57.7	0	0	0	0	109	V65	S63-V65 PolarHBondContact O-N 2.97Å; S63-V65 VanDerWaalsContact O-N 3.15Å
64	Q	24.6	Very low	24.9	Very low	191 Å²	191	149.2 Å²	149.2	89%	0.893	79%	0.792	S	S	*	*			trans	-68	106.3	170	-81.5	-173.8	-17.7	0	0	109.1
65	V	23.1	Very low	24.9	Very low	108 Å²	108	152.3 Å²	152.3	66%	0.655	79%	0.793	S	S	*	*			trans	-92.5	108.7	163.4	177.8	0	0	0	0	107.2	S63 F67	S63-V65 PolarHBondContact O-N 2.97Å; S63-V65 VanDerWaalsContact O-N 3.15Å; V65-F67 PolarHBondContact O-N 3.08Å
66	K	24	Very low	24.7	Very low	155 Å²	155	149.6 Å²	149.6	67%	0.674	79%	0.791	S	S	*	*			trans	-69.4	114.9	170.9	-85.5	178	176.6	174.3	0	109.2	Y68	K66-Y68 HydrophobicContact CB-CE2 4.2Å
67	F	21.9	Very low	24.7	Very low	194 Å²	194	151 Å²	151	85%	0.851	80%	0.798	S	S	*	*			trans	-78.6	124.1	164.5	-78.7	-94.4	0	0	0	109.1	V65	V65-F67 PolarHBondContact O-N 3.08Å
68	Y	24.1	Very low	24.5	Very low	198 Å²	198	149.9 Å²	149.9	78%	0.776	81%	0.805	S	S	*	*			trans	-98.6	114	162.9	-73.9	-87.7	0	0	0	108.2	K66	K66-Y68 HydrophobicContact CB-CE2 4.2Å
69	S	23.7	Very low	24.5	Very low	100 Å²	100	144.9 Å²	144.9	70%	0.699	80%	0.802	S	S	*	*			trans	-110.4	115.5	166.9	178.7	0	0	0	0	107.4	N71	S69-N71 PolarHBondContact O-N 2.98Å
70	T	23.8	Very low	24.6	Very low	128 Å²	128	146 Å²	146	79%	0.785	80%	0.804	S	S	*	*			trans	-90.3	96.1	172.6	48.8	0	0	0	0	108.9
71	N	23.7	Very low	24.5	Very low	153 Å²	153	149.4 Å²	149.4	82%	0.818	81%	0.812	S	S	*	*			trans	-87	118.1	159.3	-90.1	-30.3	0	0	0	108.4	S69	S69-N71 PolarHBondContact O-N 2.98Å
72	V	25.2	Very low	24.5	Very low	132 Å²	132	152.3 Å²	152.3	80%	0.8	82%	0.822	S	S	*	*			trans	-94.9	112.3	169.9	173.5	0	0	0	0	107.7
73	Q	24.2	Very low	24.2	Very low	191 Å²	191	155.1 Å²	155.1	89%	0.893	82%	0.82	S	S	*	*			trans	-103.8	128.3	161.3	-105	172.6	-32.4	0	0	108.6
74	K	26.6	Very low	24.3	Very low	200 Å²	200	156.5 Å²	156.5	87%	0.87	82%	0.824	S	S	*	*			trans	-71.6	130.2	170.3	-81.6	177.2	169.5	179.3	0	109.6
75	E	25.4	Very low	24.3	Very low	198 Å²	198	156.6 Å²	156.6	93%	0.925	83%	0.825	S	S	*	*			trans	-141.8	145	142.7	-78.5	-160.9	154.2	0	0	109.8
76	G	24.9	Very low	24.3	Very low	74 Å²	74	160.8 Å²	160.8	76%	0.763	83%	0.834	S	S	*	*			trans	-88.1	168.4	-167.8	0	0	0	0	0	115.3
77	Q	25.8	Very low	24.3	Very low	205 Å²	205	159.8 Å²	159.8	96%	0.958	84%	0.84	S	S	*	*			trans	14.6	123	151.7	-69.7	175.2	-23.2	0	0	119
78	G	22.4	Very low	24.5	Very low	78 Å²	78	156.3 Å²	156.3	80%	0.804	84%	0.837	S	S	*	*			trans	175.7	91	160.1	0	0	0	0	0	115.9
79	S	24.3	Very low	24.4	Very low	118 Å²	118	151.7 Å²	151.7	83%	0.825	83%	0.834	S	S	*	*			trans	66.3	139.1	143.4	-141.2	0	0	0	0	123.2
80	Q	28.1	Very low	24.4	Very low	169 Å²	169	157.2 Å²	157.2	79%	0.79	85%	0.846	S	S	*	*			trans	-38.7	140	169.6	-63.7	166.1	-16.1	0	0	115.8
81	T	22.2	Very low	24.6	Very low	139 Å²	139	158.9 Å²	158.9	85%	0.853	84%	0.844	S	S	*	*				167.5	112	116.8	32.4	0	0	0	0	109.8
82	L	24.5	Very low	24.7	Very low	183 Å²	183	157.2 Å²	157.2	96%	0.958	84%	0.84	S	S	*	*			trans	-104.5	100.8	166	-103.7	158.9	0	0	0	107.9
83	R	21.9	Very low	24.7	Very low	237 Å²	237	155.7 Å²	155.7	89%	0.894	84%	0.842	S	S	*	*			trans	-89.5	130.4	170.7	-156	177.3	-169.9	-179.5	2.1	107.7
84	V	25.8	Very low	24.9	Very low	135 Å²	135	155 Å²	155	82%	0.818	84%	0.838	S	S	*	*			trans	-55.9	134.1	175.9	173.8	0	0	0	0	110.7
85	E	24.1	Very low	24.8	Very low	194 Å²	194	152.6 Å²	152.6	91%	0.907	84%	0.835	S	S	*	*			trans	-128.4	133.6	161.4	-135.7	171	-158.3	0	0	111.1
86	K	23.8	Very low	24.9	Very low	196 Å²	196	150.4 Å²	150.4	85%	0.852	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-79.3	143	-168.4	-100.4	173.3	169.9	178.7	0	111.8
87	V	23	Very low	25	Very low	133 Å²	133	150 Å²	150	81%	0.806	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-73.4	141.1	162	178.6	0	0	0	0	109.8
88	P	27.1	Very low	25	Very low	121 Å²	121	144.7 Å²	144.7	79%	0.786	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-95.9	133.6	157.1	26	-12.8	0	0	0	111.6
89	S	22.7	Very low	25.2	Very low	101 Å²	101	149.6 Å²	149.6	71%	0.706	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-75.2	154.6	176.3	46.2	0	0	0	0	113.3
90	F	23.9	Very low	25.3	Very low	217 Å²	217	151 Å²	151	95%	0.952	81%	0.814	S	S	*	*			trans	-138.4	121.4	149.8	-114.7	-87.7	0	0	0	109.4
91	E	26.8	Very low	25.3	Very low	162 Å²	162	152.2 Å²	152.2	76%	0.757	82%	0.817	S	S	*	*			trans	-73.1	164.1	164.7	-70	174.4	171.2	0	0	108.9
92	T	25.1	Very low	25.6	Very low	119 Å²	119	150 Å²	150	73%	0.73	81%	0.813	S	S	*	*			cis	-170.4	154.2	19.5	-3.2	0	0	0	0	107.5
93	A	26.4	Very low	26.4	Very low	100 Å²	100	147 Å²	147	83%	0.826	80%	0.804	S	S	*	*			trans	-176.3	111.4	133	0	0	0	0	0	109.4
94	E	27.5	Very low	26.7	Very low	177 Å²	177	144.2 Å²	144.2	83%	0.827	81%	0.806	S	S	*	*			trans	-59.7	150.8	170.2	-65.1	163.1	141.8	0	0	110.8
95	D	25.1	Very low	27.3	Very low	148 Å²	148	146.7 Å²	146.7	79%	0.791	81%	0.806	S	S	*	*				-178.3	152.4	91.5	-139.4	-14.3	0	0	0	113.8
96	I	27.9	Very low	27.8	Very low	153 Å²	153	146.5 Å²	146.5	79%	0.785	81%	0.805	S	S	*	*			trans	77.3	100.6	167.4	-43.5	167.9	0	0	0	115.2
97	G	26.4	Very low	28.7	Very low	65 Å²	65	145.2 Å²	145.2	67%	0.67	80%	0.802	S	S	*	*			cis	92.5	79.1	49.4	0	0	0	0	0	108.8
98	A	25.8	Very low	29.3	Very low	93 Å²	93	144 Å²	144	77%	0.769	80%	0.797	S	S	*	*				98.2	130.2	90.4	0	0	0	0	0	113
99	E	26	Very low	30.1	Very low	181 Å²	181	146 Å²	146	85%	0.846	80%	0.8	S	S	*	*			trans	69.7	107.1	153	-66.8	-179.1	149.4	0	0	119.9
100	L	27.5	Very low	30.7	Very low	149 Å²	149	148.7 Å²	148.7	78%	0.78	80%	0.802	S	S	*	*				-164.4	118	116.2	-97.3	144.3	0	0	0	111.4
101	K	27.6	Very low	31.5	Very low	193 Å²	193	144 Å²	144	84%	0.839	79%	0.79	S	S	*	*			trans	82	107.4	148.1	-65.5	169.3	175.7	173.6	0	119.8
102	A	28.7	Very low	32.1	Very low	94 Å²	94	145.6 Å²	145.6	78%	0.777	79%	0.79	S	S	*	*			trans	-96.5	174	145.2	0	0	0	0	0	109.7
103	P	41	Very low	32.7	Very low	119 Å²	119	145.8 Å²	145.8	77%	0.773	79%	0.79	S	S	*	*				-132.2	162.3	-52.2	35.7	-20.7	0	0	0	112
104	L	28.5	Very low	33.5	Very low	179 Å²	179	149.2 Å²	149.2	94%	0.937	79%	0.786	S	S	*	*			trans	-138.1	122.2	159	-104.2	161	0	0	0	110.2
105	K	38.4	Very low	34	Very low	187 Å²	187	144.4 Å²	144.4	81%	0.813	78%	0.777	S	S	*	*			trans	-64.2	134.1	-174.5	-76.9	174	170.1	-178	0	112.8
106	Q	35	Very low	34.8	Very low	189 Å²	189	143.1 Å²	143.1	88%	0.883	77%	0.774	S	S	*	*			trans	-136.2	113.9	147.9	-73.6	-175.4	-18.1	0	0	107.8	P108	Q106-P108 VanDerWaalsContact O-CD 3.31Å; Q106-P108 WeakPolarHBondContact O-CD 3.31Å
107	E	41.8	Very low	35.4	Very low	169 Å²	169	143.1 Å²	143.1	79%	0.79	78%	0.775	S	S	*	*			trans	-87.1	121.5	170.3	-74.1	-178.5	179.7	0	0	109.3
108	P	36.3	Very low	36.1	Very low	109 Å²	109	149.5 Å²	149.5	71%	0.708	79%	0.785	S	S	*	*			trans	-91.2	117.4	151.5	29.5	-25.9	0	0	0	109.1	Q106 Q110	Q106-P108 VanDerWaalsContact O-CD 3.31Å; Q106-P108 WeakPolarHBondContact O-CD 3.31Å; P108-Q110 PolarHBondContact O-N 3.3Å
109	L	43.6	Very low	36.7	Very low	162 Å²	162	154.6 Å²	154.6	85%	0.848	79%	0.789	S	S	*	*			trans	-50.7	99.7	167.2	-93.1	141.8	0	0	0	110.1	V111	L109-V111 PolarHBondContact O-N 3.36Å
110	Q	34.7	Very low	37.8	Very low	157 Å²	157	151.4 Å²	151.4	73%	0.734	77%	0.77	S	S	*	*			trans	-78.9	94.1	166.7	-75.7	-170.9	6.1	0	0	109	P108 R112	P108-Q110 PolarHBondContact O-N 3.3Å; Q110-R112 VanDerWaalsContact C-N 3.34Å; Q110-R112 PolarHBondContact O-N 3.43Å
111	V	41.1	Very low	38.4	Very low	118 Å²	118	153.2 Å²	153.2	72%	0.715	77%	0.774	S	S	*	*			trans	-67.8	96.7	162.8	-178.5	0	0	0	0	107.6	L109 V113	L109-V111 PolarHBondContact O-N 3.36Å; V111-V113 HydrophobicContact CG1-CG2 4.05Å; V111-V113 PolarHBondContact O-N 3.44Å; V111-V113 VanDerWaalsContact O-N 3.08Å
112	R	39.7	Very low	39.2	Very low	197 Å²	197	152.4 Å²	152.4	74%	0.743	77%	0.767	S	S	*	*			trans	-73.1	93.3	167.9	-86.9	-177.2	170	-177.5	-2.8	108.9	Q110 K114	Q110-R112 VanDerWaalsContact C-N 3.34Å; Q110-R112 PolarHBondContact O-N 3.43Å; R112-K114 VanDerWaalsContact C-N 3.32Å; R112-K114 PolarHBondContact O-N 2.91Å
113	V	38.2	Very low	40.5	Very low	122 Å²	122	150.5 Å²	150.5	74%	0.739	76%	0.756	S	S	*	*			trans	-70.9	92.4	162.7	-175.1	0	0	0	0	107.7	V111 A115	V111-V113 HydrophobicContact CG1-CG2 4.05Å; V111-V113 PolarHBondContact O-N 3.44Å; V111-V113 VanDerWaalsContact O-N 3.08Å; V113-A115 VanDerWaalsContact C-N 3.31Å; V113-A115 HydrophobicContact CG1-CB 4.28Å; V113-A115 PolarHBondContact O-N 2.98Å
114	K	42.8	Very low	41.1	Very low	172 Å²	172	150.3 Å²	150.3	75%	0.748	76%	0.758	S	S	*	*			trans	-87.1	75.9	164.1	-89.4	-171.4	174.6	-177.4	0	109	R112 V116	R112-K114 VanDerWaalsContact C-N 3.32Å; R112-K114 PolarHBondContact O-N 2.91Å; K114-V116 VanDerWaalsContact C-N 3.31Å; K114-V116 PolarHBondContact O-N 3.42Å
115	A	38.7	Very low	42.2	Very low	76 Å²	76	151 Å²	151	63%	0.628	75%	0.753	S	S	*	*			trans	-88.1	80.1	155.7	0	0	0	0	0	107.2	V113 L117	V113-A115 VanDerWaalsContact C-N 3.31Å; V113-A115 HydrophobicContact CG1-CB 4.28Å; V113-A115 PolarHBondContact O-N 2.98Å; A115-L117 PolarHBondContact O-N 3.34Å
116	V	41.2	Very low	43	Very low	122 Å²	122	147.3 Å²	147.3	74%	0.739	74%	0.735	S	S	*	*			trans	-75.6	85.9	167.3	-177.5	0	0	0	0	105.9	K114 K118	K114-V116 VanDerWaalsContact C-N 3.31Å; K114-V116 PolarHBondContact O-N 3.42Å; V116-K118 PolarHBondContact O-N 3.4Å
117	L	40.5	Very low	44.2	Very low	153 Å²	153	139.7 Å²	139.7	80%	0.801	70%	0.702	S	S	*	*			trans	-52.9	113.6	164.2	-84.1	159.3	0	0	0	106.4	A115 K119	A115-L117 PolarHBondContact O-N 3.34Å; L117-K119 PolarHBondContact O-N 2.89Å
118	K	40.9	Very low	45.2	Very low	199 Å²	199	137.5 Å²	137.5	87%	0.865	69%	0.691	S	S	*	*			trans	-50.5	119.2	176.4	-133.2	177.5	-175.3	177.6	0	106.5	V116 R120	V116-K118 PolarHBondContact O-N 3.4Å; K118-R120 PolarHBondContact O-N 3.21Å
119	K	38.6	Very low	46.7	Very low	199 Å²	199	136.8 Å²	136.8	87%	0.865	68%	0.681	S	S	*	*			trans	-56.1	111.1	179.1	-167.5	178.5	-176.3	-178.5	0	107	L117 E121	L117-K119 PolarHBondContact O-N 2.89Å; K119-E121 PolarHBondContact O-N 3.22Å
120	R	48.2	Very low	48.3	Very low	115 Å²	115	133 Å²	133	43%	0.434	66%	0.662	S	S	.	*			trans	-59.9	115.7	176.9	-90.8	-177.8	-177.9	176.9	1	107.6	K118 Y122 E529	K118-R120 PolarHBondContact O-N 3.21Å; R120-Y122 HydrophobicContact CB-CD2 4.35Å; R120-Y122 HydrophobicContact CB-CE2 3.87Å; R120-Y122 WeakPolarHBondContact O-CD2 3.21Å; R120-Y122 PolarHBondContact O-N 3.09Å; R120-E529 IonicContact CZ-OE1 2.83Å; R120-E529 IonicContact NH2-OE1 3.86Å; R120-E529 PolarHBondContact NH2-OE1 3.4Å
121	E	42.1	Very low	50.6	Low	187 Å²	187	127.8 Å²	127.8	87%	0.874	64%	0.637	S	S	*	*			trans	-72.6	97.3	169.9	-72.1	-173.9	172.6	0	0	107.6	K119 G123	K119-E121 PolarHBondContact O-N 3.22Å; E121-G123 PolarHBondContact O-N 3Å
122	Y	44	Very low	52.6	Low	176 Å²	176	122.2 Å²	122.2	69%	0.69	60%	0.603	S	S	*	*			trans	-74.6	60.9	167	-61.8	-80.3	0	0	0	109.4	R120	R120-Y122 HydrophobicContact CB-CD2 4.35Å; R120-Y122 HydrophobicContact CB-CE2 3.87Å; R120-Y122 WeakPolarHBondContact O-CD2 3.21Å; R120-Y122 PolarHBondContact O-N 3.09Å
123	G	54.7	Low	54.8	Low	54 Å²	54	114.9 Å²	114.9	56%	0.557	58%	0.58	S	S	*	*			trans	-97.6	132.7	172.8	0	0	0	0	0	110.8	E121	E121-G123 PolarHBondContact O-N 3Å
124	S	54.8	Low	57	Low	115 Å²	115	109.8 Å²	109.8	80%	0.804	55%	0.552	S	S	*	*	S	Bend	trans	63.4	159.6	-168.2	77.7	0	0	0	0	114.3	Y126	S124-Y126 PolarHBondContact O-N 3.07Å
125	K	51.1	Low	58.9	Low	194 Å²	194	106.3 Å²	106.3	84%	0.843	55%	0.546	S	S	*	.			trans	-56.4	114.4	178.9	-78.6	-177.9	177.8	179.4	0	108.8	T127	K125-T127 PolarHBondContact O-N 3.31Å; K125-T127 VanDerWaalsContact O-N 3.13Å
126	Y	55.5	Low	61	Low	108 Å²	108	108.5 Å²	108.5	42%	0.424	54%	0.538	S	S	.	.			trans	-67.5	108.9	177.8	-175.8	-103.4	0	0	0	110	S124 Q128 N129	S124-Y126 PolarHBondContact O-N 3.07Å; Y126-Q128 HydrophobicContact CE2-CB 4.09Å; Y126-Q128 HydrophobicContact CE2-CG 4.49Å; Y126-N129 HydrophobicContact CE1-CB 4.16Å
127	T	59.2	Low	63	Low	30 Å²	30	102.7 Å²	102.7	18%	0.184	50%	0.502	C	S	.	.			trans	-112.7	-7.6	-178.3	52.7	0	0	0	0	113.9	K125 N129 N130 R171 E175	K125-T127 PolarHBondContact O-N 3.31Å; K125-T127 VanDerWaalsContact O-N 3.13Å; T127-N129 VanDerWaalsContact C-N 3.33Å; T127-N129 PolarHBondContact O-N 3.49Å; T127-N130 PolarHBondContact O-N 3.46Å; T127-N130 VanDerWaalsContact O-N 3.16Å; T127-R171 HydrophobicContact CG2-CG 4.46Å; T127-E175 PolarHBondContact OG1-OE2 3.01Å
128	Q	63.7	Low	65.2	Low	122 Å²	122	97.4 Å²	97.4	57%	0.57	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-38.1	-170.8	-71.1	-177.3	-14.3	0	0	113.7	Y126 L170	Y126-Q128 HydrophobicContact CE2-CB 4.09Å; Y126-Q128 HydrophobicContact CE2-CG 4.49Å; Q128-L170 VanDerWaalsContact O-CD1 3.3Å; Q128-L170 WeakPolarHBondContact O-CD1 3.43Å
129	N	67.9	Low	67	Low	94 Å²	94	93 Å²	93	50%	0.503	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	19.7	178.2	-69.6	4.4	0	0	0	113.1	Y126 T127	Y126-N129 HydrophobicContact CE1-CB 4.16Å; T127-N129 VanDerWaalsContact C-N 3.33Å; T127-N129 PolarHBondContact O-N 3.49Å
130	N	77.7	Confident	69.1	Low	82 Å²	82	86.3 Å²	86.3	44%	0.439	43%	0.432	S	S	.	.			trans	-91.1	135.2	178.3	-162.7	-17.4	0	0	0	110	T127 R171	T127-N130 PolarHBondContact O-N 3.46Å; T127-N130 VanDerWaalsContact O-N 3.16Å; N130-R171 HydrophobicContact CB-CB 4.29Å; N130-R171 WeakPolarHBondContact O-CB 3.48Å; N130-R171 PolarHBondContact O-N 3.43Å
131	F	82.9	Confident	70.9	Confident	48 Å²	48	81.1 Å²	81.1	21%	0.211	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	141.4	177.5	-60.8	-68	0	0	0	111.3	I154 V168 Y169 L170 E537	F131-I154 HydrophobicContact CD1-CD1 4.1Å; F131-I154 HydrophobicContact CE1-CD1 3.45Å; F131-I154 VanDerWaalsContact CE1-CD1 3.45Å; F131-I154 HydrophobicContact CE1-CG2 4.44Å; F131-I154 HydrophobicContact CZ-CD1 4.37Å; F131-V168 HydrophobicContact CB-CB 3.97Å; F131-V168 HydrophobicContact CB-CG1 4.43Å; F131-V168 HydrophobicContact CB-CG2 3.82Å; F131-V168 HydrophobicContact CD1-CG2 3.99Å; F131-V168 HydrophobicContact CG-CG2 3.99Å; F131-Y169 WeakPolarHBondContact CA-O 3.44Å; F131-L170 HydrophobicContact CD1-CD1 4.1Å; F131-L170 HydrophobicContact CE1-CD1 3.7Å; F131-L170 HydrophobicContact CZ-CD1 4.4Å; F131-E537 WeakPolarHBondContact CE2-OE1 3.3Å; F131-E537 WeakPolarHBondContact CZ-OE1 3.48Å
132	I	82.9	Confident	72.9	Confident	2 Å²	2	72.4 Å²	72.4	1%	0.01	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	135.5	176.7	-167.1	169.4	0	0	0	110.4	R136 A137 F141 V168 Y169 R171 V174	I132-R136 HydrophobicContact CD1-CB 3.72Å; I132-R136 HydrophobicContact CG1-CB 3.47Å; I132-R136 VanDerWaalsContact CG1-CB 3.47Å; I132-A137 HydrophobicContact CG2-CB 4.23Å; I132-F141 HydrophobicContact CD1-CD2 4.14Å; I132-F141 HydrophobicContact CD1-CE2 3.67Å; I132-V168 WeakPolarHBondContact O-CA 3.14Å; I132-Y169 PolarHBondContact N-O 3.39Å; I132-Y169 PolarHBondContact O-N 2.95Å; I132-R171 HydrophobicContact CG2-CB 4.42Å; I132-V174 HydrophobicContact CG2-CB 4.23Å; I132-V174 HydrophobicContact CG2-CG1 4.4Å; I132-V174 HydrophobicContact CG2-CG2 3.74Å
133	T	85.8	Confident	75	Confident	42 Å²	42	64 Å²	64	26%	0.258	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	149.1	172.2	58	0	0	0	0	110	V135 R136 A137 F166	T133-V135 PolarHBondContact O-N 3.37Å; T133-R136 PolarHBondContact O-N 3.22Å; T133-R136 VanDerWaalsContact O-N 3.13Å; T133-R136 WeakPolarHBondContact OG1-CB 3.3Å; T133-R136 VanDerWaalsContact OG1-CG 3.24Å; T133-R136 WeakPolarHBondContact OG1-CG 3.38Å; T133-R136 PolarHBondContact OG1-N 3.17Å; T133-A137 PolarHBondContact O-N 3.29Å; T133-F166 HydrophobicContact CG2-CD2 3.97Å; T133-F166 HydrophobicContact CG2-CE2 3.39Å; T133-F166 HydrophobicContact CG2-CZ 4.32Å
134	G	83.6	Confident	76.7	Confident	15 Å²	15	68.4 Å²	68.4	16%	0.155	34%	0.343	C	S	.	.	H	α-helix	trans	-54.2	-38.3	173.7	0	0	0	0	0	114	A137 I138	G134-A137 WeakPolarHBondContact O-CB 3.22Å; G134-A137 PolarHBondContact O-N 3.14Å; G134-I138 WeakPolarHBondContact O-CG1 3.49Å; G134-I138 PolarHBondContact O-N 2.83Å
135	V	82.8	Confident	78.3	Confident	100 Å²	100	66.7 Å²	66.7	61%	0.606	33%	0.331	S	S	*	.	H	α-helix	trans	-62.6	-48.8	177	-179.3	0	0	0	0	111.5	T133 A137 I138 N139	T133-V135 PolarHBondContact O-N 3.37Å; V135-A137 VanDerWaalsContact C-N 3.31Å; V135-A137 PolarHBondContact O-N 3.22Å; V135-I138 PolarHBondContact O-N 3.3Å; V135-N139 WeakPolarHBondContact O-CB 3.47Å; V135-N139 PolarHBondContact O-N 3.12Å; V135-N139 PolarHBondContact O-ND2 3.14Å
136	R	82.2	Confident	80.1	Confident	122 Å²	122	60.3 Å²	60.3	46%	0.46	31%	0.311	S	S	.	.	H	α-helix	trans	-64.6	-33.8	173.7	-70.1	179.3	66.1	-168.6	-0.1	112.1	I132 T133 N139 E140	I132-R136 HydrophobicContact CD1-CB 3.72Å; I132-R136 HydrophobicContact CG1-CB 3.47Å; I132-R136 VanDerWaalsContact CG1-CB 3.47Å; T133-R136 PolarHBondContact O-N 3.22Å; T133-R136 VanDerWaalsContact O-N 3.13Å; T133-R136 WeakPolarHBondContact OG1-CB 3.3Å; T133-R136 VanDerWaalsContact OG1-CG 3.24Å; T133-R136 WeakPolarHBondContact OG1-CG 3.38Å; T133-R136 PolarHBondContact OG1-N 3.17Å; R136-N139 PolarHBondContact O-N 3.25Å; R136-E140 HydrophobicContact CB-CG 4.48Å; R136-E140 IonicContact CZ-OE1 2.78Å; R136-E140 IonicContact NE-OE1 3.88Å; R136-E140 PolarHBondContact NE-OE1 2.96Å; R136-E140 IonicContact NH2-OE1 3.77Å; R136-E140 PolarHBondContact NH2-OE1 3Å; R136-E140 IonicContact NH2-OE2 2.61Å; R136-E140 WeakPolarHBondContact O-CA 3.44Å; R136-E140 WeakPolarHBondContact O-CB 3.5Å; R136-E140 WeakPolarHBondContact O-CG 3.49Å; R136-E140 PolarHBondContact O-N 3.28Å
137	A	84	Confident	81.7	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-62.6	-45.7	175.5	0	0	0	0	0	111.7	I132 T133 G134 V135 F141 L148 V174	I132-A137 HydrophobicContact CG2-CB 4.23Å; T133-A137 PolarHBondContact O-N 3.29Å; G134-A137 WeakPolarHBondContact O-CB 3.22Å; G134-A137 PolarHBondContact O-N 3.14Å; V135-A137 VanDerWaalsContact C-N 3.31Å; V135-A137 PolarHBondContact O-N 3.22Å; A137-F141 WeakPolarHBondContact O-CA 3.37Å; A137-F141 VanDerWaalsContact O-CB 3.29Å; A137-F141 WeakPolarHBondContact O-CB 3.39Å; A137-F141 PolarHBondContact O-N 2.97Å; A137-L148 HydrophobicContact CB-CD1 4.24Å; A137-L148 HydrophobicContact CB-CD2 3.78Å; A137-V174 HydrophobicContact CB-CG1 3.76Å; A137-V174 HydrophobicContact CB-CG2 4.15Å
138	I	85.9	Confident	83	Confident	41 Å²	41	55.3 Å²	55.3	21%	0.21	29%	0.291	C	S	.	.	H	α-helix	trans	-62	-45	175.8	-71.7	162.5	0	0	0	111.4	G134 V135 C142 L143 L148	G134-I138 WeakPolarHBondContact O-CG1 3.49Å; G134-I138 PolarHBondContact O-N 2.83Å; V135-I138 PolarHBondContact O-N 3.3Å; I138-C142 CarbonylContact O-C 3.45Å; I138-C142 WeakPolarHBondContact O-CA 3.26Å; I138-C142 PolarHBondContact O-N 2.88Å; I138-L143 WeakPolarHBondContact CA-O 3.41Å; I138-L143 WeakPolarHBondContact CG2-O 3.47Å; I138-L143 PolarHBondContact O-N 3.33Å; I138-L148 HydrophobicContact CD1-CD1 3.96Å; I138-L148 HydrophobicContact CG1-CD1 3.84Å
139	N	80.1	Confident	84.1	Confident	106 Å²	106	56 Å²	56	57%	0.567	29%	0.294	S	S	*	.	H	α-helix	trans	-79	-45.2	-175.1	-68.6	-18.6	0	0	0	112.9	V135 R136	V135-N139 WeakPolarHBondContact O-CB 3.47Å; V135-N139 PolarHBondContact O-N 3.12Å; V135-N139 PolarHBondContact O-ND2 3.14Å; R136-N139 PolarHBondContact O-N 3.25Å
140	E	81.7	Confident	84.9	Confident	59 Å²	59	58.5 Å²	58.5	28%	0.276	30%	0.303	S	S	.	.	H	α-helix	trans	-81.5	-21.1	-177.7	-66.1	-174.9	-164.4	0	0	113.5	R136 R171 K192	R136-E140 HydrophobicContact CB-CG 4.48Å; R136-E140 IonicContact CZ-OE1 2.78Å; R136-E140 IonicContact NE-OE1 3.88Å; R136-E140 PolarHBondContact NE-OE1 2.96Å; R136-E140 IonicContact NH2-OE1 3.77Å; R136-E140 PolarHBondContact NH2-OE1 3Å; R136-E140 IonicContact NH2-OE2 2.61Å; R136-E140 WeakPolarHBondContact O-CA 3.44Å; R136-E140 WeakPolarHBondContact O-CB 3.5Å; R136-E140 WeakPolarHBondContact O-CG 3.49Å; R136-E140 PolarHBondContact O-N 3.28Å; E140-R171 IonicContact OE2-CZ 3.71Å; E140-R171 IonicContact OE2-NH1 2.76Å; E140-R171 PolarHBondContact OE2-NH1 3.09Å; E140-R171 IonicContact OE2-NH2 3.83Å; E140-K192 WeakPolarHBondContact O-CE 3.23Å; E140-K192 PolarHBondContact O-NZ 2.91Å
141	F	86.3	Confident	85.4	Confident	7 Å²	7	55.8 Å²	55.8	3%	0.031	29%	0.288	C	S	.	.	H	α-helix	trans	-121.1	8.7	-180	-64	-83.9	0	0	0	113.4	I132 A137 L143 R171 V174 E175 W182 L188	I132-F141 HydrophobicContact CD1-CD2 4.14Å; I132-F141 HydrophobicContact CD1-CE2 3.67Å; A137-F141 WeakPolarHBondContact O-CA 3.37Å; A137-F141 VanDerWaalsContact O-CB 3.29Å; A137-F141 WeakPolarHBondContact O-CB 3.39Å; A137-F141 PolarHBondContact O-N 2.97Å; F141-L143 HydrophobicContact CB-CD1 4.16Å; F141-L143 HydrophobicContact CB-CG 4.05Å; F141-L143 PolarHBondContact O-N 3.15Å; F141-R171 HydrophobicContact CZ-CG 4.35Å; F141-V174 HydrophobicContact CB-CG1 4.12Å; F141-V174 HydrophobicContact CD2-CG1 3.42Å; F141-V174 VanDerWaalsContact CD2-CG1 3.42Å; F141-V174 HydrophobicContact CE2-CG1 3.88Å; F141-V174 HydrophobicContact CG-CG1 3.78Å; F141-E175 HydrophobicContact CD1-CG 4.25Å; F141-E175 HydrophobicContact CE1-CB 4.41Å; F141-E175 HydrophobicContact CE1-CG 3.3Å; F141-E175 HydrophobicContact CZ-CG 3.49Å; F141-E175 VanDerWaalsContact CZ-CG 3.49Å; F141-W182 PolarHBondContact O-NE1 3.39Å; F141-L188 HydrophobicContact CD1-CD2 4.24Å; F141-L188 VanDerWaalsContact O-CD1 3.3Å; F141-L188 WeakPolarHBondContact O-CD1 3.46Å
142	C	84.7	Confident	85.6	Confident	3 Å²	3	62.4 Å²	62.4	2%	0.02	31%	0.311	C	S	.	.			trans	56.2	19.1	178.4	-60.6	0	0	0	0	114.4	I138 W182 L188 E191 R195	I138-C142 CarbonylContact O-C 3.45Å; I138-C142 WeakPolarHBondContact O-CA 3.26Å; I138-C142 PolarHBondContact O-N 2.88Å; C142-W182 HydrophobicContact CB-CZ2 3.75Å; C142-W182 WeakPolarHBondContact O-CZ2 3.2Å; C142-L188 HydrophobicContact CB-CD1 4.04Å; C142-E191 HydrophobicContact CB-CG 3.85Å; C142-R195 PolarHBondContact O-NH2 3.02Å; C142-R195 VanDerWaalsContact O-NH2 3.11Å
143	L	87.6	Confident	85.8	Confident	1 Å²	1	68 Å²	68	1%	0.005	34%	0.335	C	S	.	.			trans	-73.5	159	179.7	-68.3	175.9	0	0	0	111.8	I138 F141 D147 L148 V174 K177 V181	I138-L143 WeakPolarHBondContact CA-O 3.41Å; I138-L143 WeakPolarHBondContact CG2-O 3.47Å; I138-L143 PolarHBondContact O-N 3.33Å; F141-L143 HydrophobicContact CB-CD1 4.16Å; F141-L143 HydrophobicContact CB-CG 4.05Å; F141-L143 PolarHBondContact O-N 3.15Å; L143-D147 HydrophobicContact CB-CB 4.39Å; L143-D147 HydrophobicContact CD2-CB 4.17Å; L143-L148 HydrophobicContact CD1-CD2 4Å; L143-V174 HydrophobicContact CD1-CG1 3.76Å; L143-K177 HydrophobicContact CD2-CG 4.39Å; L143-V181 HydrophobicContact CD2-CB 4.2Å; L143-V181 HydrophobicContact CD2-CG2 3.88Å
144	K	89.7	Confident	85.7	Confident	145 Å²	145	67.6 Å²	67.6	63%	0.63	33%	0.331	S	S	*	.			trans	-93.6	160.5	170.6	-61.7	174.8	-176.5	172.9	0	110.3	S146 D147	K144-S146 WeakPolarHBondContact CB-OG 3.35Å; K144-S146 PolarHBondContact O-N 3.04Å; K144-D147 WeakPolarHBondContact CB-OD2 3.45Å; K144-D147 PolarHBondContact N-OD2 3.32Å; K144-D147 WeakPolarHBondContact O-CB 3.49Å; K144-D147 PolarHBondContact O-N 3.46Å
145	S	88.1	Confident	85.6	Confident	80 Å²	80	76.1 Å²	76.1	56%	0.559	36%	0.359	S	S	*	.	H	α-helix	trans	-57.8	-34.9	175.2	-53.7	0	0	0	0	112.6	D147 L148	S145-D147 VanDerWaalsContact C-N 3.25Å; S145-D147 PolarHBondContact O-N 3.18Å; S145-L148 PolarHBondContact O-N 2.93Å
146	S	90.1	Very high	85	Confident	60 Å²	60	73.5 Å²	73.5	42%	0.42	34%	0.338	S	S	.	.	H	α-helix	trans	-59.2	-35.1	174.1	51.9	0	0	0	0	113	K144 L148 E149	K144-S146 WeakPolarHBondContact CB-OG 3.35Å; K144-S146 PolarHBondContact O-N 3.04Å; S146-L148 PolarHBondContact O-N 3.49Å; S146-E149 PolarHBondContact O-N 3.27Å
147	D	88	Confident	84.1	Confident	27 Å²	27	72.8 Å²	72.8	14%	0.144	34%	0.336	C	S	.	.	H	α-helix	trans	-75	-22.5	-175.3	-49.5	-24.6	0	0	0	111	L143 K144 S145 K177	L143-D147 HydrophobicContact CB-CB 4.39Å; L143-D147 HydrophobicContact CD2-CB 4.17Å; K144-D147 WeakPolarHBondContact CB-OD2 3.45Å; K144-D147 PolarHBondContact N-OD2 3.32Å; K144-D147 WeakPolarHBondContact O-CB 3.49Å; K144-D147 PolarHBondContact O-N 3.46Å; S145-D147 VanDerWaalsContact C-N 3.25Å; S145-D147 PolarHBondContact O-N 3.18Å; D147-K177 HydrophobicContact CB-CG 4.44Å
148	L	87.4	Confident	82.8	Confident	6 Å²	6	73.8 Å²	73.8	3%	0.031	34%	0.343	C	S	.	.	H	α-helix	trans	-82.8	-19.4	176.7	-58.3	-177.3	0	0	0	113.1	A137 I138 L143 S145 S146 Q150 L151 Y169	A137-L148 HydrophobicContact CB-CD1 4.24Å; A137-L148 HydrophobicContact CB-CD2 3.78Å; I138-L148 HydrophobicContact CD1-CD1 3.96Å; I138-L148 HydrophobicContact CG1-CD1 3.84Å; L143-L148 HydrophobicContact CD1-CD2 4Å; S145-L148 PolarHBondContact O-N 2.93Å; S146-L148 PolarHBondContact O-N 3.49Å; L148-Q150 PolarHBondContact O-N 2.93Å; L148-L151 HydrophobicContact CD2-CD1 3.88Å; L148-L151 PolarHBondContact O-N 3.44Å; L148-L151 VanDerWaalsContact O-N 3.17Å; L148-Y169 HydrophobicContact CB-CE1 4.22Å; L148-Y169 HydrophobicContact CB-CE2 4.27Å; L148-Y169 HydrophobicContact CD1-CE2 4.06Å; L148-Y169 VanDerWaalsContact O-CE1 3.25Å; L148-Y169 WeakPolarHBondContact O-CE1 3.38Å
149	E	87	Confident	81	Confident	137 Å²	137	76.8 Å²	76.8	64%	0.64	36%	0.364	S	S	*	.	H	α-helix	trans	-65.9	-30.5	-179.2	-70.1	179.3	179.7	0	0	112.6	S146 L151	S146-E149 PolarHBondContact O-N 3.27Å; E149-L151 VanDerWaalsContact C-N 3.29Å
150	Q	84.4	Confident	79.3	Confident	146 Å²	146	79.8 Å²	79.8	68%	0.682	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-14.2	178.2	-62	179	-6.7	0	0	112.7	L148	L148-Q150 PolarHBondContact O-N 2.93Å
151	L	88.5	Confident	77.6	Confident	24 Å²	24	83 Å²	83	13%	0.126	39%	0.39	C	S	.	.	S	Bend	trans	-85.9	149.6	-178.8	-63.5	-178.1	0	0	0	111.4	L148 E149 K153 Y169 D173 V174 K177	L148-L151 HydrophobicContact CD2-CD1 3.88Å; L148-L151 PolarHBondContact O-N 3.44Å; L148-L151 VanDerWaalsContact O-N 3.17Å; E149-L151 VanDerWaalsContact C-N 3.29Å; L151-K153 PolarHBondContact O-N 2.89Å; L151-K153 VanDerWaalsContact O-N 3.09Å; L151-Y169 HydrophobicContact CB-CD1 3.59Å; L151-Y169 HydrophobicContact CB-CE1 4.05Å; L151-Y169 HydrophobicContact CD1-CD1 4.39Å; L151-D173 HydrophobicContact CD2-CB 4.09Å; L151-V174 HydrophobicContact CD1-CB 4.47Å; L151-V174 HydrophobicContact CD1-CG2 3.7Å; L151-K177 HydrophobicContact CD1-CB 4.37Å; L151-K177 HydrophobicContact CD2-CB 4.11Å; L151-K177 HydrophobicContact CD2-CG 4.39Å
152	R	86.3	Confident	75.8	Confident	188 Å²	188	88 Å²	88	71%	0.709	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-59.6	117.2	176.1	-174.3	179.8	-179.4	-176.7	0.1	109.8	I154	R152-I154 HydrophobicContact CG-CG1 4.28Å
153	K	87.6	Confident	73.9	Confident	118 Å²	118	93.9 Å²	93.9	51%	0.513	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-83.8	117.2	177.2	-67	177.1	-174.8	174.5	0	109.2	L151 T167 Y169	L151-K153 PolarHBondContact O-N 2.89Å; L151-K153 VanDerWaalsContact O-N 3.09Å; K153-T167 HydrophobicContact CB-CG2 3.71Å; K153-T167 HydrophobicContact CD-CG2 4.33Å; K153-T167 HydrophobicContact CG-CG2 3.8Å; K153-Y169 HydrophobicContact CG-CE1 3.71Å
154	I	83.7	Confident	72.4	Confident	34 Å²	34	100.4 Å²	100.4	17%	0.174	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	127.7	176	-60	168.8	0	0	0	106.9	F131 R152 R156 V168	F131-I154 HydrophobicContact CD1-CD1 4.1Å; F131-I154 HydrophobicContact CE1-CD1 3.45Å; F131-I154 VanDerWaalsContact CE1-CD1 3.45Å; F131-I154 HydrophobicContact CE1-CG2 4.44Å; F131-I154 HydrophobicContact CZ-CD1 4.37Å; R152-I154 HydrophobicContact CG-CG1 4.28Å; I154-R156 HydrophobicContact CG2-CG 4.31Å; I154-V168 HydrophobicContact CB-CG2 3.99Å; I154-V168 HydrophobicContact CG2-CG2 4.16Å; I154-V168 PolarHBondContact N-O 2.81Å; I154-V168 VanDerWaalsContact O-CG2 3.3Å; I154-V168 WeakPolarHBondContact O-CG2 3.35Å; I154-V168 PolarHBondContact O-N 2.73Å
155	R	80.7	Confident	71.1	Confident	194 Å²	194	96.2 Å²	96.2	73%	0.732	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	119.9	176.9	-72.9	-175	176.8	-151.5	3.8	108.4
156	R	69.9	Low	70.3	Confident	46 Å²	46	95.5 Å²	95.5	17%	0.174	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	157.4	174.5	-73.3	-70	179.9	178.8	-20.9	110.1	I154 S165 F166 V168 E537 D541	I154-R156 HydrophobicContact CG2-CG 4.31Å; R156-S165 CarbonylContact O-C 3.5Å; R156-S165 WeakPolarHBondContact O-CA 3.5Å; R156-F166 HydrophobicContact CB-CE1 4.43Å; R156-F166 PolarHBondContact N-O 2.95Å; R156-F166 WeakPolarHBondContact O-CD1 3.3Å; R156-F166 PolarHBondContact O-N 3.04Å; R156-V168 HydrophobicContact CB-CG1 4.22Å; R156-V168 HydrophobicContact CB-CG2 3.89Å; R156-V168 HydrophobicContact CG-CG1 4.46Å; R156-V168 HydrophobicContact CG-CG2 3.34Å; R156-E537 IonicContact CZ-OE1 3.59Å; R156-E537 IonicContact NH1-OE1 2.74Å; R156-E537 IonicContact NH2-OE1 2.7Å; R156-E537 PolarHBondContact NH2-OE1 3.23Å; R156-E537 IonicContact NH2-OE2 2.95Å; R156-D541 IonicContact CZ-OD2 3.96Å; R156-D541 IonicContact NH1-OD1 2.9Å; R156-D541 PolarHBondContact NH1-OD1 2.83Å; R156-D541 IonicContact NH1-OD2 3.43Å; R156-D541 PolarHBondContact NH1-OD2 3.23Å
157	R	64.6	Low	70	Confident	107 Å²	107	95 Å²	95	40%	0.404	45%	0.454	S	S	.	.			trans	-71.9	128.2	-179	-176.5	-167.7	-178.9	161.8	7.5	111.5	F166 G544 A545 D548	R157-F166 WeakPolarHBondContact O-CE1 3.44Å; R157-G544 PolarHBondContact NH1-O 3.03Å; R157-A545 VanDerWaalsContact NH1-CA 3.3Å; R157-D548 IonicContact CZ-OD1 3.2Å; R157-D548 IonicContact CZ-OD2 2.81Å; R157-D548 IonicContact NE-OD2 2.97Å; R157-D548 VanDerWaalsContact NH1-CG 3.32Å; R157-D548 IonicContact NH1-OD2 3.01Å; R157-D548 PolarHBondContact NH1-OD2 2.99Å; R157-D548 IonicContact NH2-OD1 2.93Å; R157-D548 PolarHBondContact NH2-OD1 3Å; R157-D548 IonicContact NH2-OD2 2.82Å; R157-D548 PolarHBondContact NH2-OD2 2.66Å
158	S	56.2	Low	70	Confident	21 Å²	21	94 Å²	94	15%	0.147	45%	0.448	C	S	.	.			trans	-69	130.7	174.5	-174.8	0	0	0	0	112	H160 E161 F166	S158-H160 PolarHBondContact O-N 3.23Å; S158-H160 PolarHBondContact OG-N 3.06Å; S158-E161 PolarHBondContact OG-N 3.27Å; S158-F166 VanDerWaalsContact CA-CE1 3.49Å
159	P	48.5	Very low	70	Confident	103 Å²	103	94.7 Å²	94.7	67%	0.669	45%	0.451	S	S	*	.	S	Bend	trans	-68.5	-6.4	169.5	-19.7	32.4	0	0	0	114.2
160	H	43.6	Very low	70.1	Confident	170 Å²	170	89.9 Å²	89.9	79%	0.787	43%	0.429	S	S	*	.	S	Bend	trans	-128.2	-11.4	-166.8	-63	-27.8	0	0	0	114.9	S158	S158-H160 PolarHBondContact O-N 3.23Å; S158-H160 PolarHBondContact OG-N 3.06Å
161	E	46.5	Very low	70.1	Confident	125 Å²	125	85.2 Å²	85.2	58%	0.584	41%	0.405	S	S	*	.			trans	-140.4	131.5	-179.8	-76.9	179.3	165	0	0	111.7	S158 T163	S158-E161 PolarHBondContact OG-N 3.27Å; E161-T163 VanDerWaalsContact C-N 3.29Å; E161-T163 PolarHBondContact O-N 3.38Å
162	D	48.8	Very low	69.9	Low	112 Å²	112	85.6 Å²	85.6	60%	0.599	41%	0.41	S	S	*	.	S	Bend	trans	-78.8	-2.3	-173	-89.2	-24.2	0	0	0	115	K552	D162-K552 WeakPolarHBondContact OD1-CE 3.37Å; D162-K552 IonicContact OD1-NZ 3.26Å; D162-K552 PolarHBondContact OD1-NZ 3.27Å; D162-K552 WeakPolarHBondContact OD2-CE 3.48Å; D162-K552 IonicContact OD2-NZ 3.2Å; D162-K552 PolarHBondContact OD2-NZ 3.42Å
163	T	44.8	Very low	70.1	Confident	128 Å²	128	79.4 Å²	79.4	79%	0.785	39%	0.391	S	S	*	.	S	Bend	trans	-129.8	-13.1	-167.2	47.3	0	0	0	0	116.2	E161	E161-T163 VanDerWaalsContact C-N 3.29Å; E161-T163 PolarHBondContact O-N 3.38Å
164	E	55.8	Low	70.1	Confident	138 Å²	138	73.8 Å²	73.8	65%	0.645	37%	0.367	S	S	*	.			trans	-128.5	114.6	-179.3	-65.5	-170.1	-174.3	0	0	112.3	F166	E164-F166 PolarHBondContact O-N 3.33Å
165	S	62.1	Low	70.3	Confident	56 Å²	56	74.5 Å²	74.5	39%	0.392	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-60.1	120.7	164.1	61	0	0	0	0	108.5	R156	R156-S165 CarbonylContact O-C 3.5Å; R156-S165 WeakPolarHBondContact O-CA 3.5Å
166	F	72.8	Confident	70.6	Confident	65 Å²	65	68.1 Å²	68.1	29%	0.285	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	151	177.2	74.2	-79.4	0	0	0	110.4	T133 R156 R157 S158 E164 V168	T133-F166 HydrophobicContact CG2-CD2 3.97Å; T133-F166 HydrophobicContact CG2-CE2 3.39Å; T133-F166 HydrophobicContact CG2-CZ 4.32Å; R156-F166 HydrophobicContact CB-CE1 4.43Å; R156-F166 PolarHBondContact N-O 2.95Å; R156-F166 WeakPolarHBondContact O-CD1 3.3Å; R156-F166 PolarHBondContact O-N 3.04Å; R157-F166 WeakPolarHBondContact O-CE1 3.44Å; S158-F166 VanDerWaalsContact CA-CE1 3.49Å; E164-F166 PolarHBondContact O-N 3.33Å; F166-V168 HydrophobicContact CD2-CG1 3.66Å; F166-V168 HydrophobicContact CE2-CG1 3.07Å; F166-V168 HydrophobicContact CZ-CG1 3.68Å
167	T	83.9	Confident	71.7	Confident	51 Å²	51	66.8 Å²	66.8	31%	0.313	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	122.9	-179.9	-57	0	0	0	0	109.9	K153 Y169	K153-T167 HydrophobicContact CB-CG2 3.71Å; K153-T167 HydrophobicContact CD-CG2 4.33Å; K153-T167 HydrophobicContact CG-CG2 3.8Å; T167-Y169 HydrophobicContact CG2-CE1 4.3Å; T167-Y169 HydrophobicContact CG2-CE2 4.16Å
168	V	86.2	Confident	72.8	Confident	4 Å²	4	61.8 Å²	61.8	2%	0.024	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	160.8	169.5	-62.5	0	0	0	0	110.8	F131 I132 I154 R156 F166	F131-V168 HydrophobicContact CB-CB 3.97Å; F131-V168 HydrophobicContact CB-CG1 4.43Å; F131-V168 HydrophobicContact CB-CG2 3.82Å; F131-V168 HydrophobicContact CD1-CG2 3.99Å; F131-V168 HydrophobicContact CG-CG2 3.99Å; I132-V168 WeakPolarHBondContact O-CA 3.14Å; I154-V168 HydrophobicContact CB-CG2 3.99Å; I154-V168 HydrophobicContact CG2-CG2 4.16Å; I154-V168 PolarHBondContact N-O 2.81Å; I154-V168 VanDerWaalsContact O-CG2 3.3Å; I154-V168 WeakPolarHBondContact O-CG2 3.35Å; I154-V168 PolarHBondContact O-N 2.73Å; R156-V168 HydrophobicContact CB-CG1 4.22Å; R156-V168 HydrophobicContact CB-CG2 3.89Å; R156-V168 HydrophobicContact CG-CG1 4.46Å; R156-V168 HydrophobicContact CG-CG2 3.34Å; F166-V168 HydrophobicContact CD2-CG1 3.66Å; F166-V168 HydrophobicContact CE2-CG1 3.07Å; F166-V168 HydrophobicContact CZ-CG1 3.68Å
169	Y	89.1	Confident	74.4	Confident	22 Å²	22	64.6 Å²	64.6	9%	0.086	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	150.4	177.1	-55.8	-85.5	0	0	0	108.7	F131 I132 L148 L151 K153 T167 R171 V174	F131-Y169 WeakPolarHBondContact CA-O 3.44Å; I132-Y169 PolarHBondContact N-O 3.39Å; I132-Y169 PolarHBondContact O-N 2.95Å; L148-Y169 HydrophobicContact CB-CE1 4.22Å; L148-Y169 HydrophobicContact CB-CE2 4.27Å; L148-Y169 HydrophobicContact CD1-CE2 4.06Å; L148-Y169 VanDerWaalsContact O-CE1 3.25Å; L148-Y169 WeakPolarHBondContact O-CE1 3.38Å; L151-Y169 HydrophobicContact CB-CD1 3.59Å; L151-Y169 HydrophobicContact CB-CE1 4.05Å; L151-Y169 HydrophobicContact CD1-CD1 4.39Å; K153-Y169 HydrophobicContact CG-CE1 3.71Å; T167-Y169 HydrophobicContact CG2-CE1 4.3Å; T167-Y169 HydrophobicContact CG2-CE2 4.16Å; Y169-R171 PolarHBondContact O-N 3.22Å; Y169-V174 HydrophobicContact CG-CG2 4.48Å
170	L	87.8	Confident	76.4	Confident	36 Å²	36	66.1 Å²	66.1	19%	0.188	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	128.1	173.6	-164.2	66.3	0	0	0	108.8	Q128 F131 S172 D173 V174	Q128-L170 VanDerWaalsContact O-CD1 3.3Å; Q128-L170 WeakPolarHBondContact O-CD1 3.43Å; F131-L170 HydrophobicContact CD1-CD1 4.1Å; F131-L170 HydrophobicContact CE1-CD1 3.7Å; F131-L170 HydrophobicContact CZ-CD1 4.4Å; L170-S172 VanDerWaalsContact C-N 3.25Å; L170-S172 WeakPolarHBondContact CD2-OG 3.31Å; L170-S172 VanDerWaalsContact CG-OG 3.28Å; L170-S172 WeakPolarHBondContact CG-OG 3.5Å; L170-S172 PolarHBondContact O-N 2.89Å; L170-D173 HydrophobicContact CB-CB 4.22Å; L170-D173 PolarHBondContact O-N 3.48Å; L170-D173 VanDerWaalsContact O-N 3.08Å; L170-V174 WeakPolarHBondContact O-CG2 3.39Å; L170-V174 PolarHBondContact O-N 3.46Å
171	R	84.7	Confident	78.6	Confident	47 Å²	47	61 Å²	61	18%	0.177	33%	0.327	C	S	.	.	H	α-helix	trans	-62.3	-34.7	-175.4	-178.4	175.4	176.4	104	4.4	111.7	T127 N130 I132 E140 F141 Y169 D173 V174 E175	T127-R171 HydrophobicContact CG2-CG 4.46Å; N130-R171 HydrophobicContact CB-CB 4.29Å; N130-R171 WeakPolarHBondContact O-CB 3.48Å; N130-R171 PolarHBondContact O-N 3.43Å; I132-R171 HydrophobicContact CG2-CB 4.42Å; E140-R171 IonicContact OE2-CZ 3.71Å; E140-R171 IonicContact OE2-NH1 2.76Å; E140-R171 PolarHBondContact OE2-NH1 3.09Å; E140-R171 IonicContact OE2-NH2 3.83Å; F141-R171 HydrophobicContact CZ-CG 4.35Å; Y169-R171 PolarHBondContact O-N 3.22Å; R171-D173 VanDerWaalsContact C-N 3.32Å; R171-D173 PolarHBondContact O-N 3.12Å; R171-V174 PolarHBondContact O-N 3.09Å; R171-E175 HydrophobicContact CG-CG 4.45Å; R171-E175 IonicContact CZ-OE1 2.64Å; R171-E175 IonicContact NE-OE1 3.43Å; R171-E175 PolarHBondContact NE-OE1 3.43Å; R171-E175 IonicContact NH2-OE1 2.61Å; R171-E175 PolarHBondContact NH2-OE1 3.01Å; R171-E175 WeakPolarHBondContact O-CB 3.5Å; R171-E175 WeakPolarHBondContact O-CG 3.27Å; R171-E175 PolarHBondContact O-N 3.01Å
172	S	85.5	Confident	80.6	Confident	33 Å²	33	58.5 Å²	58.5	23%	0.231	31%	0.312	C	S	.	.	H	α-helix	trans	-60.6	-41	173.8	55.4	0	0	0	0	112.5	L170 E175 A176	L170-S172 VanDerWaalsContact C-N 3.25Å; L170-S172 WeakPolarHBondContact CD2-OG 3.31Å; L170-S172 VanDerWaalsContact CG-OG 3.28Å; L170-S172 WeakPolarHBondContact CG-OG 3.5Å; L170-S172 PolarHBondContact O-N 2.89Å; S172-E175 PolarHBondContact O-N 3.43Å; S172-A176 WeakPolarHBondContact O-CB 3.29Å; S172-A176 PolarHBondContact O-N 3.04Å
173	D	89.3	Confident	82.4	Confident	58 Å²	58	56.3 Å²	56.3	31%	0.31	32%	0.316	S	S	.	.	H	α-helix	trans	-71	-37.9	-179.1	-60.7	-5.3	0	0	0	110.6	L151 L170 R171 A176 K177	L151-D173 HydrophobicContact CD2-CB 4.09Å; L170-D173 HydrophobicContact CB-CB 4.22Å; L170-D173 PolarHBondContact O-N 3.48Å; L170-D173 VanDerWaalsContact O-N 3.08Å; R171-D173 VanDerWaalsContact C-N 3.32Å; R171-D173 PolarHBondContact O-N 3.12Å; D173-A176 PolarHBondContact O-N 3.43Å; D173-K177 WeakPolarHBondContact O-CB 3.44Å; D173-K177 PolarHBondContact O-N 3.2Å
174	V	88.3	Confident	84.5	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.7	-41.2	172.5	174.6	0	0	0	0	111.2	I132 A137 F141 L143 L151 Y169 L170 R171 K177 S178	I132-V174 HydrophobicContact CG2-CB 4.23Å; I132-V174 HydrophobicContact CG2-CG1 4.4Å; I132-V174 HydrophobicContact CG2-CG2 3.74Å; A137-V174 HydrophobicContact CB-CG1 3.76Å; A137-V174 HydrophobicContact CB-CG2 4.15Å; F141-V174 HydrophobicContact CB-CG1 4.12Å; F141-V174 HydrophobicContact CD2-CG1 3.42Å; F141-V174 VanDerWaalsContact CD2-CG1 3.42Å; F141-V174 HydrophobicContact CE2-CG1 3.88Å; F141-V174 HydrophobicContact CG-CG1 3.78Å; L143-V174 HydrophobicContact CD1-CG1 3.76Å; L151-V174 HydrophobicContact CD1-CB 4.47Å; L151-V174 HydrophobicContact CD1-CG2 3.7Å; Y169-V174 HydrophobicContact CG-CG2 4.48Å; L170-V174 WeakPolarHBondContact O-CG2 3.39Å; L170-V174 PolarHBondContact O-N 3.46Å; R171-V174 PolarHBondContact O-N 3.09Å; V174-K177 PolarHBondContact O-N 3.03Å; V174-S178 WeakPolarHBondContact O-CB 3.39Å; V174-S178 PolarHBondContact O-N 3.15Å
175	E	87.3	Confident	86	Confident	48 Å²	48	49.8 Å²	49.8	22%	0.224	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-48.2	175.2	-83.3	169.6	-173.9	0	0	110.8	T127 F141 R171 S172 K177 S178 L179	T127-E175 PolarHBondContact OG1-OE2 3.01Å; F141-E175 HydrophobicContact CD1-CG 4.25Å; F141-E175 HydrophobicContact CE1-CB 4.41Å; F141-E175 HydrophobicContact CE1-CG 3.3Å; F141-E175 HydrophobicContact CZ-CG 3.49Å; F141-E175 VanDerWaalsContact CZ-CG 3.49Å; R171-E175 HydrophobicContact CG-CG 4.45Å; R171-E175 IonicContact CZ-OE1 2.64Å; R171-E175 IonicContact NE-OE1 3.43Å; R171-E175 PolarHBondContact NE-OE1 3.43Å; R171-E175 IonicContact NH2-OE1 2.61Å; R171-E175 PolarHBondContact NH2-OE1 3.01Å; R171-E175 WeakPolarHBondContact O-CB 3.5Å; R171-E175 WeakPolarHBondContact O-CG 3.27Å; R171-E175 PolarHBondContact O-N 3.01Å; S172-E175 PolarHBondContact O-N 3.43Å; E175-K177 PolarHBondContact O-N 3.29Å; E175-S178 PolarHBondContact O-N 3.01Å; E175-S178 PolarHBondContact O-OG 2.9Å; E175-L179 WeakPolarHBondContact O-CG 3.48Å; E175-L179 PolarHBondContact O-N 2.57Å
176	A	88.1	Confident	87.2	Confident	60 Å²	60	53.8 Å²	53.8	50%	0.496	30%	0.301	S	S	.	.	H	α-helix	trans	-59.5	-46.3	175.7	0	0	0	0	0	111.8	S172 D173 S178 L179 E180	S172-A176 WeakPolarHBondContact O-CB 3.29Å; S172-A176 PolarHBondContact O-N 3.04Å; D173-A176 PolarHBondContact O-N 3.43Å; A176-S178 VanDerWaalsContact C-N 3.31Å; A176-S178 PolarHBondContact O-N 2.95Å; A176-L179 PolarHBondContact O-N 2.91Å; A176-E180 PolarHBondContact O-N 3.42Å
177	K	91.3	Very high	87.8	Confident	18 Å²	18	51.6 Å²	51.6	8%	0.078	30%	0.295	C	S	.	.	H	α-helix	trans	-64.3	-36.1	177.4	-168.9	53.5	164.9	-176	0	112.4	L143 D147 L151 D173 V174 E175 L179 E180 V181	L143-K177 HydrophobicContact CD2-CG 4.39Å; D147-K177 HydrophobicContact CB-CG 4.44Å; L151-K177 HydrophobicContact CD1-CB 4.37Å; L151-K177 HydrophobicContact CD2-CB 4.11Å; L151-K177 HydrophobicContact CD2-CG 4.39Å; D173-K177 WeakPolarHBondContact O-CB 3.44Å; D173-K177 PolarHBondContact O-N 3.2Å; V174-K177 PolarHBondContact O-N 3.03Å; E175-K177 PolarHBondContact O-N 3.29Å; K177-L179 VanDerWaalsContact C-N 3.32Å; K177-L179 PolarHBondContact O-N 2.97Å; K177-E180 HydrophobicContact CD-CB 4.4Å; K177-E180 WeakPolarHBondContact CD-OE2 3.4Å; K177-E180 IonicContact NZ-OE1 3.55Å; K177-E180 PolarHBondContact NZ-OE1 2.8Å; K177-E180 IonicContact NZ-OE2 3.29Å; K177-E180 PolarHBondContact NZ-OE2 2.76Å; K177-E180 WeakPolarHBondContact O-CB 3.18Å; K177-E180 PolarHBondContact O-N 3.33Å; K177-V181 WeakPolarHBondContact O-CG2 3.39Å; K177-V181 PolarHBondContact O-N 3.03Å
178	S	88.8	Confident	88	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-65.4	-36.5	175.3	79.4	0	0	0	0	112.5	V174 E175 A176 V181 W182	V174-S178 WeakPolarHBondContact O-CB 3.39Å; V174-S178 PolarHBondContact O-N 3.15Å; E175-S178 PolarHBondContact O-N 3.01Å; E175-S178 PolarHBondContact O-OG 2.9Å; A176-S178 VanDerWaalsContact C-N 3.31Å; A176-S178 PolarHBondContact O-N 2.95Å; S178-V181 PolarHBondContact O-N 3.45Å; S178-W182 WeakPolarHBondContact O-CB 3.47Å; S178-W182 VanDerWaalsContact O-CD1 3.23Å; S178-W182 PolarHBondContact O-N 3.36Å
179	L	89.5	Confident	87.8	Confident	80 Å²	80	52.1 Å²	52.1	42%	0.419	30%	0.303	S	S	.	.	H	α-helix	trans	-70.7	-35.1	174.4	-69.4	170.8	0	0	0	111.6	E175 A176 K177 G183 P185	E175-L179 WeakPolarHBondContact O-CG 3.48Å; E175-L179 PolarHBondContact O-N 2.57Å; A176-L179 PolarHBondContact O-N 2.91Å; K177-L179 VanDerWaalsContact C-N 3.32Å; K177-L179 PolarHBondContact O-N 2.97Å; L179-G183 WeakPolarHBondContact O-CA 3.4Å; L179-G183 PolarHBondContact O-N 2.94Å; L179-P185 HydrophobicContact CD2-CB 4.44Å
180	E	90.4	Very high	87.8	Confident	134 Å²	134	59.2 Å²	59.2	63%	0.626	33%	0.33	S	S	*	.	H	α-helix	trans	-61.9	-44.4	172.7	-167.4	-165.5	142.7	0	0	111.5	A176 K177	A176-E180 PolarHBondContact O-N 3.42Å; K177-E180 HydrophobicContact CD-CB 4.4Å; K177-E180 WeakPolarHBondContact CD-OE2 3.4Å; K177-E180 IonicContact NZ-OE1 3.55Å; K177-E180 PolarHBondContact NZ-OE1 2.8Å; K177-E180 IonicContact NZ-OE2 3.29Å; K177-E180 PolarHBondContact NZ-OE2 2.76Å; K177-E180 WeakPolarHBondContact O-CB 3.18Å; K177-E180 PolarHBondContact O-N 3.33Å
181	V	89.8	Confident	87.7	Confident	64 Å²	64	59.7 Å²	59.7	39%	0.388	33%	0.331	S	S	.	.	H	α-helix	trans	-73.3	-43.2	-178	173	0	0	0	0	112.4	L143 K177 S178	L143-V181 HydrophobicContact CD2-CB 4.2Å; L143-V181 HydrophobicContact CD2-CG2 3.88Å; K177-V181 WeakPolarHBondContact O-CG2 3.39Å; K177-V181 PolarHBondContact O-N 3.03Å; S178-V181 PolarHBondContact O-N 3.45Å
182	W	89.4	Confident	87.5	Confident	72 Å²	72	61.2 Å²	61.2	27%	0.273	34%	0.339	S	S	.	.	H	α-helix	trans	-99.8	-9.6	-172.6	-63.4	102.8	0	0	0	113.9	F141 C142 S178 S184 A187 L188 E191	F141-W182 PolarHBondContact O-NE1 3.39Å; C142-W182 HydrophobicContact CB-CZ2 3.75Å; C142-W182 WeakPolarHBondContact O-CZ2 3.2Å; S178-W182 WeakPolarHBondContact O-CB 3.47Å; S178-W182 VanDerWaalsContact O-CD1 3.23Å; S178-W182 PolarHBondContact O-N 3.36Å; W182-S184 PolarHBondContact O-N 3.42Å; W182-A187 HydrophobicContact CB-CB 4.45Å; W182-A187 VanDerWaalsContact O-CB 3.24Å; W182-A187 WeakPolarHBondContact O-CB 3.31Å; W182-L188 HydrophobicContact CB-CB 4.25Å; W182-L188 HydrophobicContact CG-CB 4.38Å; W182-L188 HydrophobicContact CG-CD1 4.31Å; W182-E191 HydrophobicContact CE3-CB 4.4Å; W182-E191 HydrophobicContact CH2-CB 4.13Å; W182-E191 HydrophobicContact CH2-CG 3.47Å; W182-E191 VanDerWaalsContact CH2-CG 3.47Å; W182-E191 HydrophobicContact CZ2-CB 4.49Å; W182-E191 HydrophobicContact CZ2-CG 3.76Å; W182-E191 HydrophobicContact CZ3-CB 4.07Å; W182-E191 HydrophobicContact CZ3-CG 3.92Å
183	G	86.8	Confident	87.5	Confident	65 Å²	65	65.9 Å²	65.9	67%	0.67	36%	0.355	S	S	*	.	S	Bend	trans	74.9	-36.4	176.6	0	0	0	0	0	115.4	L179	L179-G183 WeakPolarHBondContact O-CA 3.4Å; L179-G183 PolarHBondContact O-N 2.94Å
184	S	88.9	Confident	87.5	Confident	37 Å²	37	68 Å²	68	26%	0.259	37%	0.366	S	S	.	.	S	Bend	trans	-144.2	152.8	179.1	82.5	0	0	0	0	113.1	W182 E186 A187 L188	W182-S184 PolarHBondContact O-N 3.42Å; S184-E186 PolarHBondContact O-N 3.14Å; S184-A187 PolarHBondContact O-N 3.24Å; S184-A187 WeakPolarHBondContact OG-CB 3.44Å; S184-A187 PolarHBondContact OG-N 3.48Å; S184-A187 VanDerWaalsContact OG-N 3.12Å; S184-L188 PolarHBondContact O-N 3.44Å
185	P	85.6	Confident	87.2	Confident	92 Å²	92	72.5 Å²	72.5	60%	0.597	38%	0.383	S	S	*	.	H	α-helix	trans	-62.7	-28	176.4	24.6	-33.6	0	0	0	112.5	L179 A189	L179-P185 HydrophobicContact CD2-CB 4.44Å; P185-A189 WeakPolarHBondContact O-CB 3.49Å; P185-A189 PolarHBondContact O-N 2.98Å
186	E	87.8	Confident	86.8	Confident	141 Å²	141	76.6 Å²	76.6	66%	0.659	40%	0.4	S	S	*	.	H	α-helix	trans	-71.5	-38.8	176.5	-62.9	176.7	177.6	0	0	112.2	S184 A189 R190	S184-E186 PolarHBondContact O-N 3.14Å; E186-A189 PolarHBondContact O-N 3.4Å; E186-R190 WeakPolarHBondContact O-CG 3.3Å; E186-R190 PolarHBondContact O-N 2.87Å
187	A	86.6	Confident	86.8	Confident	18 Å²	18	78.3 Å²	78.3	15%	0.149	40%	0.398	C	S	.	.	H	α-helix	trans	-63.5	-44.3	174.6	0	0	0	0	0	111.2	W182 S184 A189 R190 E191	W182-A187 HydrophobicContact CB-CB 4.45Å; W182-A187 VanDerWaalsContact O-CB 3.24Å; W182-A187 WeakPolarHBondContact O-CB 3.31Å; S184-A187 PolarHBondContact O-N 3.24Å; S184-A187 WeakPolarHBondContact OG-CB 3.44Å; S184-A187 PolarHBondContact OG-N 3.48Å; S184-A187 VanDerWaalsContact OG-N 3.12Å; A187-A189 VanDerWaalsContact C-N 3.33Å; A187-A189 PolarHBondContact O-N 2.88Å; A187-R190 PolarHBondContact O-N 2.82Å; A187-E191 PolarHBondContact O-N 3.45Å
188	L	86.4	Confident	86.5	Confident	13 Å²	13	80.1 Å²	80.1	7%	0.068	42%	0.416	C	S	.	.	H	α-helix	trans	-60.5	-41.4	172.9	176.8	62.4	0	0	0	111.9	F141 C142 W182 S184 E191 K192	F141-L188 HydrophobicContact CD1-CD2 4.24Å; F141-L188 VanDerWaalsContact O-CD1 3.3Å; F141-L188 WeakPolarHBondContact O-CD1 3.46Å; C142-L188 HydrophobicContact CB-CD1 4.04Å; W182-L188 HydrophobicContact CB-CB 4.25Å; W182-L188 HydrophobicContact CG-CB 4.38Å; W182-L188 HydrophobicContact CG-CD1 4.31Å; S184-L188 PolarHBondContact O-N 3.44Å; L188-E191 PolarHBondContact O-N 2.93Å; L188-K192 HydrophobicContact CD1-CG 4.44Å; L188-K192 HydrophobicContact CG-CD 4.34Å; L188-K192 WeakPolarHBondContact O-CB 3.47Å; L188-K192 VanDerWaalsContact O-CG 3.29Å; L188-K192 WeakPolarHBondContact O-CG 3.45Å; L188-K192 PolarHBondContact O-N 2.94Å
189	A	83.3	Confident	86	Confident	54 Å²	54	86.2 Å²	86.2	45%	0.446	44%	0.444	S	S	.	.	H	α-helix	trans	-64.9	-38.3	177.7	0	0	0	0	0	112.7	P185 E186 A187 K192 K193	P185-A189 WeakPolarHBondContact O-CB 3.49Å; P185-A189 PolarHBondContact O-N 2.98Å; E186-A189 PolarHBondContact O-N 3.4Å; A187-A189 VanDerWaalsContact C-N 3.33Å; A187-A189 PolarHBondContact O-N 2.88Å; A189-K192 PolarHBondContact O-N 2.76Å; A189-K193 PolarHBondContact O-N 3.07Å
190	R	87.8	Confident	85.5	Confident	170 Å²	170	86.7 Å²	86.7	64%	0.642	45%	0.446	S	S	*	.	H	α-helix	trans	-62.9	-47.1	173.8	-74	-173.8	-67.3	-160.4	-0.1	111.6	E186 A187 K192 K193 L194	E186-R190 WeakPolarHBondContact O-CG 3.3Å; E186-R190 PolarHBondContact O-N 2.87Å; A187-R190 PolarHBondContact O-N 2.82Å; R190-K192 PolarHBondContact O-N 2.93Å; R190-K193 WeakPolarHBondContact O-CB 3.4Å; R190-K193 PolarHBondContact O-N 2.66Å; R190-L194 PolarHBondContact O-N 2.82Å
191	E	85.8	Confident	85.4	Confident	47 Å²	47	85.5 Å²	85.5	22%	0.22	44%	0.44	C	S	.	.	H	α-helix	trans	-61.9	-43.3	177.3	-179.5	65.3	-168.1	0	0	111.7	C142 W182 A187 L188 K193 L194 R195	C142-E191 HydrophobicContact CB-CG 3.85Å; W182-E191 HydrophobicContact CE3-CB 4.4Å; W182-E191 HydrophobicContact CH2-CB 4.13Å; W182-E191 HydrophobicContact CH2-CG 3.47Å; W182-E191 VanDerWaalsContact CH2-CG 3.47Å; W182-E191 HydrophobicContact CZ2-CB 4.49Å; W182-E191 HydrophobicContact CZ2-CG 3.76Å; W182-E191 HydrophobicContact CZ3-CB 4.07Å; W182-E191 HydrophobicContact CZ3-CG 3.92Å; A187-E191 PolarHBondContact O-N 3.45Å; L188-E191 PolarHBondContact O-N 2.93Å; E191-K193 VanDerWaalsContact C-N 3.29Å; E191-K193 PolarHBondContact O-N 3.01Å; E191-L194 PolarHBondContact O-N 2.93Å; E191-R195 PolarHBondContact O-N 2.88Å; E191-R195 IonicContact OE1-CZ 3Å; E191-R195 IonicContact OE1-NE 3.76Å; E191-R195 PolarHBondContact OE1-NE 2.78Å; E191-R195 IonicContact OE1-NH2 3.22Å
192	K	82	Confident	84.9	Confident	78 Å²	78	89.9 Å²	89.9	34%	0.339	45%	0.451	S	S	.	.	H	α-helix	trans	-58	-42.2	174.7	-77.1	176.6	-176.7	-169.2	0	112.3	E140 L188 A189 R190 K196	E140-K192 WeakPolarHBondContact O-CE 3.23Å; E140-K192 PolarHBondContact O-NZ 2.91Å; L188-K192 HydrophobicContact CD1-CG 4.44Å; L188-K192 HydrophobicContact CG-CD 4.34Å; L188-K192 WeakPolarHBondContact O-CB 3.47Å; L188-K192 VanDerWaalsContact O-CG 3.29Å; L188-K192 WeakPolarHBondContact O-CG 3.45Å; L188-K192 PolarHBondContact O-N 2.94Å; A189-K192 PolarHBondContact O-N 2.76Å; R190-K192 PolarHBondContact O-N 2.93Å; K192-K196 VanDerWaalsContact O-CB 3.25Å; K192-K196 WeakPolarHBondContact O-CB 3.46Å; K192-K196 PolarHBondContact O-N 2.86Å
193	K	85.5	Confident	84.4	Confident	132 Å²	132	94 Å²	94	57%	0.574	47%	0.467	S	S	*	.	H	α-helix	trans	-62.9	-46.5	178.2	-172.3	-180	175.1	-173.5	0	110.7	A189 R190 E191 K196 E197	A189-K193 PolarHBondContact O-N 3.07Å; R190-K193 WeakPolarHBondContact O-CB 3.4Å; R190-K193 PolarHBondContact O-N 2.66Å; E191-K193 VanDerWaalsContact C-N 3.29Å; E191-K193 PolarHBondContact O-N 3.01Å; K193-K196 PolarHBondContact O-N 3.26Å; K193-E197 WeakPolarHBondContact CE-OE1 3.31Å; K193-E197 WeakPolarHBondContact O-CG 3.45Å; K193-E197 PolarHBondContact O-N 2.74Å
194	L	87.8	Confident	84.2	Confident	103 Å²	103	95.4 Å²	95.4	54%	0.539	46%	0.456	S	S	.	.	H	α-helix	trans	-60.4	-47.7	177.1	-72.3	169.7	0	0	0	112.3	R190 E191 K196 E197 A198	R190-L194 PolarHBondContact O-N 2.82Å; E191-L194 PolarHBondContact O-N 2.93Å; L194-K196 VanDerWaalsContact C-N 3.31Å; L194-K196 PolarHBondContact O-N 3.47Å; L194-E197 PolarHBondContact O-N 3.35Å; L194-A198 WeakPolarHBondContact O-CB 3.43Å; L194-A198 PolarHBondContact O-N 3.42Å
195	R	82.5	Confident	84.1	Confident	93 Å²	93	100.7 Å²	100.7	35%	0.351	47%	0.47	S	S	.	.	H	α-helix	trans	-63	-38	177.2	-69.8	-166.9	-172.3	-175.1	6.1	112.4	C142 E191 A198 E199	C142-R195 PolarHBondContact O-NH2 3.02Å; C142-R195 VanDerWaalsContact O-NH2 3.11Å; E191-R195 PolarHBondContact O-N 2.88Å; E191-R195 IonicContact OE1-CZ 3Å; E191-R195 IonicContact OE1-NE 3.76Å; E191-R195 PolarHBondContact OE1-NE 2.78Å; E191-R195 IonicContact OE1-NH2 3.22Å; R195-A198 PolarHBondContact O-N 2.74Å; R195-E199 WeakPolarHBondContact O-CB 3.43Å; R195-E199 PolarHBondContact O-N 3.03Å
196	K	78.6	Confident	84.1	Confident	135 Å²	135	99.3 Å²	99.3	59%	0.587	46%	0.457	S	S	*	.	H	α-helix	trans	-67.8	-40.4	177.5	-170	175.9	-177	179.7	0	112.1	K192 K193 L194 E199 I200	K192-K196 VanDerWaalsContact O-CB 3.25Å; K192-K196 WeakPolarHBondContact O-CB 3.46Å; K192-K196 PolarHBondContact O-N 2.86Å; K193-K196 PolarHBondContact O-N 3.26Å; L194-K196 VanDerWaalsContact C-N 3.31Å; L194-K196 PolarHBondContact O-N 3.47Å; K196-E199 PolarHBondContact O-N 3.33Å; K196-I200 HydrophobicContact CG-CD1 4.28Å; K196-I200 WeakPolarHBondContact O-CD1 3.4Å; K196-I200 VanDerWaalsContact O-CG1 3.22Å; K196-I200 WeakPolarHBondContact O-CG1 3.42Å; K196-I200 PolarHBondContact O-N 3.35Å
197	E	88.2	Confident	83.9	Confident	95 Å²	95	98.1 Å²	98.1	44%	0.444	45%	0.45	S	S	.	.	H	α-helix	trans	-63.3	-44.6	173.5	-74.3	171.1	-178	0	0	111.1	K193 L194 E199 I200 E201	K193-E197 WeakPolarHBondContact CE-OE1 3.31Å; K193-E197 WeakPolarHBondContact O-CG 3.45Å; K193-E197 PolarHBondContact O-N 2.74Å; L194-E197 PolarHBondContact O-N 3.35Å; E197-E199 PolarHBondContact O-N 3.13Å; E197-I200 PolarHBondContact O-N 3.28Å; E197-E201 PolarHBondContact O-N 3.04Å
198	A	84.4	Confident	83.8	Confident	56 Å²	56	102.9 Å²	102.9	46%	0.463	46%	0.464	S	S	.	.	H	α-helix	trans	-63.6	-37.7	174.8	0	0	0	0	0	112.9	L194 R195 E201 Y202	L194-A198 WeakPolarHBondContact O-CB 3.43Å; L194-A198 PolarHBondContact O-N 3.42Å; R195-A198 PolarHBondContact O-N 2.74Å; A198-E201 PolarHBondContact O-N 2.8Å; A198-Y202 VanDerWaalsContact O-CB 3.29Å; A198-Y202 WeakPolarHBondContact O-CB 3.45Å; A198-Y202 PolarHBondContact O-N 2.87Å
199	E	79	Confident	83.4	Confident	132 Å²	132	106.6 Å²	106.6	62%	0.617	48%	0.484	S	S	*	.	H	α-helix	trans	-66.7	-42.1	175.4	-170.5	-176	177.5	0	0	111.5	R195 K196 E197 Y202 R203	R195-E199 WeakPolarHBondContact O-CB 3.43Å; R195-E199 PolarHBondContact O-N 3.03Å; K196-E199 PolarHBondContact O-N 3.33Å; E197-E199 PolarHBondContact O-N 3.13Å; E199-Y202 PolarHBondContact O-N 3Å; E199-R203 VanDerWaalsContact O-CB 3.24Å; E199-R203 WeakPolarHBondContact O-CB 3.36Å; E199-R203 PolarHBondContact O-N 3.03Å
200	I	79.4	Confident	83.2	Confident	90 Å²	90	108.6 Å²	108.6	46%	0.462	48%	0.484	S	S	.	.	H	α-helix	trans	-60.4	-47.8	173.9	-70.1	163.7	0	0	0	109.8	K196 E197 Y202 R203 E204	K196-I200 HydrophobicContact CG-CD1 4.28Å; K196-I200 WeakPolarHBondContact O-CD1 3.4Å; K196-I200 VanDerWaalsContact O-CG1 3.22Å; K196-I200 WeakPolarHBondContact O-CG1 3.42Å; K196-I200 PolarHBondContact O-N 3.35Å; E197-I200 PolarHBondContact O-N 3.28Å; I200-Y202 PolarHBondContact O-N 2.9Å; I200-R203 PolarHBondContact O-N 3.19Å; I200-E204 WeakPolarHBondContact O-CG 3.46Å; I200-E204 PolarHBondContact O-N 3.04Å
201	E	87.4	Confident	82.8	Confident	108 Å²	108	106.8 Å²	106.8	51%	0.505	48%	0.481	S	S	.	.	H	α-helix	trans	-62.3	-43.7	178.3	-168.3	-171	167.6	0	0	111.9	E197 A198 R203 E204 R205	E197-E201 PolarHBondContact O-N 3.04Å; A198-E201 PolarHBondContact O-N 2.8Å; E201-R203 PolarHBondContact O-N 2.93Å; E201-E204 PolarHBondContact O-N 3.32Å; E201-R205 WeakPolarHBondContact O-CB 3.49Å; E201-R205 PolarHBondContact O-N 2.79Å
202	Y	80.4	Confident	82.5	Confident	156 Å²	156	108.1 Å²	108.1	61%	0.612	49%	0.489	S	S	*	.	H	α-helix	trans	-60.5	-45.2	175	177.5	-99.7	0	0	0	111.2	A198 E199 I200 E204 R205 L206	A198-Y202 VanDerWaalsContact O-CB 3.29Å; A198-Y202 WeakPolarHBondContact O-CB 3.45Å; A198-Y202 PolarHBondContact O-N 2.87Å; E199-Y202 PolarHBondContact O-N 3Å; I200-Y202 PolarHBondContact O-N 2.9Å; Y202-E204 PolarHBondContact O-N 3.44Å; Y202-R205 CarbonylContact O-C 3.51Å; Y202-R205 WeakPolarHBondContact O-CB 3.19Å; Y202-R205 PolarHBondContact O-N 3.43Å; Y202-L206 HydrophobicContact CE1-CD1 3.68Å; Y202-L206 WeakPolarHBondContact O-CB 3.5Å; Y202-L206 PolarHBondContact O-N 2.86Å; Y202-L206 WeakPolarHBondContact OH-CD1 3.4Å
203	R	77.9	Confident	82.1	Confident	159 Å²	159	110 Å²	110	60%	0.6	50%	0.502	S	S	*	.	H	α-helix	trans	-63.9	-41.9	179.1	-162.6	-178.8	-175.1	-179.3	2.6	111.1	E199 I200 E201 L206 F207	E199-R203 VanDerWaalsContact O-CB 3.24Å; E199-R203 WeakPolarHBondContact O-CB 3.36Å; E199-R203 PolarHBondContact O-N 3.03Å; I200-R203 PolarHBondContact O-N 3.19Å; E201-R203 PolarHBondContact O-N 2.93Å; R203-L206 PolarHBondContact O-N 3.07Å; R203-F207 HydrophobicContact CG-CD2 4Å; R203-F207 HydrophobicContact CG-CE2 3.59Å; R203-F207 HydrophobicContact CG-CZ 4.46Å; R203-F207 WeakPolarHBondContact O-CD2 3.48Å; R203-F207 PolarHBondContact O-N 3Å
204	E	83.4	Confident	81.5	Confident	95 Å²	95	111 Å²	111	44%	0.444	50%	0.502	S	S	.	.	H	α-helix	trans	-61.9	-43.7	172	-75	-168.9	-177.8	0	0	112.4	I200 E201 Y202 L206 F207 R208	I200-E204 WeakPolarHBondContact O-CG 3.46Å; I200-E204 PolarHBondContact O-N 3.04Å; E201-E204 PolarHBondContact O-N 3.32Å; Y202-E204 PolarHBondContact O-N 3.44Å; E204-L206 VanDerWaalsContact C-N 3.29Å; E204-L206 PolarHBondContact O-N 2.64Å; E204-F207 PolarHBondContact O-N 2.75Å; E204-R208 WeakPolarHBondContact O-CB 3.42Å; E204-R208 WeakPolarHBondContact O-CG 3.41Å; E204-R208 PolarHBondContact O-N 3.2Å; E204-R208 IonicContact OE2-CZ 3.55Å; E204-R208 IonicContact OE2-NH1 2.67Å; E204-R208 PolarHBondContact OE2-NH1 3.06Å; E204-R208 IonicContact OE2-NH2 2.71Å; E204-R208 PolarHBondContact OE2-NH2 2.87Å
205	R	86.1	Confident	80.9	Confident	148 Å²	148	111 Å²	111	56%	0.558	50%	0.5	S	S	*	.	H	α-helix	trans	-59.6	-41.3	173.1	-98.7	-178.9	164.3	-172.7	-2.4	111.3	E201 Y202 R208 N209	E201-R205 WeakPolarHBondContact O-CB 3.49Å; E201-R205 PolarHBondContact O-N 2.79Å; Y202-R205 CarbonylContact O-C 3.51Å; Y202-R205 WeakPolarHBondContact O-CB 3.19Å; Y202-R205 PolarHBondContact O-N 3.43Å; R205-R208 PolarHBondContact O-N 3.44Å; R205-N209 VanDerWaalsContact O-CB 3.29Å; R205-N209 WeakPolarHBondContact O-CB 3.26Å; R205-N209 PolarHBondContact O-N 2.95Å
206	L	86.9	Confident	80.1	Confident	62 Å²	62	113.4 Å²	113.4	33%	0.325	51%	0.51	S	S	.	.	H	α-helix	trans	-66.7	-42.4	178.5	-157.9	120.8	0	0	0	111.2	Y202 R203 E204 N209 Q210	Y202-L206 HydrophobicContact CE1-CD1 3.68Å; Y202-L206 WeakPolarHBondContact O-CB 3.5Å; Y202-L206 PolarHBondContact O-N 2.86Å; Y202-L206 WeakPolarHBondContact OH-CD1 3.4Å; R203-L206 PolarHBondContact O-N 3.07Å; E204-L206 VanDerWaalsContact C-N 3.29Å; E204-L206 PolarHBondContact O-N 2.64Å; L206-N209 PolarHBondContact O-N 2.97Å; L206-Q210 WeakPolarHBondContact O-CB 3.27Å; L206-Q210 WeakPolarHBondContact O-CG 3.41Å; L206-Q210 PolarHBondContact O-N 3.21Å
207	F	82.4	Confident	79.5	Confident	116 Å²	116	114.9 Å²	114.9	51%	0.509	51%	0.512	S	S	.	.	H	α-helix	trans	-63.2	-42.9	172.7	-77.4	-59.3	0	0	0	112.1	R203 E204 Q210 K211	R203-F207 HydrophobicContact CG-CD2 4Å; R203-F207 HydrophobicContact CG-CE2 3.59Å; R203-F207 HydrophobicContact CG-CZ 4.46Å; R203-F207 WeakPolarHBondContact O-CD2 3.48Å; R203-F207 PolarHBondContact O-N 3Å; E204-F207 PolarHBondContact O-N 2.75Å; F207-Q210 PolarHBondContact O-N 3.27Å; F207-K211 WeakPolarHBondContact O-CB 3.38Å; F207-K211 PolarHBondContact O-N 2.94Å
208	R	83.7	Confident	78.2	Confident	119 Å²	119	115.5 Å²	115.5	45%	0.449	52%	0.518	S	S	.	.	H	α-helix	trans	-60.4	-46.7	173.4	-76.4	-172.5	-74.8	-100.1	3	110.8	E204 R205 K211 I212	E204-R208 WeakPolarHBondContact O-CB 3.42Å; E204-R208 WeakPolarHBondContact O-CG 3.41Å; E204-R208 PolarHBondContact O-N 3.2Å; E204-R208 IonicContact OE2-CZ 3.55Å; E204-R208 IonicContact OE2-NH1 2.67Å; E204-R208 PolarHBondContact OE2-NH1 3.06Å; E204-R208 IonicContact OE2-NH2 2.71Å; E204-R208 PolarHBondContact OE2-NH2 2.87Å; R205-R208 PolarHBondContact O-N 3.44Å; R208-K211 WeakPolarHBondContact O-CB 3.5Å; R208-K211 PolarHBondContact O-N 3.42Å; R208-I212 WeakPolarHBondContact O-CB 3.4Å; R208-I212 VanDerWaalsContact O-CG1 3.23Å; R208-I212 WeakPolarHBondContact O-CG1 3.49Å; R208-I212 PolarHBondContact O-N 2.75Å
209	N	79.3	Confident	77.2	Confident	91 Å²	91	121.4 Å²	121.4	49%	0.487	53%	0.533	S	S	.	.	H	α-helix	trans	-66.1	-39	178.2	-73.6	-11.4	0	0	0	112.3	R205 L206 K211 I212 L213	R205-N209 VanDerWaalsContact O-CB 3.29Å; R205-N209 WeakPolarHBondContact O-CB 3.26Å; R205-N209 PolarHBondContact O-N 2.95Å; L206-N209 PolarHBondContact O-N 2.97Å; N209-K211 VanDerWaalsContact C-N 3.35Å; N209-I212 PolarHBondContact O-N 3.15Å; N209-L213 VanDerWaalsContact O-CB 3.25Å; N209-L213 WeakPolarHBondContact O-CB 3.46Å; N209-L213 WeakPolarHBondContact O-CG 3.46Å; N209-L213 PolarHBondContact O-N 2.91Å
210	Q	79.8	Confident	76	Confident	96 Å²	96	120.4 Å²	120.4	45%	0.449	53%	0.532	S	S	.	.	H	α-helix	trans	-65.4	-39	173.8	-78.9	-176.8	-5.7	0	0	111.8	L206 F207 L213 R214	L206-Q210 WeakPolarHBondContact O-CB 3.27Å; L206-Q210 WeakPolarHBondContact O-CG 3.41Å; L206-Q210 PolarHBondContact O-N 3.21Å; F207-Q210 PolarHBondContact O-N 3.27Å; Q210-L213 PolarHBondContact O-N 3.21Å; Q210-R214 VanDerWaalsContact O-CB 3.25Å; Q210-R214 WeakPolarHBondContact O-CB 3.47Å; Q210-R214 PolarHBondContact O-N 3.01Å
211	K	77.8	Confident	74.4	Confident	132 Å²	132	118.9 Å²	118.9	57%	0.574	54%	0.538	S	S	*	.	H	α-helix	trans	-63.7	-46.7	173.8	-172.6	-177.6	177	-171.5	0	110.6	F207 R208 N209 R214 E215	F207-K211 WeakPolarHBondContact O-CB 3.38Å; F207-K211 PolarHBondContact O-N 2.94Å; R208-K211 WeakPolarHBondContact O-CB 3.5Å; R208-K211 PolarHBondContact O-N 3.42Å; N209-K211 VanDerWaalsContact C-N 3.35Å; K211-R214 WeakPolarHBondContact O-CB 3.33Å; K211-R214 PolarHBondContact O-N 3.33Å; K211-E215 WeakPolarHBondContact CE-OE1 3.14Å; K211-E215 WeakPolarHBondContact O-CG 3.33Å; K211-E215 PolarHBondContact O-N 3.17Å
212	I	81.1	Confident	72.6	Confident	74 Å²	74	119.4 Å²	119.4	38%	0.379	55%	0.545	S	S	.	.	H	α-helix	trans	-62.5	-44	175.8	-69.9	166.1	0	0	0	110.8	R208 N209 R214 E215 Y216	R208-I212 WeakPolarHBondContact O-CB 3.4Å; R208-I212 VanDerWaalsContact O-CG1 3.23Å; R208-I212 WeakPolarHBondContact O-CG1 3.49Å; R208-I212 PolarHBondContact O-N 2.75Å; N209-I212 PolarHBondContact O-N 3.15Å; I212-R214 VanDerWaalsContact C-N 3.28Å; I212-R214 PolarHBondContact O-N 3.4Å; I212-E215 CarbonylContact O-C 3.46Å; I212-E215 PolarHBondContact O-N 3.06Å; I212-Y216 HydrophobicContact CG2-CD2 3.52Å; I212-Y216 HydrophobicContact CG2-CE2 3.72Å; I212-Y216 WeakPolarHBondContact O-CB 3.3Å; I212-Y216 WeakPolarHBondContact O-CD2 3.46Å; I212-Y216 PolarHBondContact O-N 2.99Å
213	L	73.1	Confident	71.1	Confident	119 Å²	119	118.4 Å²	118.4	62%	0.623	56%	0.555	S	S	*	*	H	α-helix	trans	-64.4	-34.2	176.1	-76.9	169.6	0	0	0	111.9	N209 Q210 R217	N209-L213 VanDerWaalsContact O-CB 3.25Å; N209-L213 WeakPolarHBondContact O-CB 3.46Å; N209-L213 WeakPolarHBondContact O-CG 3.46Å; N209-L213 PolarHBondContact O-N 2.91Å; Q210-L213 PolarHBondContact O-N 3.21Å; L213-R217 WeakPolarHBondContact O-CB 3.25Å; L213-R217 PolarHBondContact O-N 3.31Å
214	R	72.9	Confident	69.4	Low	152 Å²	152	119.7 Å²	119.7	57%	0.574	57%	0.565	S	S	*	*	H	α-helix	trans	-67.3	-47.7	173	-167	178.8	-69.2	-176.2	-1.5	110	Q210 K211 I212 Y216 R217 D218	Q210-R214 VanDerWaalsContact O-CB 3.25Å; Q210-R214 WeakPolarHBondContact O-CB 3.47Å; Q210-R214 PolarHBondContact O-N 3.01Å; K211-R214 WeakPolarHBondContact O-CB 3.33Å; K211-R214 PolarHBondContact O-N 3.33Å; I212-R214 VanDerWaalsContact C-N 3.28Å; I212-R214 PolarHBondContact O-N 3.4Å; R214-Y216 PolarHBondContact O-N 3.49Å; R214-R217 PolarHBondContact O-N 3.37Å; R214-D218 VanDerWaalsContact O-CB 3.31Å; R214-D218 WeakPolarHBondContact O-CB 3.45Å; R214-D218 PolarHBondContact O-N 3.22Å
215	E	74.6	Confident	67.3	Low	104 Å²	104	120.7 Å²	120.7	49%	0.486	58%	0.579	S	S	.	*	H	α-helix	trans	-60.6	-42.9	174.1	-74.3	171.1	-172.2	0	0	112.2	K211 I212 D218 F219	K211-E215 WeakPolarHBondContact CE-OE1 3.14Å; K211-E215 WeakPolarHBondContact O-CG 3.33Å; K211-E215 PolarHBondContact O-N 3.17Å; I212-E215 CarbonylContact O-C 3.46Å; I212-E215 PolarHBondContact O-N 3.06Å; E215-D218 PolarHBondContact O-N 3.38Å; E215-F219 WeakPolarHBondContact O-CB 3.42Å; E215-F219 PolarHBondContact O-N 2.85Å
216	Y	66.4	Low	65.2	Low	143 Å²	143	123.1 Å²	123.1	56%	0.561	59%	0.589	S	S	*	*	H	α-helix	trans	-65.2	-40.5	174.5	-98.6	-89.3	0	0	0	111.7	I212 R214 D218 F219 L220	I212-Y216 HydrophobicContact CG2-CD2 3.52Å; I212-Y216 HydrophobicContact CG2-CE2 3.72Å; I212-Y216 WeakPolarHBondContact O-CB 3.3Å; I212-Y216 WeakPolarHBondContact O-CD2 3.46Å; I212-Y216 PolarHBondContact O-N 2.99Å; R214-Y216 PolarHBondContact O-N 3.49Å; Y216-D218 VanDerWaalsContact C-N 3.32Å; Y216-F219 PolarHBondContact O-N 3.36Å; Y216-L220 HydrophobicContact CD1-CD1 3.99Å; Y216-L220 WeakPolarHBondContact O-CB 3.47Å; Y216-L220 PolarHBondContact O-N 3.12Å
217	R	64.8	Low	63.2	Low	166 Å²	166	124 Å²	124	63%	0.626	60%	0.6	S	S	*	*	H	α-helix	trans	-67.1	-36.2	175.9	-177.9	-175.9	68.4	179.2	2.6	111.7	L213 R214	L213-R217 WeakPolarHBondContact O-CB 3.25Å; L213-R217 PolarHBondContact O-N 3.31Å; R214-R217 PolarHBondContact O-N 3.37Å
218	D	60.5	Low	61.2	Low	108 Å²	108	129.2 Å²	129.2	58%	0.578	62%	0.616	S	S	*	*	H	α-helix	trans	-76.4	-31.6	178.2	-62.2	-14	0	0	0	110.6	R214 E215 Y216	R214-D218 VanDerWaalsContact O-CB 3.31Å; R214-D218 WeakPolarHBondContact O-CB 3.45Å; R214-D218 PolarHBondContact O-N 3.22Å; E215-D218 PolarHBondContact O-N 3.38Å; Y216-D218 VanDerWaalsContact C-N 3.32Å
219	F	65.4	Low	59.4	Low	179 Å²	179	127.8 Å²	127.8	79%	0.785	62%	0.621	S	S	*	*	H	α-helix	trans	-76.2	-42.7	173.6	-176.1	-97.6	0	0	0	113.2	E215 Y216 G221	E215-F219 WeakPolarHBondContact O-CB 3.42Å; E215-F219 PolarHBondContact O-N 2.85Å; Y216-F219 PolarHBondContact O-N 3.36Å; F219-G221 PolarHBondContact O-N 2.91Å; F219-G221 VanDerWaalsContact O-N 3.14Å
220	L	53.5	Low	57.7	Low	111 Å²	111	125.3 Å²	125.3	58%	0.581	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	30	175.1	-76.5	159.3	0	0	0	112.4	Y216 N222	Y216-L220 HydrophobicContact CD1-CD1 3.99Å; Y216-L220 WeakPolarHBondContact O-CB 3.47Å; Y216-L220 PolarHBondContact O-N 3.12Å; L220-N222 PolarHBondContact O-N 3.07Å
221	G	44.3	Very low	55.8	Low	58 Å²	58	123.4 Å²	123.4	60%	0.598	61%	0.61	S	S	*	*			trans	-43.5	109.2	178.6	0	0	0	0	0	112	F219	F219-G221 PolarHBondContact O-N 2.91Å; F219-G221 VanDerWaalsContact O-N 3.14Å
222	N	50.9	Low	54.2	Low	120 Å²	120	121.7 Å²	121.7	64%	0.642	61%	0.61	S	S	*	*			trans	92.9	59.2	152.8	-130.5	25.8	0	0	0	120.3	L220	L220-N222 PolarHBondContact O-N 3.07Å
223	T	47.6	Very low	52.5	Low	134 Å²	134	122.6 Å²	122.6	82%	0.822	61%	0.612	S	S	*	*			trans	-132.9	44.3	158.9	55.2	0	0	0	0	114.7
224	K	42.9	Very low	51.1	Low	186 Å²	186	123.6 Å²	123.6	81%	0.809	61%	0.611	S	S	*	*	S	Bend	trans	-125.1	139.6	152.8	-81.8	-171	179.3	-178.5	0	109.1	R226	K224-R226 PolarHBondContact O-N 3.22Å
225	P	39.8	Very low	49.4	Very low	116 Å²	116	124.5 Å²	124.5	75%	0.753	62%	0.619	S	S	*	*			trans	-66.3	118.5	-166.4	28	-32.8	0	0	0	108.5	S227	P225-S227 PolarHBondContact O-N 3.39Å
226	R	42.4	Very low	48.8	Very low	200 Å²	200	122 Å²	122	76%	0.755	62%	0.622	S	S	*	*			trans	-66.5	36.6	170.4	-160.4	172.3	174.1	156.6	-5.8	111.3	K224 A230	K224-R226 PolarHBondContact O-N 3.22Å; R226-A230 VanDerWaalsContact O-CB 3.3Å; R226-A230 WeakPolarHBondContact O-CB 3.28Å
227	S	43.5	Very low	48.1	Very low	79 Å²	79	120.5 Å²	120.5	55%	0.552	63%	0.63	S	S	*	*	H	α-helix	trans	-96	-19.4	-156.4	179.7	0	0	0	0	114.4	P225 S231	P225-S227 PolarHBondContact O-N 3.39Å; S227-S231 WeakPolarHBondContact O-CB 2.98Å; S227-S231 PolarHBondContact O-OG 3.39Å
228	R	40.3	Very low	47.7	Very low	227 Å²	227	113 Å²	113	86%	0.857	60%	0.604	S	S	*	*	H	α-helix	trans	-90.3	-22.5	176.7	-107.5	-179.1	171.5	179.2	-2.6	115.5	S231	R228-S231 PolarHBondContact O-OG 3.1Å
229	T	45.8	Very low	48	Very low	89 Å²	89	114.1 Å²	114.1	55%	0.546	60%	0.604	S	S	.	*	H	α-helix	trans	-97.4	-36.1	179.6	-48	0	0	0	0	112.1	S231 V232	T229-S231 VanDerWaalsContact C-N 3.27Å; T229-S231 PolarHBondContact O-N 2.93Å; T229-V232 PolarHBondContact O-N 3.28Å
230	A	43.3	Very low	48.2	Very low	39 Å²	39	110.6 Å²	110.6	32%	0.322	60%	0.597	S	S	.	*	H	α-helix	trans	-63.4	-35.7	172	0	0	0	0	0	111.3	R226 V232 F233 F234	R226-A230 VanDerWaalsContact O-CB 3.3Å; R226-A230 WeakPolarHBondContact O-CB 3.28Å; A230-V232 VanDerWaalsContact C-N 3.28Å; A230-V232 PolarHBondContact O-N 3.06Å; A230-F233 PolarHBondContact O-N 2.61Å; A230-F234 HydrophobicContact CB-CD2 4.45Å; A230-F234 WeakPolarHBondContact O-CD2 3.14Å; A230-F234 PolarHBondContact O-N 2.9Å; A230-F234 VanDerWaalsContact O-N 3.1Å
231	S	41.2	Very low	48.8	Very low	56 Å²	56	108.9 Å²	108.9	39%	0.392	59%	0.591	S	S	.	*	H	α-helix	trans	-69.5	-18.9	179.4	53.1	0	0	0	0	114.9	S227 R228 T229 K235	S227-S231 WeakPolarHBondContact O-CB 2.98Å; S227-S231 PolarHBondContact O-OG 3.39Å; R228-S231 PolarHBondContact O-OG 3.1Å; T229-S231 VanDerWaalsContact C-N 3.27Å; T229-S231 PolarHBondContact O-N 2.93Å; S231-K235 PolarHBondContact O-N 2.76Å
232	V	44.9	Very low	50.1	Low	95 Å²	95	109 Å²	109	58%	0.576	58%	0.577	S	S	*	*	H	α-helix	trans	-79.5	-36.9	172.9	178.6	0	0	0	0	111.2	T229 A230 G238	T229-V232 PolarHBondContact O-N 3.28Å; A230-V232 VanDerWaalsContact C-N 3.28Å; A230-V232 PolarHBondContact O-N 3.06Å; V232-G238 WeakPolarHBondContact O-CA 3.34Å
233	F	44.4	Very low	51.4	Low	94 Å²	94	106.6 Å²	106.6	41%	0.412	57%	0.566	S	S	.	*	H	α-helix	trans	-70.6	-30.5	174.7	-83.8	-83.4	0	0	0	112.7	A230 G238 K239	A230-F233 PolarHBondContact O-N 2.61Å; F233-G238 CarbonylContact O-C 3.54Å; F233-K239 PolarHBondContact O-N 3.28Å
234	F	43	Very low	52.7	Low	140 Å²	140	102 Å²	102	61%	0.614	54%	0.541	S	S	*	.	S	Bend	trans	-98.2	2.7	-177	-68.7	-67.4	0	0	0	115.5	A230 M242	A230-F234 HydrophobicContact CB-CD2 4.45Å; A230-F234 WeakPolarHBondContact O-CD2 3.14Å; A230-F234 PolarHBondContact O-N 2.9Å; A230-F234 VanDerWaalsContact O-N 3.1Å; F234-M242 HydrophobicContact CD1-CE 4.4Å; F234-M242 HydrophobicContact CD1-SD 4.36Å; F234-M242 HydrophobicContact CE1-CE 4.15Å; F234-M242 HydrophobicContact CE1-SD 3.77Å; F234-M242 HydrophobicContact CZ-SD 4.33Å
235	K	37.9	Very low	54.3	Low	170 Å²	170	96.3 Å²	96.3	74%	0.739	52%	0.519	S	S	*	.	S	Bend	trans	-135.4	132.7	171.6	-73.1	-171.1	176.4	-176.2	0	112.7	S231	S231-K235 PolarHBondContact O-N 2.76Å
236	G	61.5	Low	56.4	Low	52 Å²	52	94.2 Å²	94.2	54%	0.536	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	-130.6	172.7	0	0	0	0	0	114.1	G238 K239	G236-G238 VanDerWaalsContact C-N 3.27Å; G236-G238 PolarHBondContact O-N 2.61Å; G236-K239 WeakPolarHBondContact O-CB 3.33Å; G236-K239 PolarHBondContact O-N 3.05Å; G236-K239 VanDerWaalsContact O-N 3.13Å
237	P	51.5	Low	58.4	Low	112 Å²	112	87.8 Å²	87.8	73%	0.727	49%	0.486	S	S	*	.	H	α-helix	trans	-57.3	-30.7	-176.1	-24.7	33.2	0	0	0	115.1	K239 V240 V241	P237-K239 VanDerWaalsContact C-N 3.27Å; P237-K239 PolarHBondContact O-N 2.88Å; P237-V240 WeakPolarHBondContact O-CB 3.37Å; P237-V240 PolarHBondContact O-N 2.95Å; P237-V241 PolarHBondContact O-N 3.19Å
238	G	56.3	Low	60.3	Low	9 Å²	9	84.8 Å²	84.8	9%	0.093	46%	0.464	C	S	.	.	H	α-helix	trans	-67.3	-26.9	178.8	0	0	0	0	0	113.8	V232 F233 G236 V240 V241 M242	V232-G238 WeakPolarHBondContact O-CA 3.34Å; F233-G238 CarbonylContact O-C 3.54Å; G236-G238 VanDerWaalsContact C-N 3.27Å; G236-G238 PolarHBondContact O-N 2.61Å; G238-V240 VanDerWaalsContact C-N 3.33Å; G238-V241 PolarHBondContact O-N 2.88Å; G238-M242 WeakPolarHBondContact O-CB 3.3Å; G238-M242 PolarHBondContact O-N 3.39Å
239	K	67.3	Low	62.6	Low	130 Å²	130	75.2 Å²	75.2	57%	0.565	44%	0.436	S	S	*	.	H	α-helix	trans	-66.5	-38	173.6	-171.7	179.6	178.8	-177.2	0	110.7	F233 G236 P237 M242 V243	F233-K239 PolarHBondContact O-N 3.28Å; G236-K239 WeakPolarHBondContact O-CB 3.33Å; G236-K239 PolarHBondContact O-N 3.05Å; G236-K239 VanDerWaalsContact O-N 3.13Å; P237-K239 VanDerWaalsContact C-N 3.27Å; P237-K239 PolarHBondContact O-N 2.88Å; K239-M242 PolarHBondContact O-N 2.89Å; K239-V243 WeakPolarHBondContact O-CB 3.36Å; K239-V243 WeakPolarHBondContact O-CG2 3.3Å; K239-V243 PolarHBondContact O-N 3.41Å
240	V	70.1	Confident	64.7	Low	105 Å²	105	75.4 Å²	75.4	64%	0.636	43%	0.433	S	S	*	.	H	α-helix	trans	-65.2	-45.1	177.5	-176.6	0	0	0	0	110.5	P237 G238 V243 A244	P237-V240 WeakPolarHBondContact O-CB 3.37Å; P237-V240 PolarHBondContact O-N 2.95Å; G238-V240 VanDerWaalsContact C-N 3.33Å; V240-V243 PolarHBondContact O-N 3.33Å; V240-A244 PolarHBondContact O-N 3.27Å
241	V	66.4	Low	66.9	Low	76 Å²	76	74.6 Å²	74.6	46%	0.461	42%	0.423	S	S	.	.	H	α-helix	trans	-63.3	-43.6	177.1	177.8	0	0	0	0	111.5	P237 G238 V243 A244 I245	P237-V241 PolarHBondContact O-N 3.19Å; G238-V241 PolarHBondContact O-N 2.88Å; V241-V243 VanDerWaalsContact C-N 3.35Å; V241-V243 PolarHBondContact O-N 2.97Å; V241-A244 PolarHBondContact O-N 3.13Å; V241-I245 HydrophobicContact CG1-CD1 4.04Å; V241-I245 WeakPolarHBondContact O-CG1 3.4Å; V241-I245 PolarHBondContact O-N 2.97Å
242	M	71.6	Confident	69.3	Low	61 Å²	61	72.6 Å²	72.6	30%	0.3	41%	0.409	S	S	.	.	H	α-helix	trans	-64.5	-39.7	177.2	-172.3	-174.6	68.3	0	0	111.8	F234 G238 K239 I245 C246	F234-M242 HydrophobicContact CD1-CE 4.4Å; F234-M242 HydrophobicContact CD1-SD 4.36Å; F234-M242 HydrophobicContact CE1-CE 4.15Å; F234-M242 HydrophobicContact CE1-SD 3.77Å; F234-M242 HydrophobicContact CZ-SD 4.33Å; G238-M242 WeakPolarHBondContact O-CB 3.3Å; G238-M242 PolarHBondContact O-N 3.39Å; K239-M242 PolarHBondContact O-N 2.89Å; M242-I245 PolarHBondContact O-N 3.03Å; M242-C246 WeakPolarHBondContact O-CB 3.19Å; M242-C246 PolarHBondContact O-N 3.25Å; M242-C246 PolarHBondContact O-SG 2.67Å; M242-C246 VanDerWaalsContact O-SG 3.32Å
243	V	77.8	Confident	71.6	Confident	68 Å²	68	73.5 Å²	73.5	41%	0.412	41%	0.406	S	S	.	.	H	α-helix	trans	-62.1	-43.9	174.2	167.5	0	0	0	0	110.8	K239 V240 V241 C246 I247	K239-V243 WeakPolarHBondContact O-CB 3.36Å; K239-V243 WeakPolarHBondContact O-CG2 3.3Å; K239-V243 PolarHBondContact O-N 3.41Å; V240-V243 PolarHBondContact O-N 3.33Å; V241-V243 VanDerWaalsContact C-N 3.35Å; V241-V243 PolarHBondContact O-N 2.97Å; V243-C246 PolarHBondContact O-N 3.22Å; V243-I247 HydrophobicContact CG1-CD1 3.68Å; V243-I247 HydrophobicContact CG1-CG1 4.34Å; V243-I247 VanDerWaalsContact O-CG1 3.27Å; V243-I247 WeakPolarHBondContact O-CG1 3.26Å; V243-I247 PolarHBondContact O-N 3Å
244	A	73.8	Confident	73.9	Confident	37 Å²	37	73.4 Å²	73.4	31%	0.306	41%	0.405	S	S	.	.	H	α-helix	trans	-60.8	-46.3	176.8	0	0	0	0	0	112.3	V240 V241 C246 I247 N248	V240-A244 PolarHBondContact O-N 3.27Å; V241-A244 PolarHBondContact O-N 3.13Å; A244-C246 VanDerWaalsContact C-N 3.32Å; A244-C246 PolarHBondContact O-N 2.84Å; A244-I247 PolarHBondContact O-N 3.49Å; A244-N248 PolarHBondContact O-N 2.97Å
245	I	76.8	Confident	76.4	Confident	68 Å²	68	66.8 Å²	66.8	35%	0.349	38%	0.376	S	S	.	.	H	α-helix	trans	-60.9	-41.9	175.8	-66.9	168.4	0	0	0	111	V241 M242 N248 G249	V241-I245 HydrophobicContact CG1-CD1 4.04Å; V241-I245 WeakPolarHBondContact O-CG1 3.4Å; V241-I245 PolarHBondContact O-N 2.97Å; M242-I245 PolarHBondContact O-N 3.03Å; I245-N248 PolarHBondContact O-N 2.81Å; I245-G249 PolarHBondContact O-N 3Å
246	C	84.4	Confident	79	Confident	71 Å²	71	62.5 Å²	62.5	48%	0.48	36%	0.358	S	S	.	.	H	α-helix	trans	-64.4	-40.8	176.3	-74.9	0	0	0	0	112.3	M242 V243 A244 G249 L250	M242-C246 WeakPolarHBondContact O-CB 3.19Å; M242-C246 PolarHBondContact O-N 3.25Å; M242-C246 PolarHBondContact O-SG 2.67Å; M242-C246 VanDerWaalsContact O-SG 3.32Å; V243-C246 PolarHBondContact O-N 3.22Å; A244-C246 VanDerWaalsContact C-N 3.32Å; A244-C246 PolarHBondContact O-N 2.84Å; C246-G249 PolarHBondContact O-N 3.09Å; C246-L250 WeakPolarHBondContact O-CB 3.25Å; C246-L250 VanDerWaalsContact O-CG 3.27Å; C246-L250 WeakPolarHBondContact O-CG 3.43Å; C246-L250 PolarHBondContact O-N 3.19Å
247	I	83.9	Confident	80.5	Confident	66 Å²	66	63.7 Å²	63.7	34%	0.338	35%	0.351	S	S	.	.	H	α-helix	trans	-62.6	-48.2	177.1	-71	166	0	0	0	110.2	V243 A244 G249 L250 N251	V243-I247 HydrophobicContact CG1-CD1 3.68Å; V243-I247 HydrophobicContact CG1-CG1 4.34Å; V243-I247 VanDerWaalsContact O-CG1 3.27Å; V243-I247 WeakPolarHBondContact O-CG1 3.26Å; V243-I247 PolarHBondContact O-N 3Å; A244-I247 PolarHBondContact O-N 3.49Å; I247-G249 VanDerWaalsContact C-N 3.35Å; I247-G249 PolarHBondContact O-N 2.9Å; I247-L250 PolarHBondContact O-N 2.75Å; I247-N251 PolarHBondContact O-N 2.71Å
248	N	84.6	Confident	82.3	Confident	15 Å²	15	58.5 Å²	58.5	8%	0.08	32%	0.318	C	S	.	.	H	α-helix	trans	-64.6	-40.2	179.4	-68.4	-12.2	0	0	0	111.7	A244 I245 N251 C252 Q281	A244-N248 PolarHBondContact O-N 2.97Å; I245-N248 PolarHBondContact O-N 2.81Å; N248-N251 PolarHBondContact O-N 2.67Å; N248-C252 WeakPolarHBondContact O-CB 3.08Å; N248-C252 PolarHBondContact O-N 3.31Å; N248-Q281 PolarHBondContact ND2-NE2 2.94Å
249	G	87.9	Confident	84	Confident	26 Å²	26	60.8 Å²	60.8	27%	0.268	32%	0.324	S	S	.	.	H	α-helix	trans	-63.2	-39.8	173.3	0	0	0	0	0	113.4	I245 C246 I247 C252 F253	I245-G249 PolarHBondContact O-N 3Å; C246-G249 PolarHBondContact O-N 3.09Å; I247-G249 VanDerWaalsContact C-N 3.35Å; I247-G249 PolarHBondContact O-N 2.9Å; G249-C252 WeakPolarHBondContact O-CB 3.28Å; G249-C252 PolarHBondContact O-N 3.06Å; G249-F253 WeakPolarHBondContact O-CB 3.5Å; G249-F253 PolarHBondContact O-N 2.88Å
250	L	90.3	Very high	85.1	Confident	94 Å²	94	59.6 Å²	59.6	49%	0.492	32%	0.323	S	S	.	.	H	α-helix	trans	-66.2	-43.6	174.9	-76.7	169.6	0	0	0	111.5	C246 I247 C252 F253 F254	C246-L250 WeakPolarHBondContact O-CB 3.25Å; C246-L250 VanDerWaalsContact O-CG 3.27Å; C246-L250 WeakPolarHBondContact O-CG 3.43Å; C246-L250 PolarHBondContact O-N 3.19Å; I247-L250 PolarHBondContact O-N 2.75Å; L250-C252 VanDerWaalsContact C-N 3.33Å; L250-C252 PolarHBondContact O-N 3.07Å; L250-F253 WeakPolarHBondContact O-CB 3.33Å; L250-F253 PolarHBondContact O-N 2.81Å; L250-F253 VanDerWaalsContact O-N 3.17Å; L250-F254 HydrophobicContact CB-CD2 4.45Å; L250-F254 HydrophobicContact CB-CE2 4.31Å; L250-F254 HydrophobicContact CD2-CE2 4.26Å; L250-F254 WeakPolarHBondContact O-CD2 3.41Å; L250-F254 PolarHBondContact O-N 2.94Å
251	N	89.4	Confident	85.9	Confident	21 Å²	21	59.9 Å²	59.9	11%	0.112	31%	0.313	C	S	.	.	H	α-helix	trans	-58.2	-46.6	174.2	-79	-14.3	0	0	0	111.4	I247 N248 F253 F254 K255 S356	I247-N251 PolarHBondContact O-N 2.71Å; N248-N251 PolarHBondContact O-N 2.67Å; N251-F253 VanDerWaalsContact C-N 3.31Å; N251-F253 PolarHBondContact O-N 2.8Å; N251-F254 PolarHBondContact O-N 3.38Å; N251-K255 WeakPolarHBondContact O-CB 3.03Å; N251-K255 WeakPolarHBondContact O-CG 3.38Å; N251-K255 PolarHBondContact O-N 2.88Å; N251-S356 PolarHBondContact ND2-OG 3.42Å; N251-S356 PolarHBondContact OD1-OG 3Å
252	C	91.8	Very high	87	Confident	14 Å²	14	56.4 Å²	56.4	10%	0.095	29%	0.292	C	S	.	.	H	α-helix	trans	-56.3	-46.3	174.6	179.8	0	0	0	0	111.5	N248 G249 L250 F256 L275	N248-C252 WeakPolarHBondContact O-CB 3.08Å; N248-C252 PolarHBondContact O-N 3.31Å; G249-C252 WeakPolarHBondContact O-CB 3.28Å; G249-C252 PolarHBondContact O-N 3.06Å; L250-C252 VanDerWaalsContact C-N 3.33Å; L250-C252 PolarHBondContact O-N 3.07Å; C252-F256 VanDerWaalsContact O-CB 3.31Å; C252-F256 WeakPolarHBondContact O-CB 3.47Å; C252-F256 PolarHBondContact O-N 3.08Å; C252-L275 WeakPolarHBondContact SG-CA 3.31Å; C252-L275 PolarHBondContact SG-N 3.44Å; C252-L275 VanDerWaalsContact SG-N 3.42Å
253	F	93.5	Very high	87.6	Confident	115 Å²	115	56.3 Å²	56.3	50%	0.504	31%	0.306	S	S	.	.	H	α-helix	trans	-62.1	-48.4	179.5	178	-102.8	0	0	0	112.2	G249 L250 N251 F256 L257	G249-F253 WeakPolarHBondContact O-CB 3.5Å; G249-F253 PolarHBondContact O-N 2.88Å; L250-F253 WeakPolarHBondContact O-CB 3.33Å; L250-F253 PolarHBondContact O-N 2.81Å; L250-F253 VanDerWaalsContact O-N 3.17Å; N251-F253 VanDerWaalsContact C-N 3.31Å; N251-F253 PolarHBondContact O-N 2.8Å; F253-F256 PolarHBondContact O-N 2.85Å; F253-L257 HydrophobicContact CD1-CD1 4.09Å; F253-L257 HydrophobicContact CE1-CD1 3.46Å; F253-L257 VanDerWaalsContact CE1-CD1 3.46Å; F253-L257 HydrophobicContact CE1-CG 4.28Å; F253-L257 HydrophobicContact CE2-CD1 4.46Å; F253-L257 HydrophobicContact CZ-CD1 3.69Å; F253-L257 HydrophobicContact CZ-CG 4.22Å; F253-L257 PolarHBondContact O-N 2.62Å
254	F	93.2	Very high	88.1	Confident	92 Å²	92	53 Å²	53	40%	0.404	29%	0.287	S	S	.	.	H	α-helix	trans	-67	-40.3	179.2	-71.1	-61.2	0	0	0	112.5	L250 N251 F256 L257 A258 I349	L250-F254 HydrophobicContact CB-CD2 4.45Å; L250-F254 HydrophobicContact CB-CE2 4.31Å; L250-F254 HydrophobicContact CD2-CE2 4.26Å; L250-F254 WeakPolarHBondContact O-CD2 3.41Å; L250-F254 PolarHBondContact O-N 2.94Å; N251-F254 PolarHBondContact O-N 3.38Å; F254-F256 VanDerWaalsContact C-N 3.29Å; F254-F256 PolarHBondContact O-N 3.16Å; F254-L257 PolarHBondContact O-N 3.49Å; F254-A258 WeakPolarHBondContact O-CB 3.29Å; F254-A258 PolarHBondContact O-N 3.19Å; F254-I349 HydrophobicContact CB-CD1 4.41Å; F254-I349 HydrophobicContact CB-CG1 4.42Å; F254-I349 HydrophobicContact CB-CG2 3.95Å
255	K	93.6	Very high	88.9	Confident	1 Å²	1	51.8 Å²	51.8	0%	0.004	28%	0.276	C	S	.	.	H	α-helix	trans	-61.5	-39.2	174.5	-73.6	179.6	179.3	-179.1	0	111.7	N251 A258 W259 M267 E270 A271 S274 I349 S353 E357	N251-K255 WeakPolarHBondContact O-CB 3.03Å; N251-K255 WeakPolarHBondContact O-CG 3.38Å; N251-K255 PolarHBondContact O-N 2.88Å; K255-A258 PolarHBondContact O-N 3.45Å; K255-W259 PolarHBondContact O-N 3.15Å; K255-M267 HydrophobicContact CB-CE 3.82Å; K255-M267 HydrophobicContact CG-CE 3.81Å; K255-E270 HydrophobicContact CD-CB 4.25Å; K255-E270 IonicContact NZ-OE2 2.77Å; K255-E270 PolarHBondContact NZ-OE2 3.31Å; K255-E270 VanDerWaalsContact NZ-OE2 3.07Å; K255-A271 HydrophobicContact CB-CB 4.16Å; K255-S274 WeakPolarHBondContact CD-OG 3.48Å; K255-S274 PolarHBondContact NZ-OG 3.13Å; K255-I349 HydrophobicContact CG-CG2 4.2Å; K255-S353 VanDerWaalsContact CE-CB 3.48Å; K255-S353 WeakPolarHBondContact CE-OG 3.28Å; K255-S353 PolarHBondContact NZ-OG 2.74Å; K255-S353 VanDerWaalsContact NZ-OG 3.09Å; K255-E357 IonicContact NZ-OE1 2.94Å; K255-E357 PolarHBondContact NZ-OE1 2.86Å; K255-E357 IonicContact NZ-OE2 3.49Å
256	F	93.5	Very high	89.6	Confident	80 Å²	80	48.5 Å²	48.5	35%	0.351	26%	0.259	S	S	.	.	H	α-helix	trans	-64.7	-42.1	176.4	-169.2	-101.1	0	0	0	112.3	C252 F253 F254 W259 I260 A271	C252-F256 VanDerWaalsContact O-CB 3.31Å; C252-F256 WeakPolarHBondContact O-CB 3.47Å; C252-F256 PolarHBondContact O-N 3.08Å; F253-F256 PolarHBondContact O-N 2.85Å; F254-F256 VanDerWaalsContact C-N 3.29Å; F254-F256 PolarHBondContact O-N 3.16Å; F256-W259 AromaticContact CD2-CE3 3.78Å; F256-W259 HydrophobicContact CD2-CE3 3.78Å; F256-W259 HydrophobicContact CD2-CZ3 4.02Å; F256-W259 HydrophobicContact CE1-CZ3 4.49Å; F256-W259 AromaticContact CE2-CE3 3.62Å; F256-W259 HydrophobicContact CE2-CE3 3.62Å; F256-W259 AromaticContact CE2-CZ3 3.35Å; F256-W259 HydrophobicContact CE2-CZ3 3.35Å; F256-W259 HydrophobicContact CG-CE3 4.4Å; F256-W259 HydrophobicContact CZ-CE3 4.13Å; F256-W259 AromaticContact CZ-CZ3 3.64Å; F256-W259 HydrophobicContact CZ-CZ3 3.64Å; F256-W259 PolarHBondContact O-N 3.07Å; F256-I260 HydrophobicContact CD1-CD1 3.76Å; F256-I260 HydrophobicContact CE1-CD1 3.44Å; F256-I260 VanDerWaalsContact CE1-CD1 3.44Å; F256-I260 HydrophobicContact CE1-CG1 4.31Å; F256-I260 HydrophobicContact CZ-CD1 4.18Å; F256-I260 WeakPolarHBondContact O-CG1 3.44Å; F256-I260 PolarHBondContact O-N 2.97Å; F256-A271 HydrophobicContact CB-CB 4.4Å; F256-A271 HydrophobicContact CD2-CB 4.39Å
257	L	92.3	Very high	90	Very high	76 Å²	76	45.1 Å²	45.1	40%	0.398	24%	0.237	S	C	.	.	H	α-helix	trans	-63.5	-42.6	173.6	-70.8	-179.5	0	0	0	112.3	F253 F254 W259 I260 Y261	F253-L257 HydrophobicContact CD1-CD1 4.09Å; F253-L257 HydrophobicContact CE1-CD1 3.46Å; F253-L257 VanDerWaalsContact CE1-CD1 3.46Å; F253-L257 HydrophobicContact CE1-CG 4.28Å; F253-L257 HydrophobicContact CE2-CD1 4.46Å; F253-L257 HydrophobicContact CZ-CD1 3.69Å; F253-L257 HydrophobicContact CZ-CG 4.22Å; F253-L257 PolarHBondContact O-N 2.62Å; F254-L257 PolarHBondContact O-N 3.49Å; L257-W259 VanDerWaalsContact C-N 3.29Å; L257-W259 PolarHBondContact O-N 3.27Å; L257-I260 PolarHBondContact O-N 3.23Å; L257-Y261 WeakPolarHBondContact O-CB 3.19Å; L257-Y261 PolarHBondContact O-N 3.03Å
258	A	90.8	Very high	90.5	Very high	4 Å²	4	42.6 Å²	42.6	3%	0.033	22%	0.223	C	C	.	.	H	α-helix	trans	-61.2	-39.4	175.7	0	0	0	0	0	112	F254 K255 Y261 T262 M267 A346 I349	F254-A258 WeakPolarHBondContact O-CB 3.29Å; F254-A258 PolarHBondContact O-N 3.19Å; K255-A258 PolarHBondContact O-N 3.45Å; A258-Y261 PolarHBondContact O-N 3.35Å; A258-T262 WeakPolarHBondContact O-CB 2.79Å; A258-T262 WeakPolarHBondContact O-CG2 3.38Å; A258-T262 PolarHBondContact O-N 3.16Å; A258-T262 PolarHBondContact O-OG1 2.8Å; A258-M267 HydrophobicContact CB-CE 3.38Å; A258-M267 HydrophobicContact CB-CG 4.03Å; A258-M267 HydrophobicContact CB-SD 4.2Å; A258-A346 HydrophobicContact CB-CB 4.35Å; A258-I349 HydrophobicContact CB-CB 4.4Å; A258-I349 HydrophobicContact CB-CD1 3.72Å; A258-I349 HydrophobicContact CB-CG2 4.26Å
259	W	91.8	Very high	90.9	Very high	56 Å²	56	41.9 Å²	41.9	21%	0.212	22%	0.219	C	C	.	.	H	α-helix	trans	-62.3	-51.4	174	163.6	55.9	0	0	0	111.6	K255 F256 L257 Y261 T262 G263 S264 M267 F268 A271	K255-W259 PolarHBondContact O-N 3.15Å; F256-W259 AromaticContact CD2-CE3 3.78Å; F256-W259 HydrophobicContact CD2-CE3 3.78Å; F256-W259 HydrophobicContact CD2-CZ3 4.02Å; F256-W259 HydrophobicContact CE1-CZ3 4.49Å; F256-W259 AromaticContact CE2-CE3 3.62Å; F256-W259 HydrophobicContact CE2-CE3 3.62Å; F256-W259 AromaticContact CE2-CZ3 3.35Å; F256-W259 HydrophobicContact CE2-CZ3 3.35Å; F256-W259 HydrophobicContact CG-CE3 4.4Å; F256-W259 HydrophobicContact CZ-CE3 4.13Å; F256-W259 AromaticContact CZ-CZ3 3.64Å; F256-W259 HydrophobicContact CZ-CZ3 3.64Å; F256-W259 PolarHBondContact O-N 3.07Å; L257-W259 VanDerWaalsContact C-N 3.29Å; L257-W259 PolarHBondContact O-N 3.27Å; W259-Y261 PolarHBondContact O-N 3.17Å; W259-T262 PolarHBondContact O-N 3.24Å; W259-T262 PolarHBondContact O-OG1 3.15Å; W259-G263 PolarHBondContact O-N 3.33Å; W259-S264 VanDerWaalsContact CD1-O 3.25Å; W259-M267 HydrophobicContact CB-CB 4.29Å; W259-M267 HydrophobicContact CB-CG 4Å; W259-F268 HydrophobicContact CD2-CB 4.37Å; W259-F268 AromaticContact CD2-CD2 3.75Å; W259-F268 HydrophobicContact CD2-CD2 3.75Å; W259-F268 AromaticContact CE2-CD2 3.38Å; W259-F268 HydrophobicContact CE3-CD2 4.22Å; W259-F268 HydrophobicContact CG-CB 4.02Å; W259-F268 HydrophobicContact CG-CD2 4.27Å; W259-F268 AromaticContact CH2-CD2 3.98Å; W259-F268 HydrophobicContact CH2-CD2 3.98Å; W259-F268 HydrophobicContact CH2-CE2 4.03Å; W259-F268 AromaticContact CZ2-CD2 3.49Å; W259-F268 HydrophobicContact CZ2-CD2 3.49Å; W259-F268 VanDerWaalsContact CZ2-CD2 3.49Å; W259-F268 AromaticContact CZ2-CE2 3.88Å; W259-F268 HydrophobicContact CZ2-CE2 3.88Å; W259-F268 HydrophobicContact CZ2-CG 4.5Å; W259-F268 HydrophobicContact CZ3-CD2 4.33Å; W259-F268 AromaticContact NE1-CD2 3.74Å; W259-A271 HydrophobicContact CB-CB 4.47Å
260	I	90	Very high	91.2	Very high	105 Å²	105	40.7 Å²	40.7	54%	0.538	21%	0.207	S	C	.	.	H	α-helix	trans	-55.6	-40.7	178.8	-71.2	171.8	0	0	0	111	F256 L257	F256-I260 HydrophobicContact CD1-CD1 3.76Å; F256-I260 HydrophobicContact CE1-CD1 3.44Å; F256-I260 VanDerWaalsContact CE1-CD1 3.44Å; F256-I260 HydrophobicContact CE1-CG1 4.31Å; F256-I260 HydrophobicContact CZ-CD1 4.18Å; F256-I260 WeakPolarHBondContact O-CG1 3.44Å; F256-I260 PolarHBondContact O-N 2.97Å; L257-I260 PolarHBondContact O-N 3.23Å
261	Y	87.5	Confident	91.4	Very high	112 Å²	112	36.2 Å²	36.2	44%	0.439	18%	0.184	S	C	.	.	H	α-helix	trans	-72.9	-38.4	-178.8	-179.2	-103.3	0	0	0	113.2	L257 A258 W259 S342 W345	L257-Y261 WeakPolarHBondContact O-CB 3.19Å; L257-Y261 PolarHBondContact O-N 3.03Å; A258-Y261 PolarHBondContact O-N 3.35Å; W259-Y261 PolarHBondContact O-N 3.17Å; Y261-S342 WeakPolarHBondContact CE1-O 3.36Å; Y261-S342 WeakPolarHBondContact CE1-OG 3.25Å; Y261-S342 PolarHBondContact OH-OG 3.22Å; Y261-W345 HydrophobicContact CE1-CB 4.4Å
262	T	87.8	Confident	91.6	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.018	18%	0.181	C	C	.	.	H	α-helix	trans	-90.4	-28.7	-175.5	53.5	0	0	0	0	114.2	A258 W259 S264 I340 E341 L343 A346	A258-T262 WeakPolarHBondContact O-CB 2.79Å; A258-T262 WeakPolarHBondContact O-CG2 3.38Å; A258-T262 PolarHBondContact O-N 3.16Å; A258-T262 PolarHBondContact O-OG1 2.8Å; W259-T262 PolarHBondContact O-N 3.24Å; W259-T262 PolarHBondContact O-OG1 3.15Å; T262-S264 PolarHBondContact O-N 3.49Å; T262-S264 PolarHBondContact OG1-N 3.06Å; T262-I340 WeakPolarHBondContact O-CG2 3.21Å; T262-E341 PolarHBondContact O-N 2.9Å; T262-L343 HydrophobicContact CG2-CD2 4.39Å; T262-A346 HydrophobicContact CG2-CB 3.61Å
263	G	85.6	Confident	91.6	Very high	58 Å²	58	35.5 Å²	35.5	60%	0.598	18%	0.178	S	C	*	.			trans	70.2	6.5	-169.2	0	0	0	0	0	114.6	W259	W259-G263 PolarHBondContact O-N 3.33Å
264	S	88.8	Confident	91.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.156	C	C	.	.			trans	-69.1	136.2	-174.8	156	0	0	0	0	112.9	W259 T262 S266 M267 F268 D424	W259-S264 VanDerWaalsContact CD1-O 3.25Å; T262-S264 PolarHBondContact O-N 3.49Å; T262-S264 PolarHBondContact OG1-N 3.06Å; S264-S266 PolarHBondContact OG-N 2.86Å; S264-M267 WeakPolarHBondContact OG-CB 3.48Å; S264-M267 PolarHBondContact OG-N 3.24Å; S264-F268 WeakPolarHBondContact O-CB 3.41Å; S264-F268 PolarHBondContact O-N 3.25Å; S264-D424 VanDerWaalsContact CA-OD2 3.27Å; S264-D424 WeakPolarHBondContact CA-OD2 3.29Å; S264-D424 WeakPolarHBondContact CB-OD2 3.19Å; S264-D424 VanDerWaalsContact OG-CG 3.22Å; S264-D424 PolarHBondContact OG-OD1 3.03Å; S264-D424 PolarHBondContact OG-OD2 3.07Å; S264-D424 VanDerWaalsContact OG-OD2 3.1Å
265	A	90.1	Very high	91.4	Very high	10 Å²	10	28.7 Å²	28.7	8%	0.083	15%	0.151	C	C	.	.	H	α-helix	trans	-70.1	-37.6	174.3	0	0	0	0	0	112.3	F268 S269 D424 S428	A265-F268 WeakPolarHBondContact O-CB 3.24Å; A265-F268 PolarHBondContact O-N 2.93Å; A265-S269 PolarHBondContact O-N 2.93Å; A265-S269 VanDerWaalsContact O-N 3.09Å; A265-S269 PolarHBondContact O-OG 2.79Å; A265-D424 PolarHBondContact N-OD2 3.29Å; A265-S428 WeakPolarHBondContact O-CB 3.47Å; A265-S428 PolarHBondContact O-OG 3.25Å
266	S	91.2	Very high	91.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-65.5	-42.8	173.3	-54.8	0	0	0	0	111.1	S264 F268 S269 E270 D424 G427 S428	S264-S266 PolarHBondContact OG-N 2.86Å; S266-F268 VanDerWaalsContact C-N 3.31Å; S266-F268 PolarHBondContact O-N 2.79Å; S266-S269 WeakPolarHBondContact O-CB 3.18Å; S266-S269 PolarHBondContact O-N 3.32Å; S266-E270 PolarHBondContact O-N 3.17Å; S266-D424 WeakPolarHBondContact CB-OD1 3.35Å; S266-D424 PolarHBondContact N-OD1 2.86Å; S266-D424 PolarHBondContact OG-O 2.8Å; S266-D424 PolarHBondContact OG-OD1 3.04Å; S266-G427 WeakPolarHBondContact OG-CA 3.42Å; S266-S428 PolarHBondContact OG-N 3.4Å
267	M	93.2	Very high	91	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65	-37.4	178.6	-161.2	65.6	-158	0	0	111.7	K255 A258 W259 S264 E270 A271 A346 I349 L350 M412	K255-M267 HydrophobicContact CB-CE 3.82Å; K255-M267 HydrophobicContact CG-CE 3.81Å; A258-M267 HydrophobicContact CB-CE 3.38Å; A258-M267 HydrophobicContact CB-CG 4.03Å; A258-M267 HydrophobicContact CB-SD 4.2Å; W259-M267 HydrophobicContact CB-CB 4.29Å; W259-M267 HydrophobicContact CB-CG 4Å; S264-M267 WeakPolarHBondContact OG-CB 3.48Å; S264-M267 PolarHBondContact OG-N 3.24Å; M267-E270 PolarHBondContact O-N 3.36Å; M267-A271 WeakPolarHBondContact O-CB 3.11Å; M267-A271 PolarHBondContact O-N 2.88Å; M267-A346 HydrophobicContact SD-CB 4.45Å; M267-I349 HydrophobicContact CE-CG2 4.09Å; M267-L350 HydrophobicContact CE-CD2 3.72Å; M267-L350 HydrophobicContact CE-CG 4.05Å; M267-L350 HydrophobicContact SD-CD1 4.08Å; M267-L350 HydrophobicContact SD-CD2 3.73Å; M267-L350 HydrophobicContact SD-CG 3.86Å; M267-M412 HydrophobicContact CB-SD 4.13Å; M267-M412 HydrophobicContact SD-SD 4.33Å
268	F	93.1	Very high	90.7	Very high	13 Å²	13	24.2 Å²	24.2	6%	0.057	13%	0.134	C	C	.	.	H	α-helix	trans	-58.3	-48	171.4	176.4	-103.3	0	0	0	112	W259 S264 A265 S266 E270 A271 I272 L325 H329	W259-F268 HydrophobicContact CD2-CB 4.37Å; W259-F268 AromaticContact CD2-CD2 3.75Å; W259-F268 HydrophobicContact CD2-CD2 3.75Å; W259-F268 AromaticContact CE2-CD2 3.38Å; W259-F268 HydrophobicContact CE3-CD2 4.22Å; W259-F268 HydrophobicContact CG-CB 4.02Å; W259-F268 HydrophobicContact CG-CD2 4.27Å; W259-F268 AromaticContact CH2-CD2 3.98Å; W259-F268 HydrophobicContact CH2-CD2 3.98Å; W259-F268 HydrophobicContact CH2-CE2 4.03Å; W259-F268 AromaticContact CZ2-CD2 3.49Å; W259-F268 HydrophobicContact CZ2-CD2 3.49Å; W259-F268 VanDerWaalsContact CZ2-CD2 3.49Å; W259-F268 AromaticContact CZ2-CE2 3.88Å; W259-F268 HydrophobicContact CZ2-CE2 3.88Å; W259-F268 HydrophobicContact CZ2-CG 4.5Å; W259-F268 HydrophobicContact CZ3-CD2 4.33Å; W259-F268 AromaticContact NE1-CD2 3.74Å; S264-F268 WeakPolarHBondContact O-CB 3.41Å; S264-F268 PolarHBondContact O-N 3.25Å; A265-F268 WeakPolarHBondContact O-CB 3.24Å; A265-F268 PolarHBondContact O-N 2.93Å; S266-F268 VanDerWaalsContact C-N 3.31Å; S266-F268 PolarHBondContact O-N 2.79Å; F268-E270 VanDerWaalsContact C-N 3.3Å; F268-E270 PolarHBondContact O-N 3.39Å; F268-A271 PolarHBondContact O-N 2.85Å; F268-A271 VanDerWaalsContact O-N 3.16Å; F268-I272 HydrophobicContact CD1-CG1 4.25Å; F268-I272 HydrophobicContact CD2-CG1 4.11Å; F268-I272 HydrophobicContact CE1-CG1 3.73Å; F268-I272 HydrophobicContact CE2-CD1 3.99Å; F268-I272 HydrophobicContact CE2-CG1 3.63Å; F268-I272 HydrophobicContact CG-CG1 4.44Å; F268-I272 HydrophobicContact CZ-CD1 3.95Å; F268-I272 HydrophobicContact CZ-CG1 3.43Å; F268-I272 VanDerWaalsContact CZ-CG1 3.43Å; F268-I272 PolarHBondContact O-N 2.83Å; F268-L325 HydrophobicContact CE1-CB 3.91Å; F268-L325 HydrophobicContact CZ-CB 4.21Å; F268-H329 HydrophobicContact CD1-CB 3.76Å; F268-H329 AromaticContact CD1-CD2 3.46Å; F268-H329 VanDerWaalsContact CD1-CD2 3.46Å; F268-H329 WeakPolarHBondContact CD1-CD2 3.44Å; F268-H329 AromaticContact CD1-CG 3.49Å; F268-H329 VanDerWaalsContact CD1-CG 3.49Å; F268-H329 HydrophobicContact CE1-CB 4.09Å; F268-H329 AromaticContact CE1-CD2 3.05Å; F268-H329 WeakPolarHBondContact CE1-CD2 3.49Å; F268-H329 AromaticContact CE1-CG 3.61Å; F268-H329 AromaticContact CE1-NE2 3.69Å; F268-H329 AromaticContact CE2-NE2 3.96Å; F268-H329 AromaticContact CZ-CD2 3.44Å; F268-H329 VanDerWaalsContact CZ-CD2 3.44Å; F268-H329 WeakPolarHBondContact CZ-CD2 3.43Å; F268-H329 AromaticContact CZ-NE2 3.57Å
269	S	93.8	Very high	90.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.2	-41.7	-179.3	-61.8	0	0	0	0	111.4	A265 S266 I272 H273 S326 S428	A265-S269 PolarHBondContact O-N 2.93Å; A265-S269 VanDerWaalsContact O-N 3.09Å; A265-S269 PolarHBondContact O-OG 2.79Å; S266-S269 WeakPolarHBondContact O-CB 3.18Å; S266-S269 PolarHBondContact O-N 3.32Å; S269-I272 PolarHBondContact O-N 3.43Å; S269-H273 VanDerWaalsContact O-CB 3.3Å; S269-H273 WeakPolarHBondContact O-CB 3.47Å; S269-H273 PolarHBondContact O-N 2.7Å; S269-S326 WeakPolarHBondContact CB-OG 3.29Å; S269-S326 WeakPolarHBondContact OG-CA 3.25Å; S269-S326 VanDerWaalsContact OG-CB 3.25Å; S269-S326 WeakPolarHBondContact OG-CB 3.34Å; S269-S326 PolarHBondContact OG-OG 3.11Å; S269-S428 WeakPolarHBondContact OG-CA 3.5Å; S269-S428 PolarHBondContact OG-OG 2.94Å
270	E	94.3	Very high	90.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-66	-38.1	174.7	-80.5	-57.5	119.3	0	0	113.7	K255 S266 M267 F268 S274 L350 G404 V405 A408	K255-E270 HydrophobicContact CD-CB 4.25Å; K255-E270 IonicContact NZ-OE2 2.77Å; K255-E270 PolarHBondContact NZ-OE2 3.31Å; K255-E270 VanDerWaalsContact NZ-OE2 3.07Å; S266-E270 PolarHBondContact O-N 3.17Å; M267-E270 PolarHBondContact O-N 3.36Å; F268-E270 VanDerWaalsContact C-N 3.3Å; F268-E270 PolarHBondContact O-N 3.39Å; E270-S274 WeakPolarHBondContact O-CB 3.41Å; E270-S274 PolarHBondContact O-N 3.46Å; E270-S274 VanDerWaalsContact O-N 3.07Å; E270-S274 PolarHBondContact O-OG 2.87Å; E270-L350 HydrophobicContact CG-CD2 4.43Å; E270-G404 VanDerWaalsContact CD-C 3.46Å; E270-G404 WeakPolarHBondContact OE1-CA 3.34Å; E270-V405 PolarHBondContact OE1-N 3.36Å; E270-V405 WeakPolarHBondContact OE2-CG2 3.22Å; E270-A408 HydrophobicContact CG-CB 3.57Å
271	A	94	Very high	90	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.008	13%	0.127	C	C	.	.	H	α-helix	trans	-66.5	-46	175.6	0	0	0	0	0	111.6	K255 F256 W259 M267 F268 H273 S274 L275	K255-A271 HydrophobicContact CB-CB 4.16Å; F256-A271 HydrophobicContact CB-CB 4.4Å; F256-A271 HydrophobicContact CD2-CB 4.39Å; W259-A271 HydrophobicContact CB-CB 4.47Å; M267-A271 WeakPolarHBondContact O-CB 3.11Å; M267-A271 PolarHBondContact O-N 2.88Å; F268-A271 PolarHBondContact O-N 2.85Å; F268-A271 VanDerWaalsContact O-N 3.16Å; A271-H273 VanDerWaalsContact C-N 3.35Å; A271-S274 PolarHBondContact O-N 3.23Å; A271-L275 WeakPolarHBondContact O-CB 3.4Å; A271-L275 PolarHBondContact O-N 2.97Å
272	I	93.6	Very high	89.9	Confident	12 Å²	12	17.9 Å²	17.9	6%	0.062	12%	0.124	C	C	.	.	H	α-helix	trans	-67.6	-35.5	177.3	-69.6	-62.1	0	0	0	111.8	F268 S269 L275 S276 M321 L325	F268-I272 HydrophobicContact CD1-CG1 4.25Å; F268-I272 HydrophobicContact CD2-CG1 4.11Å; F268-I272 HydrophobicContact CE1-CG1 3.73Å; F268-I272 HydrophobicContact CE2-CD1 3.99Å; F268-I272 HydrophobicContact CE2-CG1 3.63Å; F268-I272 HydrophobicContact CG-CG1 4.44Å; F268-I272 HydrophobicContact CZ-CD1 3.95Å; F268-I272 HydrophobicContact CZ-CG1 3.43Å; F268-I272 VanDerWaalsContact CZ-CG1 3.43Å; F268-I272 PolarHBondContact O-N 2.83Å; S269-I272 PolarHBondContact O-N 3.43Å; I272-L275 HydrophobicContact CD1-CD2 4.29Å; I272-L275 PolarHBondContact O-N 3.17Å; I272-S276 WeakPolarHBondContact O-CB 3.37Å; I272-S276 PolarHBondContact O-N 2.95Å; I272-S276 PolarHBondContact O-OG 2.9Å; I272-M321 HydrophobicContact CD1-CE 4.2Å; I272-M321 HydrophobicContact CG2-CG 4.04Å; I272-M321 VanDerWaalsContact CG2-O 3.23Å; I272-M321 WeakPolarHBondContact CG2-O 3.37Å; I272-L325 HydrophobicContact CD1-CD1 4.22Å; I272-L325 HydrophobicContact CG1-CD1 4.49Å; I272-L325 HydrophobicContact CG2-CB 4.46Å; I272-L325 HydrophobicContact CG2-CD1 4.2Å
273	H	92	Very high	89.8	Confident	8 Å²	8	21 Å²	21	4%	0.037	14%	0.14	C	C	.	.	H	α-helix	trans	-57.2	-53.4	171.8	178.8	53.4	0	0	0	111	S269 A271 L275 S276 D277 A401 L435	S269-H273 VanDerWaalsContact O-CB 3.3Å; S269-H273 WeakPolarHBondContact O-CB 3.47Å; S269-H273 PolarHBondContact O-N 2.7Å; A271-H273 VanDerWaalsContact C-N 3.35Å; H273-L275 VanDerWaalsContact C-N 3.28Å; H273-L275 PolarHBondContact O-N 3.4Å; H273-S276 WeakPolarHBondContact O-CB 3.34Å; H273-S276 PolarHBondContact O-N 2.85Å; H273-S276 VanDerWaalsContact O-N 3.1Å; H273-D277 PolarHBondContact O-N 2.69Å; H273-A401 VanDerWaalsContact NE2-CA 3.32Å; H273-A401 WeakPolarHBondContact NE2-CA 3.46Å; H273-A401 WeakPolarHBondContact NE2-CB 3.39Å; H273-A401 PolarHBondContact NE2-N 3Å; H273-L435 HydrophobicContact CB-CD1 3.96Å; H273-L435 WeakPolarHBondContact CE1-CD2 3.34Å; H273-L435 WeakPolarHBondContact ND1-CD2 3.29Å
274	S	91.4	Very high	89.7	Confident	6 Å²	6	18.8 Å²	18.8	4%	0.042	12%	0.115	C	C	.	.	H	α-helix	trans	-65.4	-32.7	-178.2	-51.9	0	0	0	0	112.4	K255 E270 A271 T278	K255-S274 WeakPolarHBondContact CD-OG 3.48Å; K255-S274 PolarHBondContact NZ-OG 3.13Å; E270-S274 WeakPolarHBondContact O-CB 3.41Å; E270-S274 PolarHBondContact O-N 3.46Å; E270-S274 VanDerWaalsContact O-N 3.07Å; E270-S274 PolarHBondContact O-OG 2.87Å; A271-S274 PolarHBondContact O-N 3.23Å; S274-T278 WeakPolarHBondContact O-CB 3.37Å; S274-T278 PolarHBondContact O-N 3.04Å; S274-T278 PolarHBondContact O-OG1 3.48Å
275	L	92	Very high	89.4	Confident	57 Å²	57	21.1 Å²	21.1	30%	0.298	13%	0.134	S	C	.	.	H	α-helix	trans	-67.4	-42.9	172.6	179.4	57	0	0	0	111.7	C252 A271 I272 H273 D277 T278 C279 M321	C252-L275 WeakPolarHBondContact SG-CA 3.31Å; C252-L275 PolarHBondContact SG-N 3.44Å; C252-L275 VanDerWaalsContact SG-N 3.42Å; A271-L275 WeakPolarHBondContact O-CB 3.4Å; A271-L275 PolarHBondContact O-N 2.97Å; I272-L275 HydrophobicContact CD1-CD2 4.29Å; I272-L275 PolarHBondContact O-N 3.17Å; H273-L275 VanDerWaalsContact C-N 3.28Å; H273-L275 PolarHBondContact O-N 3.4Å; L275-D277 VanDerWaalsContact C-N 3.33Å; L275-T278 PolarHBondContact O-N 3.34Å; L275-C279 PolarHBondContact O-N 3.16Å; L275-C279 PolarHBondContact O-SG 3.19Å; L275-M321 HydrophobicContact CB-CE 4.49Å; L275-M321 HydrophobicContact CD2-CE 3.33Å; L275-M321 HydrophobicContact CG-CE 3.73Å
276	S	90.8	Very high	89.1	Confident	6 Å²	6	25.5 Å²	25.5	4%	0.042	16%	0.156	C	C	.	.	H	α-helix	trans	-63.8	-41.4	176.6	-58.7	0	0	0	0	110.7	I272 H273 C279 N280	I272-S276 WeakPolarHBondContact O-CB 3.37Å; I272-S276 PolarHBondContact O-N 2.95Å; I272-S276 PolarHBondContact O-OG 2.9Å; H273-S276 WeakPolarHBondContact O-CB 3.34Å; H273-S276 PolarHBondContact O-N 2.85Å; H273-S276 VanDerWaalsContact O-N 3.1Å; S276-C279 PolarHBondContact O-N 2.8Å; S276-N280 VanDerWaalsContact O-CB 3.29Å; S276-N280 WeakPolarHBondContact O-CB 3.36Å; S276-N280 PolarHBondContact O-N 3.35Å
277	D	86.4	Confident	88.9	Confident	17 Å²	17	25.7 Å²	25.7	9%	0.091	16%	0.157	C	C	.	.	H	α-helix	trans	-65	-43	176.3	-177	51.9	0	0	0	112.4	H273 L275 C279 N280 Q281	H273-D277 PolarHBondContact O-N 2.69Å; L275-D277 VanDerWaalsContact C-N 3.33Å; D277-C279 VanDerWaalsContact C-N 3.32Å; D277-C279 PolarHBondContact O-N 2.99Å; D277-N280 WeakPolarHBondContact O-CB 3.38Å; D277-N280 PolarHBondContact O-N 3.47Å; D277-N280 VanDerWaalsContact O-N 3.16Å; D277-Q281 WeakPolarHBondContact O-CG 3.36Å; D277-Q281 PolarHBondContact O-N 3.39Å; D277-Q281 PolarHBondContact OD2-NE2 2.84Å
278	T	86.5	Confident	88.5	Confident	41 Å²	41	29 Å²	29	25%	0.252	17%	0.174	S	C	.	.	H	α-helix	trans	-60.3	-42.9	174.8	-57.6	0	0	0	0	111.4	S274 L275 G282	S274-T278 WeakPolarHBondContact O-CB 3.37Å; S274-T278 PolarHBondContact O-N 3.04Å; S274-T278 PolarHBondContact O-OG1 3.48Å; L275-T278 PolarHBondContact O-N 3.34Å; T278-G282 PolarHBondContact O-N 3.44Å
279	C	87.3	Confident	88	Confident	66 Å²	66	37 Å²	37	45%	0.446	20%	0.204	S	C	.	.	H	α-helix	trans	-64	-43.1	174.6	-68.4	0	0	0	0	112	L275 S276 D277 G282 L283	L275-C279 PolarHBondContact O-N 3.16Å; L275-C279 PolarHBondContact O-SG 3.19Å; S276-C279 PolarHBondContact O-N 2.8Å; D277-C279 VanDerWaalsContact C-N 3.32Å; D277-C279 PolarHBondContact O-N 2.99Å; C279-G282 PolarHBondContact O-N 3.25Å; C279-L283 PolarHBondContact O-N 2.56Å
280	N	87.5	Confident	87.5	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-57.9	-48.1	177.6	164.6	53.5	0	0	0	111.8	S276 D277 G282 L283 L284 S314 E397	S276-N280 VanDerWaalsContact O-CB 3.29Å; S276-N280 WeakPolarHBondContact O-CB 3.36Å; S276-N280 PolarHBondContact O-N 3.35Å; D277-N280 WeakPolarHBondContact O-CB 3.38Å; D277-N280 PolarHBondContact O-N 3.47Å; D277-N280 VanDerWaalsContact O-N 3.16Å; N280-G282 PolarHBondContact O-N 2.93Å; N280-L283 CarbonylContact O-C 3.53Å; N280-L283 WeakPolarHBondContact O-CB 3.31Å; N280-L283 PolarHBondContact O-N 3.48Å; N280-L284 WeakPolarHBondContact O-CG 3.4Å; N280-L284 PolarHBondContact O-N 2.87Å; N280-L284 VanDerWaalsContact OD1-CD1 3.25Å; N280-L284 WeakPolarHBondContact OD1-CD1 3.45Å; N280-L284 WeakPolarHBondContact OD1-CG 3.48Å; N280-S314 WeakPolarHBondContact CB-OG 3.09Å; N280-S314 WeakPolarHBondContact OD1-CB 3.15Å; N280-S314 PolarHBondContact OD1-OG 3.28Å; N280-E397 PolarHBondContact ND2-OE1 3.32Å; N280-E397 PolarHBondContact ND2-OE2 3.44Å
281	Q	84.1	Confident	87	Confident	39 Å²	39	41.7 Å²	41.7	18%	0.182	23%	0.225	C	C	.	.	H	α-helix	trans	-57.6	-39.7	178.2	-72.8	166.7	14.8	0	0	112	N248 D277 A285	N248-Q281 PolarHBondContact ND2-NE2 2.94Å; D277-Q281 WeakPolarHBondContact O-CG 3.36Å; D277-Q281 PolarHBondContact O-N 3.39Å; D277-Q281 PolarHBondContact OD2-NE2 2.84Å; Q281-A285 VanDerWaalsContact O-CB 3.25Å; Q281-A285 WeakPolarHBondContact O-CB 3.43Å; Q281-A285 PolarHBondContact O-N 3.27Å
282	G	83.6	Confident	86.5	Confident	37 Å²	37	46.7 Å²	46.7	38%	0.381	26%	0.255	S	S	.	.	H	α-helix	trans	-62.5	-46.6	172.7	0	0	0	0	0	112.9	T278 C279 N280 A285 L286	T278-G282 PolarHBondContact O-N 3.44Å; C279-G282 PolarHBondContact O-N 3.25Å; N280-G282 PolarHBondContact O-N 2.93Å; G282-A285 PolarHBondContact O-N 2.98Å; G282-L286 WeakPolarHBondContact O-CG 3.19Å; G282-L286 PolarHBondContact O-N 2.84Å; G282-L286 VanDerWaalsContact O-N 3.07Å
283	L	86.9	Confident	86	Confident	69 Å²	69	49.8 Å²	49.8	36%	0.361	27%	0.269	S	S	.	.	H	α-helix	trans	-63.7	-45.7	178.1	-72.5	174.4	0	0	0	112.4	C279 N280 L286 G287 I313	C279-L283 PolarHBondContact O-N 2.56Å; N280-L283 CarbonylContact O-C 3.53Å; N280-L283 WeakPolarHBondContact O-CB 3.31Å; N280-L283 PolarHBondContact O-N 3.48Å; L283-L286 PolarHBondContact O-N 3.42Å; L283-G287 PolarHBondContact O-N 3.11Å; L283-I313 HydrophobicContact CD1-CG2 4.22Å
284	L	83.6	Confident	85.4	Confident	11 Å²	11	54.6 Å²	54.6	6%	0.058	30%	0.3	C	S	.	.	H	α-helix	trans	-63.2	-42	177	-71.3	177.3	0	0	0	111.4	N280 L286 G287 I288 V393	N280-L284 WeakPolarHBondContact O-CG 3.4Å; N280-L284 PolarHBondContact O-N 2.87Å; N280-L284 VanDerWaalsContact OD1-CD1 3.25Å; N280-L284 WeakPolarHBondContact OD1-CD1 3.45Å; N280-L284 WeakPolarHBondContact OD1-CG 3.48Å; L284-L286 VanDerWaalsContact C-N 3.33Å; L284-L286 PolarHBondContact O-N 3.26Å; L284-G287 PolarHBondContact O-N 3.38Å; L284-I288 WeakPolarHBondContact O-CB 3.46Å; L284-I288 VanDerWaalsContact O-CG1 3.29Å; L284-I288 WeakPolarHBondContact O-CG1 3.43Å; L284-I288 PolarHBondContact O-N 2.81Å; L284-V393 HydrophobicContact CD1-CG1 4.14Å
285	A	81.9	Confident	85.1	Confident	49 Å²	49	57.6 Å²	57.6	41%	0.405	32%	0.319	S	S	.	.	H	α-helix	trans	-60.7	-42.2	176	0	0	0	0	0	111.9	Q281 G282 R289	Q281-A285 VanDerWaalsContact O-CB 3.25Å; Q281-A285 WeakPolarHBondContact O-CB 3.43Å; Q281-A285 PolarHBondContact O-N 3.27Å; G282-A285 PolarHBondContact O-N 2.98Å; A285-R289 WeakPolarHBondContact O-CB 3.24Å; A285-R289 PolarHBondContact O-N 2.82Å
286	L	84.8	Confident	84.8	Confident	103 Å²	103	57.2 Å²	57.2	54%	0.539	32%	0.317	S	S	.	.	H	α-helix	trans	-64.5	-42.9	173.7	-71	174.2	0	0	0	111.8	G282 L283 L284 R289 K290	G282-L286 WeakPolarHBondContact O-CG 3.19Å; G282-L286 PolarHBondContact O-N 2.84Å; G282-L286 VanDerWaalsContact O-N 3.07Å; L283-L286 PolarHBondContact O-N 3.42Å; L284-L286 VanDerWaalsContact C-N 3.33Å; L284-L286 PolarHBondContact O-N 3.26Å; L286-R289 PolarHBondContact O-N 3.15Å; L286-K290 WeakPolarHBondContact O-CB 3.46Å; L286-K290 WeakPolarHBondContact O-CG 3.29Å; L286-K290 PolarHBondContact O-N 3.37Å
287	G	86.5	Confident	84.5	Confident	3 Å²	3	63.6 Å²	63.6	3%	0.031	36%	0.359	C	S	.	.	H	α-helix	trans	-61.4	-47.3	177.3	0	0	0	0	0	113	L283 L284 K290 S291 S310	L283-G287 PolarHBondContact O-N 3.11Å; L284-G287 PolarHBondContact O-N 3.38Å; G287-K290 PolarHBondContact O-N 3.41Å; G287-S291 WeakPolarHBondContact O-CB 3.42Å; G287-S291 PolarHBondContact O-N 3.07Å; G287-S310 WeakPolarHBondContact CA-OG 3.41Å
288	I	83.6	Confident	84.3	Confident	71 Å²	71	67 Å²	67	36%	0.364	38%	0.383	S	S	.	.	H	α-helix	trans	-60.2	-50.2	175.2	-69.2	166.8	0	0	0	109.9	L284 K290 S291 V292 R307	L284-I288 WeakPolarHBondContact O-CB 3.46Å; L284-I288 VanDerWaalsContact O-CG1 3.29Å; L284-I288 WeakPolarHBondContact O-CG1 3.43Å; L284-I288 PolarHBondContact O-N 2.81Å; I288-K290 PolarHBondContact O-N 3.2Å; I288-S291 WeakPolarHBondContact CA-OG 3.41Å; I288-S291 PolarHBondContact O-N 2.96Å; I288-S291 PolarHBondContact O-OG 3.19Å; I288-V292 PolarHBondContact O-N 3.33Å; I288-R307 HydrophobicContact CG1-CG 4.26Å
289	R	82.8	Confident	84.3	Confident	179 Å²	179	69.2 Å²	69.2	68%	0.675	39%	0.391	S	S	*	.	H	α-helix	trans	-56.9	-40.8	179	-178.8	-178.2	132.9	174.7	-3.9	111.9	A285 L286	A285-R289 WeakPolarHBondContact O-CB 3.24Å; A285-R289 PolarHBondContact O-N 2.82Å; L286-R289 PolarHBondContact O-N 3.15Å
290	K	84.4	Confident	84.1	Confident	94 Å²	94	70.2 Å²	70.2	41%	0.409	40%	0.397	S	S	.	.	H	α-helix	trans	-73.8	-31.4	176.6	-77.4	-71.7	-172.9	173.3	0	112.8	L286 G287 I288 V292 Q293 F303 M306	L286-K290 WeakPolarHBondContact O-CB 3.46Å; L286-K290 WeakPolarHBondContact O-CG 3.29Å; L286-K290 PolarHBondContact O-N 3.37Å; G287-K290 PolarHBondContact O-N 3.41Å; I288-K290 PolarHBondContact O-N 3.2Å; K290-V292 VanDerWaalsContact C-N 3.27Å; K290-V292 PolarHBondContact O-N 3.25Å; K290-Q293 WeakPolarHBondContact O-CB 3.13Å; K290-Q293 PolarHBondContact O-N 3.36Å; K290-Q293 VanDerWaalsContact O-N 3.12Å; K290-F303 VanDerWaalsContact O-CB 3.26Å; K290-F303 WeakPolarHBondContact O-CB 3.36Å; K290-M306 HydrophobicContact CB-CB 4.2Å; K290-M306 HydrophobicContact CB-CE 4.46Å; K290-M306 HydrophobicContact CB-CG 3.58Å; K290-M306 HydrophobicContact CG-CG 4.49Å
291	S	83.6	Confident	83.9	Confident	6 Å²	6	75.1 Å²	75.1	4%	0.042	42%	0.416	C	S	.	.	H	α-helix	trans	-67	-27.1	-179.2	75	0	0	0	0	114.4	G287 I288 Q293 F303	G287-S291 WeakPolarHBondContact O-CB 3.42Å; G287-S291 PolarHBondContact O-N 3.07Å; I288-S291 WeakPolarHBondContact CA-OG 3.41Å; I288-S291 PolarHBondContact O-N 2.96Å; I288-S291 PolarHBondContact O-OG 3.19Å; S291-Q293 VanDerWaalsContact C-N 3.26Å; S291-F303 VanDerWaalsContact CA-O 3.28Å; S291-F303 WeakPolarHBondContact CA-O 3.46Å
292	V	82.4	Confident	84	Confident	106 Å²	106	74 Å²	74	64%	0.642	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-4.7	177.4	-176.1	0	0	0	0	111.8	I288 K290 T294	I288-V292 PolarHBondContact O-N 3.33Å; K290-V292 VanDerWaalsContact C-N 3.27Å; K290-V292 PolarHBondContact O-N 3.25Å; V292-T294 PolarHBondContact O-N 3.4Å
293	Q	83.1	Confident	84.2	Confident	76 Å²	76	73.6 Å²	73.6	36%	0.355	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-62	137.2	178.4	-171.7	173.9	-17.3	0	0	111.2	K290 S291 F303	K290-Q293 WeakPolarHBondContact O-CB 3.13Å; K290-Q293 PolarHBondContact O-N 3.36Å; K290-Q293 VanDerWaalsContact O-N 3.12Å; S291-Q293 VanDerWaalsContact C-N 3.26Å; Q293-F303 HydrophobicContact CB-CB 4.33Å; Q293-F303 HydrophobicContact CB-CD2 3.92Å; Q293-F303 HydrophobicContact CB-CG 4.33Å; Q293-F303 HydrophobicContact CG-CD2 3.97Å; Q293-F303 HydrophobicContact CG-CE2 4.25Å
294	T	81.2	Confident	84	Confident	110 Å²	110	71 Å²	71	68%	0.675	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-64.9	149.2	178.9	51.8	0	0	0	0	111.6	V292	V292-T294 PolarHBondContact O-N 3.4Å
295	P	85	Confident	84.2	Confident	69 Å²	69	73.6 Å²	73.6	45%	0.448	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-54.6	148.5	174.4	-23.7	33.2	0	0	0	113.4	P300	P295-P300 WeakPolarHBondContact CB-O 3.34Å
296	D	85.6	Confident	84.5	Confident	49 Å²	49	74.2 Å²	74.2	26%	0.262	40%	0.4	S	S	.	.	B	Isolated β-bridge	trans	-129.4	167.9	173.2	69.7	35.7	0	0	0	109.8	S298 H299 F303	D296-S298 PolarHBondContact O-N 3.26Å; D296-S298 VanDerWaalsContact O-N 3.09Å; D296-S298 WeakPolarHBondContact OD1-CA 2.78Å; D296-S298 WeakPolarHBondContact OD1-CB 3.3Å; D296-S298 PolarHBondContact OD1-N 3Å; D296-S298 PolarHBondContact OD1-OG 3.38Å; D296-H299 PolarHBondContact N-O 3.33Å; D296-H299 CarbonylContact O-C 3.49Å; D296-H299 PolarHBondContact O-N 3.37Å; D296-H299 VanDerWaalsContact O-O 3.08Å; D296-H299 IonicContact OD1-CG 2.97Å; D296-H299 PolarHBondContact OD1-N 3.35Å; D296-H299 IonicContact OD1-ND1 3.07Å; D296-H299 PolarHBondContact OD1-ND1 3.43Å; D296-H299 IonicContact OD2-ND1 3.68Å; D296-F303 WeakPolarHBondContact OD2-CE2 3.15Å; D296-F303 VanDerWaalsContact OD2-CZ 3.28Å; D296-F303 WeakPolarHBondContact OD2-CZ 3.41Å
297	P	83.6	Confident	84.5	Confident	140 Å²	140	71.2 Å²	71.2	91%	0.909	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-21.5	-178.6	-26.8	36	0	0	0	114.8
298	S	82.4	Confident	84.6	Confident	87 Å²	87	71.8 Å²	71.8	61%	0.608	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-23	174.8	58.9	0	0	0	0	113.2	D296	D296-S298 PolarHBondContact O-N 3.26Å; D296-S298 VanDerWaalsContact O-N 3.09Å; D296-S298 WeakPolarHBondContact OD1-CA 2.78Å; D296-S298 WeakPolarHBondContact OD1-CB 3.3Å; D296-S298 PolarHBondContact OD1-N 3Å; D296-S298 PolarHBondContact OD1-OG 3.38Å
299	H	85.9	Confident	84.9	Confident	88 Å²	88	71.8 Å²	71.8	41%	0.407	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-132.8	76.1	179.1	-56.7	85.6	0	0	0	109.2	D296 Y301 G302 F303	D296-H299 PolarHBondContact N-O 3.33Å; D296-H299 CarbonylContact O-C 3.49Å; D296-H299 PolarHBondContact O-N 3.37Å; D296-H299 VanDerWaalsContact O-O 3.08Å; D296-H299 IonicContact OD1-CG 2.97Å; D296-H299 PolarHBondContact OD1-N 3.35Å; D296-H299 IonicContact OD1-ND1 3.07Å; D296-H299 PolarHBondContact OD1-ND1 3.43Å; D296-H299 IonicContact OD2-ND1 3.68Å; H299-Y301 PolarHBondContact O-N 3.44Å; H299-G302 PolarHBondContact O-N 2.86Å; H299-F303 HydrophobicContact CB-CE1 4.23Å; H299-F303 HydrophobicContact CB-CE2 4.06Å; H299-F303 HydrophobicContact CB-CZ 3.86Å; H299-F303 AromaticContact CD2-CE1 3.9Å; H299-F303 AromaticContact CE1-CE1 3.78Å; H299-F303 AromaticContact CE1-CZ 3.91Å; H299-F303 AromaticContact CG-CE1 3.64Å; H299-F303 AromaticContact CG-CZ 3.55Å; H299-F303 AromaticContact ND1-CE1 3.56Å; H299-F303 AromaticContact ND1-CZ 3.28Å; H299-F303 VanDerWaalsContact ND1-CZ 3.28Å; H299-F303 WeakPolarHBondContact ND1-CZ 3.44Å; H299-F303 AromaticContact NE2-CE1 3.97Å
300	P	84.6	Confident	85.2	Confident	88 Å²	88	63.7 Å²	63.7	57%	0.571	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-25.4	-172.1	24.1	-34.3	0	0	0	113.5	P295	P295-P300 WeakPolarHBondContact CB-O 3.34Å
301	Y	82.5	Confident	85.3	Confident	103 Å²	103	59.2 Å²	59.2	40%	0.404	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-1.9	175.1	-61.8	-71.2	0	0	0	113.4	H299 R490 H563	H299-Y301 PolarHBondContact O-N 3.44Å; Y301-R490 VanDerWaalsContact OH-CZ 3.3Å; Y301-R490 PolarHBondContact OH-NH1 2.74Å; Y301-R490 PolarHBondContact OH-NH2 3.13Å; Y301-H563 AromaticContact CD1-CE1 3.85Å; Y301-H563 AromaticContact CD1-NE2 3.82Å; Y301-H563 AromaticContact CE1-ND1 3.91Å
302	G	86.2	Confident	85.7	Confident	17 Å²	17	61 Å²	61	18%	0.175	34%	0.342	C	S	.	.			trans	84.2	-162.4	-177.8	0	0	0	0	0	114.2	H299	H299-G302 PolarHBondContact O-N 2.86Å
303	F	86.7	Confident	86.2	Confident	28 Å²	28	60.5 Å²	60.5	12%	0.123	34%	0.335	C	S	.	.	S	Bend	trans	-113.7	15.1	-168.5	-69.2	-86.6	0	0	0	113.9	K290 S291 Q293 D296 H299 N305 M306	K290-F303 VanDerWaalsContact O-CB 3.26Å; K290-F303 WeakPolarHBondContact O-CB 3.36Å; S291-F303 VanDerWaalsContact CA-O 3.28Å; S291-F303 WeakPolarHBondContact CA-O 3.46Å; Q293-F303 HydrophobicContact CB-CB 4.33Å; Q293-F303 HydrophobicContact CB-CD2 3.92Å; Q293-F303 HydrophobicContact CB-CG 4.33Å; Q293-F303 HydrophobicContact CG-CD2 3.97Å; Q293-F303 HydrophobicContact CG-CE2 4.25Å; D296-F303 WeakPolarHBondContact OD2-CE2 3.15Å; D296-F303 VanDerWaalsContact OD2-CZ 3.28Å; D296-F303 WeakPolarHBondContact OD2-CZ 3.41Å; H299-F303 HydrophobicContact CB-CE1 4.23Å; H299-F303 HydrophobicContact CB-CE2 4.06Å; H299-F303 HydrophobicContact CB-CZ 3.86Å; H299-F303 AromaticContact CD2-CE1 3.9Å; H299-F303 AromaticContact CE1-CE1 3.78Å; H299-F303 AromaticContact CE1-CZ 3.91Å; H299-F303 AromaticContact CG-CE1 3.64Å; H299-F303 AromaticContact CG-CZ 3.55Å; H299-F303 AromaticContact ND1-CE1 3.56Å; H299-F303 AromaticContact ND1-CZ 3.28Å; H299-F303 VanDerWaalsContact ND1-CZ 3.28Å; H299-F303 WeakPolarHBondContact ND1-CZ 3.44Å; H299-F303 AromaticContact NE2-CE1 3.97Å; F303-N305 PolarHBondContact O-N 3.38Å; F303-N305 VanDerWaalsContact O-N 3.07Å; F303-M306 WeakPolarHBondContact O-CB 3.4Å; F303-M306 PolarHBondContact O-N 2.99Å
304	S	84.8	Confident	86.5	Confident	13 Å²	13	57 Å²	57	9%	0.091	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-39.9	-175.9	51.3	0	0	0	0	112.9	M306 R307 L484	S304-M306 PolarHBondContact O-N 3.46Å; S304-M306 VanDerWaalsContact O-N 3.1Å; S304-R307 PolarHBondContact O-N 3.43Å; S304-L484 VanDerWaalsContact CB-O 3.29Å; S304-L484 WeakPolarHBondContact CB-O 3.48Å; S304-L484 PolarHBondContact OG-O 3.34Å
305	N	87.2	Confident	87	Confident	66 Å²	66	51.8 Å²	51.8	35%	0.353	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-17.7	178.6	-68.8	-10.1	0	0	0	114.5	F303 R307 Y308 I309 L450	F303-N305 PolarHBondContact O-N 3.38Å; F303-N305 VanDerWaalsContact O-N 3.07Å; N305-R307 PolarHBondContact O-N 2.74Å; N305-R307 VanDerWaalsContact O-N 3.16Å; N305-Y308 HydrophobicContact CB-CD2 4.37Å; N305-Y308 PolarHBondContact O-N 2.95Å; N305-I309 WeakPolarHBondContact O-CG1 3.47Å; N305-I309 PolarHBondContact O-N 2.99Å; N305-L450 HydrophobicContact CB-CD2 4.25Å
306	M	88.1	Confident	87.4	Confident	62 Å²	62	51.8 Å²	51.8	31%	0.305	29%	0.286	S	S	.	.	H	α-helix	trans	-59.4	-29	178.5	-169.3	66.6	85.8	0	0	112.3	K290 F303 S304 I309 S310	K290-M306 HydrophobicContact CB-CB 4.2Å; K290-M306 HydrophobicContact CB-CE 4.46Å; K290-M306 HydrophobicContact CB-CG 3.58Å; K290-M306 HydrophobicContact CG-CG 4.49Å; F303-M306 WeakPolarHBondContact O-CB 3.4Å; F303-M306 PolarHBondContact O-N 2.99Å; S304-M306 PolarHBondContact O-N 3.46Å; S304-M306 VanDerWaalsContact O-N 3.1Å; M306-I309 PolarHBondContact O-N 3.28Å; M306-I309 HydrophobicContact SD-CB 4.38Å; M306-I309 HydrophobicContact SD-CD1 4.45Å; M306-I309 HydrophobicContact SD-CG2 4.48Å; M306-S310 WeakPolarHBondContact O-CB 3.27Å; M306-S310 PolarHBondContact O-N 3.48Å; M306-S310 PolarHBondContact O-OG 2.93Å
307	R	85.3	Confident	87.8	Confident	40 Å²	40	51 Å²	51	15%	0.151	29%	0.29	C	S	.	.	H	α-helix	trans	-61.1	-48	173.9	-168.9	176.6	-169.5	-174.6	0.7	110.9	I288 S304 N305 S310 S311 D388 S390	I288-R307 HydrophobicContact CG1-CG 4.26Å; S304-R307 PolarHBondContact O-N 3.43Å; N305-R307 PolarHBondContact O-N 2.74Å; N305-R307 VanDerWaalsContact O-N 3.16Å; R307-S310 PolarHBondContact O-N 3.21Å; R307-S310 PolarHBondContact O-OG 2.81Å; R307-S311 WeakPolarHBondContact O-CB 3.37Å; R307-S311 PolarHBondContact O-N 3.46Å; R307-D388 VanDerWaalsContact CZ-CG 3.47Å; R307-D388 IonicContact CZ-OD1 3.51Å; R307-D388 IonicContact CZ-OD2 3.04Å; R307-D388 IonicContact NE-OD1 2.78Å; R307-D388 IonicContact NH1-OD1 2.67Å; R307-D388 PolarHBondContact NH1-OD1 2.69Å; R307-D388 IonicContact NH1-OD2 3.8Å; R307-D388 PolarHBondContact NH1-OD2 3.01Å; R307-D388 VanDerWaalsContact NH2-CG 3.3Å; R307-D388 IonicContact NH2-OD1 3.25Å; R307-D388 PolarHBondContact NH2-OD1 3.41Å; R307-D388 IonicContact NH2-OD2 3.75Å; R307-D388 PolarHBondContact NH2-OD2 3.12Å; R307-S390 WeakPolarHBondContact CG-OG 3.41Å; R307-S390 PolarHBondContact NE-OG 2.99Å
308	Y	86.9	Confident	88.2	Confident	15 Å²	15	44.8 Å²	44.8	6%	0.059	25%	0.249	C	C	.	.	H	α-helix	trans	-66.8	-39.5	177.4	-48.8	-50.7	0	0	0	112	N305 S311 L312 P389 A449 L450 G485	N305-Y308 HydrophobicContact CB-CD2 4.37Å; N305-Y308 PolarHBondContact O-N 2.95Å; Y308-S311 PolarHBondContact O-N 2.93Å; Y308-L312 WeakPolarHBondContact O-CB 3.46Å; Y308-L312 PolarHBondContact O-N 3.46Å; Y308-P389 HydrophobicContact CD1-CG 3.36Å; Y308-P389 HydrophobicContact CE1-CG 3.2Å; Y308-A449 HydrophobicContact CD1-CB 3.84Å; Y308-A449 HydrophobicContact CD2-CB 4.28Å; Y308-A449 HydrophobicContact CE1-CB 4.04Å; Y308-A449 HydrophobicContact CE2-CB 4.46Å; Y308-A449 HydrophobicContact CG-CB 3.98Å; Y308-L450 HydrophobicContact CD2-CD2 4.45Å; Y308-G485 WeakPolarHBondContact OH-CA 3.38Å
309	I	90.6	Very high	88.8	Confident	72 Å²	72	43.7 Å²	43.7	37%	0.369	23%	0.233	S	C	.	.	H	α-helix	trans	-60.4	-48.8	175.2	-62.5	176.8	0	0	0	110.5	N305 M306 S311 L312 I313 L450	N305-I309 WeakPolarHBondContact O-CG1 3.47Å; N305-I309 PolarHBondContact O-N 2.99Å; M306-I309 PolarHBondContact O-N 3.28Å; M306-I309 HydrophobicContact SD-CB 4.38Å; M306-I309 HydrophobicContact SD-CD1 4.45Å; M306-I309 HydrophobicContact SD-CG2 4.48Å; I309-S311 VanDerWaalsContact C-N 3.33Å; I309-S311 PolarHBondContact O-N 3.39Å; I309-L312 PolarHBondContact O-N 3.21Å; I309-I313 HydrophobicContact CG2-CD1 3.95Å; I309-I313 WeakPolarHBondContact O-CG1 3.07Å; I309-I313 PolarHBondContact O-N 3.38Å; I309-L450 HydrophobicContact CG1-CD1 4.36Å; I309-L450 HydrophobicContact CG1-CD2 3.64Å
310	S	89.5	Confident	89.2	Confident	9 Å²	9	45 Å²	45	6%	0.063	24%	0.241	C	C	.	.	H	α-helix	trans	-63.2	-39.5	179.8	65.2	0	0	0	0	112.6	G287 M306 R307 I313 S314	G287-S310 WeakPolarHBondContact CA-OG 3.41Å; M306-S310 WeakPolarHBondContact O-CB 3.27Å; M306-S310 PolarHBondContact O-N 3.48Å; M306-S310 PolarHBondContact O-OG 2.93Å; R307-S310 PolarHBondContact O-N 3.21Å; R307-S310 PolarHBondContact O-OG 2.81Å; S310-I313 PolarHBondContact O-N 3.19Å; S310-S314 PolarHBondContact O-N 3.27Å
311	S	87	Confident	89.5	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-70.3	-35.3	177.5	-173	0	0	0	0	112.1	R307 Y308 I309 S314 G315 V393 N446	R307-S311 WeakPolarHBondContact O-CB 3.37Å; R307-S311 PolarHBondContact O-N 3.46Å; Y308-S311 PolarHBondContact O-N 2.93Å; I309-S311 VanDerWaalsContact C-N 3.33Å; I309-S311 PolarHBondContact O-N 3.39Å; S311-S314 WeakPolarHBondContact O-CB 3.29Å; S311-S314 PolarHBondContact O-N 2.89Å; S311-G315 PolarHBondContact O-N 3.47Å; S311-V393 VanDerWaalsContact OG-CG2 3.31Å; S311-V393 WeakPolarHBondContact OG-CG2 3.4Å; S311-N446 WeakPolarHBondContact CB-OD1 3.49Å; S311-N446 PolarHBondContact OG-ND2 3.33Å; S311-N446 PolarHBondContact OG-OD1 3.25Å
312	L	91.1	Very high	90	Very high	42 Å²	42	39.1 Å²	39.1	22%	0.22	21%	0.21	C	C	.	.	H	α-helix	trans	-64.2	-47	172.4	179.7	64	0	0	0	111.7	Y308 I309 S314 G315 V316 I443 N446 L450	Y308-L312 WeakPolarHBondContact O-CB 3.46Å; Y308-L312 PolarHBondContact O-N 3.46Å; I309-L312 PolarHBondContact O-N 3.21Å; L312-S314 PolarHBondContact O-N 3.45Å; L312-G315 PolarHBondContact O-N 2.98Å; L312-V316 WeakPolarHBondContact O-CG2 3.21Å; L312-V316 PolarHBondContact O-N 3.43Å; L312-I443 HydrophobicContact CD1-CB 4.22Å; L312-I443 HydrophobicContact CD1-CG1 4.32Å; L312-I443 HydrophobicContact CD1-CG2 3.88Å; L312-N446 HydrophobicContact CB-CB 4.11Å; L312-L450 HydrophobicContact CB-CD1 4.37Å; L312-L450 HydrophobicContact CD2-CD1 3.7Å
313	I	92.8	Very high	90.4	Very high	96 Å²	96	38.3 Å²	38.3	49%	0.492	20%	0.202	S	C	.	.	H	α-helix	trans	-57.7	-42.9	175.9	-68.9	168	0	0	0	109.9	L283 I309 S310 V316 G317	L283-I313 HydrophobicContact CD1-CG2 4.22Å; I309-I313 HydrophobicContact CG2-CD1 3.95Å; I309-I313 WeakPolarHBondContact O-CG1 3.07Å; I309-I313 PolarHBondContact O-N 3.38Å; S310-I313 PolarHBondContact O-N 3.19Å; I313-V316 PolarHBondContact O-N 3.44Å; I313-G317 PolarHBondContact O-N 3.09Å
314	S	89.8	Confident	90.8	Very high	4 Å²	4	38.2 Å²	38.2	3%	0.028	21%	0.209	C	C	.	.	H	α-helix	trans	-62.5	-49.3	175.7	177.6	0	0	0	0	112.8	N280 S310 S311 L312 V316 G317 I318	N280-S314 WeakPolarHBondContact CB-OG 3.09Å; N280-S314 WeakPolarHBondContact OD1-CB 3.15Å; N280-S314 PolarHBondContact OD1-OG 3.28Å; S310-S314 PolarHBondContact O-N 3.27Å; S311-S314 WeakPolarHBondContact O-CB 3.29Å; S311-S314 PolarHBondContact O-N 2.89Å; L312-S314 PolarHBondContact O-N 3.45Å; S314-V316 VanDerWaalsContact C-N 3.25Å; S314-V316 PolarHBondContact O-N 2.84Å; S314-G317 CarbonylContact O-C 3.12Å; S314-G317 VanDerWaalsContact O-CA 3.29Å; S314-G317 WeakPolarHBondContact O-CA 3.49Å; S314-G317 PolarHBondContact O-N 3.17Å; S314-I318 WeakPolarHBondContact O-CG1 3.45Å; S314-I318 PolarHBondContact O-N 3.17Å
315	G	91.3	Very high	91.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-55.8	-41.7	177.7	0	0	0	0	0	112.1	S311 L312 I318 F319 S439	S311-G315 PolarHBondContact O-N 3.47Å; L312-G315 PolarHBondContact O-N 2.98Å; G315-I318 PolarHBondContact O-N 2.93Å; G315-F319 WeakPolarHBondContact O-CB 3.44Å; G315-F319 PolarHBondContact O-N 2.98Å; G315-S439 WeakPolarHBondContact O-CB 3.42Å
316	V	94.1	Very high	91.7	Very high	68 Å²	68	37.6 Å²	37.6	41%	0.412	20%	0.204	S	C	.	.	H	α-helix	trans	-64	-40.2	173	175.3	0	0	0	0	111.7	L312 I313 S314 F319 M320 I443	L312-V316 WeakPolarHBondContact O-CG2 3.21Å; L312-V316 PolarHBondContact O-N 3.43Å; I313-V316 PolarHBondContact O-N 3.44Å; S314-V316 VanDerWaalsContact C-N 3.25Å; S314-V316 PolarHBondContact O-N 2.84Å; V316-F319 PolarHBondContact O-N 3.2Å; V316-M320 HydrophobicContact CG1-CG 4.3Å; V316-M320 WeakPolarHBondContact O-CB 3.42Å; V316-M320 WeakPolarHBondContact O-CG 3.46Å; V316-M320 PolarHBondContact O-N 3.35Å; V316-I443 HydrophobicContact CG2-CD1 3.97Å; V316-I443 HydrophobicContact CG2-CG1 4.06Å
317	G	92.6	Very high	92.1	Very high	33 Å²	33	38.7 Å²	38.7	34%	0.34	21%	0.205	S	C	.	.	H	α-helix	trans	-60.4	-49.4	174.3	0	0	0	0	0	112.8	I313 S314 F319 M320 M321	I313-G317 PolarHBondContact O-N 3.09Å; S314-G317 CarbonylContact O-C 3.12Å; S314-G317 VanDerWaalsContact O-CA 3.29Å; S314-G317 WeakPolarHBondContact O-CA 3.49Å; S314-G317 PolarHBondContact O-N 3.17Å; G317-F319 VanDerWaalsContact C-N 3.3Å; G317-F319 PolarHBondContact O-N 2.92Å; G317-M320 PolarHBondContact O-N 3.36Å; G317-M321 VanDerWaalsContact O-CB 3.22Å; G317-M321 WeakPolarHBondContact O-CB 3.37Å; G317-M321 PolarHBondContact O-N 2.71Å
318	I	92.1	Very high	92.6	Very high	9 Å²	9	43.1 Å²	43.1	5%	0.046	22%	0.222	C	C	.	.	I	π-helix	trans	-61.9	-38.6	176.9	-63.3	168.3	0	0	0	110.7	S314 G315 G322 A323 E397 L442	S314-I318 WeakPolarHBondContact O-CG1 3.45Å; S314-I318 PolarHBondContact O-N 3.17Å; G315-I318 PolarHBondContact O-N 2.93Å; I318-G322 CarbonylContact O-C 3.55Å; I318-G322 WeakPolarHBondContact O-CA 3.34Å; I318-G322 PolarHBondContact O-N 2.82Å; I318-A323 PolarHBondContact O-N 2.92Å; I318-E397 HydrophobicContact CD1-CG 4.48Å; I318-E397 WeakPolarHBondContact CD1-OE1 3.34Å; I318-L442 HydrophobicContact CD1-CD1 4.5Å
319	F	95.1	Very high	92.8	Very high	65 Å²	65	45.2 Å²	45.2	29%	0.285	23%	0.233	S	C	.	.	I	π-helix	trans	-65.9	-50.5	175.9	-175.3	-105.6	0	0	0	111.9	G315 V316 G317 A323 G324 W327 S439 I443	G315-F319 WeakPolarHBondContact O-CB 3.44Å; G315-F319 PolarHBondContact O-N 2.98Å; V316-F319 PolarHBondContact O-N 3.2Å; G317-F319 VanDerWaalsContact C-N 3.3Å; G317-F319 PolarHBondContact O-N 2.92Å; F319-A323 HydrophobicContact CD2-CB 4.38Å; F319-A323 VanDerWaalsContact O-CB 3.29Å; F319-A323 WeakPolarHBondContact O-CB 3.39Å; F319-A323 PolarHBondContact O-N 3.42Å; F319-G324 PolarHBondContact O-N 2.93Å; F319-W327 HydrophobicContact CE2-CH2 4.06Å; F319-W327 HydrophobicContact CE2-CZ3 4.19Å; F319-W327 HydrophobicContact CZ-CH2 4.43Å; F319-W327 HydrophobicContact CZ-CZ3 4.23Å; F319-S439 WeakPolarHBondContact CA-OG 3.06Å; F319-S439 WeakPolarHBondContact CB-OG 3.45Å; F319-S439 WeakPolarHBondContact CD2-OG 3.19Å; F319-I443 HydrophobicContact CB-CD1 4.28Å
320	M	94.2	Very high	92.9	Very high	116 Å²	116	41.8 Å²	41.8	57%	0.571	22%	0.215	S	C	*	.	I	π-helix	trans	-72.4	-49.3	-175.8	-70.4	-77.8	97.9	0	0	112.7	V316 G317 G324	V316-M320 HydrophobicContact CG1-CG 4.3Å; V316-M320 WeakPolarHBondContact O-CB 3.42Å; V316-M320 WeakPolarHBondContact O-CG 3.46Å; V316-M320 PolarHBondContact O-N 3.35Å; G317-M320 PolarHBondContact O-N 3.36Å; M320-G324 WeakPolarHBondContact O-CA 3.38Å; M320-G324 PolarHBondContact O-N 2.97Å
321	M	92	Very high	93.2	Very high	66 Å²	66	44.8 Å²	44.8	33%	0.325	23%	0.233	S	C	.	.	I	π-helix	trans	-82	-50.1	-177.7	-172.1	173.3	174.5	0	0	111.1	I272 L275 G317 L325	I272-M321 HydrophobicContact CD1-CE 4.2Å; I272-M321 HydrophobicContact CG2-CG 4.04Å; I272-M321 VanDerWaalsContact CG2-O 3.23Å; I272-M321 WeakPolarHBondContact CG2-O 3.37Å; L275-M321 HydrophobicContact CB-CE 4.49Å; L275-M321 HydrophobicContact CD2-CE 3.33Å; L275-M321 HydrophobicContact CG-CE 3.73Å; G317-M321 VanDerWaalsContact O-CB 3.22Å; G317-M321 WeakPolarHBondContact O-CB 3.37Å; G317-M321 PolarHBondContact O-N 2.71Å; M321-L325 HydrophobicContact CG-CD1 3.91Å; M321-L325 WeakPolarHBondContact O-CB 3.46Å; M321-L325 WeakPolarHBondContact O-CD1 3.41Å; M321-L325 WeakPolarHBondContact O-CG 3.47Å; M321-L325 PolarHBondContact O-N 3.02Å
322	G	92.3	Very high	93.5	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.25	C	C	.	.	I	π-helix	trans	-66.3	-71.9	179	0	0	0	0	0	112.6	I318 S326	I318-G322 CarbonylContact O-C 3.55Å; I318-G322 WeakPolarHBondContact O-CA 3.34Å; I318-G322 PolarHBondContact O-N 2.82Å; G322-S326 VanDerWaalsContact O-CB 3.23Å; G322-S326 WeakPolarHBondContact O-CB 3.45Å; G322-S326 PolarHBondContact O-N 3.11Å; G322-S326 PolarHBondContact O-OG 3.43Å
323	A	95.4	Very high	93.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.246	C	C	.	.	I	π-helix	trans	-66.1	-45.9	-175.7	0	0	0	0	0	112.2	I318 F319 S326 W327 G432 L435	I318-A323 PolarHBondContact O-N 2.92Å; F319-A323 HydrophobicContact CD2-CB 4.38Å; F319-A323 VanDerWaalsContact O-CB 3.29Å; F319-A323 WeakPolarHBondContact O-CB 3.39Å; F319-A323 PolarHBondContact O-N 3.42Å; A323-S326 PolarHBondContact O-N 2.99Å; A323-W327 HydrophobicContact CB-CE3 4.27Å; A323-W327 HydrophobicContact CB-CH2 4.16Å; A323-W327 HydrophobicContact CB-CZ2 4.42Å; A323-W327 HydrophobicContact CB-CZ3 4.08Å; A323-W327 WeakPolarHBondContact O-CB 3.43Å; A323-W327 PolarHBondContact O-N 3.26Å; A323-G432 WeakPolarHBondContact CB-O 3.22Å; A323-L435 HydrophobicContact CB-CB 4.14Å
324	G	95.8	Very high	93.4	Very high	26 Å²	26	45.5 Å²	45.5	27%	0.268	24%	0.239	S	C	.	.	H	α-helix	trans	-59.4	-49	-177.7	0	0	0	0	0	114	F319 M320 Y328	F319-G324 PolarHBondContact O-N 2.93Å; M320-G324 WeakPolarHBondContact O-CA 3.38Å; M320-G324 PolarHBondContact O-N 2.97Å; G324-Y328 WeakPolarHBondContact O-CB 3.14Å; G324-Y328 PolarHBondContact O-N 3.42Å
325	L	94.9	Very high	93.6	Very high	66 Å²	66	50.7 Å²	50.7	35%	0.346	27%	0.266	S	S	.	.	H	α-helix	trans	-72	-35.6	179.3	-59.8	177.5	0	0	0	112.2	F268 I272 M321 Y328 H329	F268-L325 HydrophobicContact CE1-CB 3.91Å; F268-L325 HydrophobicContact CZ-CB 4.21Å; I272-L325 HydrophobicContact CD1-CD1 4.22Å; I272-L325 HydrophobicContact CG1-CD1 4.49Å; I272-L325 HydrophobicContact CG2-CB 4.46Å; I272-L325 HydrophobicContact CG2-CD1 4.2Å; M321-L325 HydrophobicContact CG-CD1 3.91Å; M321-L325 WeakPolarHBondContact O-CB 3.46Å; M321-L325 WeakPolarHBondContact O-CD1 3.41Å; M321-L325 WeakPolarHBondContact O-CG 3.47Å; M321-L325 PolarHBondContact O-N 3.02Å; L325-Y328 PolarHBondContact O-N 2.96Å; L325-H329 PolarHBondContact O-N 3.06Å
326	S	95.3	Very high	93.4	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64.7	-39.8	175.7	-57.2	0	0	0	0	111.7	S269 G322 A323 G330 S428 G432	S269-S326 WeakPolarHBondContact CB-OG 3.29Å; S269-S326 WeakPolarHBondContact OG-CA 3.25Å; S269-S326 VanDerWaalsContact OG-CB 3.25Å; S269-S326 WeakPolarHBondContact OG-CB 3.34Å; S269-S326 PolarHBondContact OG-OG 3.11Å; G322-S326 VanDerWaalsContact O-CB 3.23Å; G322-S326 WeakPolarHBondContact O-CB 3.45Å; G322-S326 PolarHBondContact O-N 3.11Å; G322-S326 PolarHBondContact O-OG 3.43Å; A323-S326 PolarHBondContact O-N 2.99Å; S326-G330 PolarHBondContact O-N 3.11Å; S326-S428 PolarHBondContact O-OG 3.41Å; S326-G432 VanDerWaalsContact CB-CA 3.45Å
327	W	97.1	Very high	92.9	Very high	86 Å²	86	56.6 Å²	56.6	33%	0.326	30%	0.295	S	S	.	.	H	α-helix	trans	-66.3	-44.3	171.9	-73.4	-33.5	0	0	0	112.1	F319 A323 H329 G330 V331 L429 T433	F319-W327 HydrophobicContact CE2-CH2 4.06Å; F319-W327 HydrophobicContact CE2-CZ3 4.19Å; F319-W327 HydrophobicContact CZ-CH2 4.43Å; F319-W327 HydrophobicContact CZ-CZ3 4.23Å; A323-W327 HydrophobicContact CB-CE3 4.27Å; A323-W327 HydrophobicContact CB-CH2 4.16Å; A323-W327 HydrophobicContact CB-CZ2 4.42Å; A323-W327 HydrophobicContact CB-CZ3 4.08Å; A323-W327 WeakPolarHBondContact O-CB 3.43Å; A323-W327 PolarHBondContact O-N 3.26Å; W327-H329 PolarHBondContact O-N 3.44Å; W327-G330 PolarHBondContact O-N 3.45Å; W327-V331 WeakPolarHBondContact O-CB 3.33Å; W327-V331 WeakPolarHBondContact O-CG2 3.02Å; W327-V331 PolarHBondContact O-N 3.4Å; W327-L429 HydrophobicContact CB-CD2 4.47Å; W327-T433 PolarHBondContact NE1-OG1 3.02Å; W327-T433 VanDerWaalsContact NE1-OG1 3.14Å
328	Y	95.1	Very high	92.1	Very high	133 Å²	133	61.7 Å²	61.7	52%	0.522	31%	0.31	S	S	.	.	H	α-helix	trans	-57.1	-50.8	177.5	173.8	-96.6	0	0	0	111.6	G324 L325 V331 M332	G324-Y328 WeakPolarHBondContact O-CB 3.14Å; G324-Y328 PolarHBondContact O-N 3.42Å; L325-Y328 PolarHBondContact O-N 2.96Å; Y328-V331 PolarHBondContact O-N 2.93Å; Y328-M332 HydrophobicContact CD2-CE 4.42Å; Y328-M332 HydrophobicContact CD2-CG 4.38Å; Y328-M332 HydrophobicContact CE1-CG 4.13Å; Y328-M332 HydrophobicContact CE2-CE 3.53Å; Y328-M332 HydrophobicContact CE2-CG 4.01Å; Y328-M332 WeakPolarHBondContact O-CB 3.48Å; Y328-M332 VanDerWaalsContact O-CG 3.29Å; Y328-M332 WeakPolarHBondContact O-CG 3.24Å; Y328-M332 PolarHBondContact O-N 3Å
329	H	90.9	Very high	91.4	Very high	59 Å²	59	66.2 Å²	66.2	27%	0.273	34%	0.34	S	S	.	.	H	α-helix	trans	-66.6	-37.5	178	-92.4	-91	0	0	0	112.7	F268 L325 W327 M332 G333	F268-H329 HydrophobicContact CD1-CB 3.76Å; F268-H329 AromaticContact CD1-CD2 3.46Å; F268-H329 VanDerWaalsContact CD1-CD2 3.46Å; F268-H329 WeakPolarHBondContact CD1-CD2 3.44Å; F268-H329 AromaticContact CD1-CG 3.49Å; F268-H329 VanDerWaalsContact CD1-CG 3.49Å; F268-H329 HydrophobicContact CE1-CB 4.09Å; F268-H329 AromaticContact CE1-CD2 3.05Å; F268-H329 WeakPolarHBondContact CE1-CD2 3.49Å; F268-H329 AromaticContact CE1-CG 3.61Å; F268-H329 AromaticContact CE1-NE2 3.69Å; F268-H329 AromaticContact CE2-NE2 3.96Å; F268-H329 AromaticContact CZ-CD2 3.44Å; F268-H329 VanDerWaalsContact CZ-CD2 3.44Å; F268-H329 WeakPolarHBondContact CZ-CD2 3.43Å; F268-H329 AromaticContact CZ-NE2 3.57Å; L325-H329 PolarHBondContact O-N 3.06Å; W327-H329 PolarHBondContact O-N 3.44Å; H329-M332 PolarHBondContact O-N 2.82Å; H329-G333 PolarHBondContact O-N 3.02Å
330	G	93.6	Very high	90.6	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-63.2	-46.6	175	0	0	0	0	0	112.6	S326 W327 G333 L334 S425 S428	S326-G330 PolarHBondContact O-N 3.11Å; W327-G330 PolarHBondContact O-N 3.45Å; G330-G333 PolarHBondContact O-N 3.27Å; G330-L334 WeakPolarHBondContact O-CG 3.37Å; G330-L334 PolarHBondContact O-N 2.98Å; G330-L334 VanDerWaalsContact O-N 3.08Å; G330-S425 WeakPolarHBondContact CA-O 3.47Å; G330-S428 PolarHBondContact N-OG 2.86Å
331	V	95.5	Very high	89.7	Confident	72 Å²	72	65.5 Å²	65.5	44%	0.436	34%	0.337	S	S	.	.	H	α-helix	trans	-64.7	-43.8	176.2	173.6	0	0	0	0	110.9	W327 Y328 G333 L334 L335 L429	W327-V331 WeakPolarHBondContact O-CB 3.33Å; W327-V331 WeakPolarHBondContact O-CG2 3.02Å; W327-V331 PolarHBondContact O-N 3.4Å; Y328-V331 PolarHBondContact O-N 2.93Å; V331-G333 VanDerWaalsContact C-N 3.33Å; V331-G333 PolarHBondContact O-N 3.05Å; V331-L334 PolarHBondContact O-N 3.28Å; V331-L335 HydrophobicContact CG1-CD1 4Å; V331-L335 HydrophobicContact CG1-CG 4.43Å; V331-L335 WeakPolarHBondContact O-CG 3.42Å; V331-L335 PolarHBondContact O-N 2.96Å; V331-L429 HydrophobicContact CG2-CD2 4.02Å
332	M	92.9	Very high	88.7	Confident	72 Å²	72	65 Å²	65	36%	0.355	34%	0.34	S	S	.	.	H	α-helix	trans	-64.1	-37.8	178.3	-75.4	-61.4	-175.3	0	0	112.4	Y328 H329 L334 L335 H336	Y328-M332 HydrophobicContact CD2-CE 4.42Å; Y328-M332 HydrophobicContact CD2-CG 4.38Å; Y328-M332 HydrophobicContact CE1-CG 4.13Å; Y328-M332 HydrophobicContact CE2-CE 3.53Å; Y328-M332 HydrophobicContact CE2-CG 4.01Å; Y328-M332 WeakPolarHBondContact O-CB 3.48Å; Y328-M332 VanDerWaalsContact O-CG 3.29Å; Y328-M332 WeakPolarHBondContact O-CG 3.24Å; Y328-M332 PolarHBondContact O-N 3Å; H329-M332 PolarHBondContact O-N 2.82Å; M332-L334 VanDerWaalsContact C-N 3.34Å; M332-L335 PolarHBondContact O-N 3.12Å; M332-L335 HydrophobicContact SD-CD1 4.47Å; M332-H336 PolarHBondContact O-N 3.01Å
333	G	89.3	Confident	88	Confident	14 Å²	14	65.8 Å²	65.8	14%	0.144	34%	0.344	C	S	.	.	H	α-helix	trans	-67.8	-31.4	175	0	0	0	0	0	113.4	H329 G330 V331 H336 P337 S425	H329-G333 PolarHBondContact O-N 3.02Å; G330-G333 PolarHBondContact O-N 3.27Å; V331-G333 VanDerWaalsContact C-N 3.33Å; V331-G333 PolarHBondContact O-N 3.05Å; G333-H336 CarbonylContact O-C 3.45Å; G333-P337 WeakPolarHBondContact O-CA 3.31Å; G333-S425 VanDerWaalsContact CA-OG 3.24Å; G333-S425 WeakPolarHBondContact CA-OG 3.45Å; G333-S425 PolarHBondContact O-OG 2.93Å
334	L	92.4	Very high	87.3	Confident	66 Å²	66	72.4 Å²	72.4	35%	0.346	38%	0.379	S	S	.	.	H	α-helix	trans	-69.3	-38.4	170.7	-69.1	178.6	0	0	0	112.4	G330 V331 M332 L422 L426 L429	G330-L334 WeakPolarHBondContact O-CG 3.37Å; G330-L334 PolarHBondContact O-N 2.98Å; G330-L334 VanDerWaalsContact O-N 3.08Å; V331-L334 PolarHBondContact O-N 3.28Å; M332-L334 VanDerWaalsContact C-N 3.34Å; L334-L422 HydrophobicContact CD2-CB 4.47Å; L334-L422 HydrophobicContact CD2-CD2 3.78Å; L334-L426 HydrophobicContact CD2-CD2 4.43Å; L334-L426 HydrophobicContact CD2-CG 4.49Å; L334-L429 HydrophobicContact CD1-CD1 3.63Å
335	L	92.9	Very high	86.6	Confident	114 Å²	114	79.3 Å²	79.3	60%	0.597	40%	0.397	S	S	*	.	H	α-helix	trans	-76.2	-35.5	179.5	-68.5	173.9	0	0	0	112.6	V331 M332	V331-L335 HydrophobicContact CG1-CD1 4Å; V331-L335 HydrophobicContact CG1-CG 4.43Å; V331-L335 WeakPolarHBondContact O-CG 3.42Å; V331-L335 PolarHBondContact O-N 2.96Å; M332-L335 PolarHBondContact O-N 3.12Å; M332-L335 HydrophobicContact SD-CD1 4.47Å
336	H	88.3	Confident	86.2	Confident	124 Å²	124	76.2 Å²	76.2	57%	0.574	38%	0.38	S	S	*	.	S	Bend	trans	-132.3	77.7	-178	-54.4	95.1	0	0	0	110.4	M332 G333 Q338	M332-H336 PolarHBondContact O-N 3.01Å; G333-H336 CarbonylContact O-C 3.45Å; H336-Q338 PolarHBondContact O-N 2.99Å
337	P	83.7	Confident	85.9	Confident	68 Å²	68	79.4 Å²	79.4	44%	0.442	39%	0.393	S	S	.	.			trans	-61.4	120.5	179.9	-22.7	34.3	0	0	0	111.1	G333 P421 L422	G333-P337 WeakPolarHBondContact O-CA 3.31Å; P337-P421 HydrophobicContact CB-CB 4.34Å; P337-L422 HydrophobicContact CG-CD2 4.06Å
338	Q	76.6	Confident	85.6	Confident	139 Å²	139	79.7 Å²	79.7	65%	0.65	41%	0.407	S	S	*	.			trans	-107.9	141	174.2	-67.4	-69.8	-23.1	0	0	109.3	H336 P421	H336-Q338 PolarHBondContact O-N 2.99Å; Q338-P421 VanDerWaalsContact O-CB 3.32Å; Q338-P421 WeakPolarHBondContact O-CB 3.27Å; Q338-P421 WeakPolarHBondContact O-CG 3.33Å
339	P	75.7	Confident	85.4	Confident	104 Å²	104	74.4 Å²	74.4	68%	0.675	39%	0.388	S	S	*	.			trans	-65.4	141	173.9	28.4	-32.7	0	0	0	110.1
340	I	79.1	Confident	85.4	Confident	37 Å²	37	71.8 Å²	71.8	19%	0.19	38%	0.375	C	S	.	.			trans	-91.1	136.1	177.9	-48.6	-176.1	0	0	0	108.7	T262 L343 T415 D424	T262-I340 WeakPolarHBondContact O-CG2 3.21Å; I340-L343 HydrophobicContact CG2-CD2 3.67Å; I340-L343 HydrophobicContact CG2-CG 4.22Å; I340-T415 HydrophobicContact CD1-CG2 3.48Å; I340-T415 VanDerWaalsContact CD1-CG2 3.48Å; I340-T415 HydrophobicContact CG1-CG2 4.14Å; I340-D424 HydrophobicContact CD1-CB 3.45Å; I340-D424 VanDerWaalsContact CD1-CB 3.45Å; I340-D424 VanDerWaalsContact CD1-CG 3.45Å; I340-D424 WeakPolarHBondContact CD1-OD2 3.11Å
341	E	75.9	Confident	85.4	Confident	129 Å²	129	74.4 Å²	74.4	60%	0.603	40%	0.397	S	S	*	.			trans	-76.6	-168.3	176.3	-66.3	-161	-170.7	0	0	112.3	T262 L343	T262-E341 PolarHBondContact O-N 2.9Å; E341-L343 PolarHBondContact O-N 3.02Å
342	S	69.9	Low	85.2	Confident	56 Å²	56	72.8 Å²	72.8	39%	0.392	40%	0.395	S	S	.	.			trans	-59.3	121.6	-170.1	100.5	0	0	0	0	112.9	Y261	Y261-S342 WeakPolarHBondContact CE1-O 3.36Å; Y261-S342 WeakPolarHBondContact CE1-OG 3.25Å; Y261-S342 PolarHBondContact OH-OG 3.22Å
343	L	77.6	Confident	85.2	Confident	17 Å²	17	69.4 Å²	69.4	9%	0.089	38%	0.378	C	S	.	.			trans	-89.4	-11.7	-171.5	-72	166.3	0	0	0	114.1	T262 I340 E341 W345 A346 Y347 M412 S416	T262-L343 HydrophobicContact CG2-CD2 4.39Å; I340-L343 HydrophobicContact CG2-CD2 3.67Å; I340-L343 HydrophobicContact CG2-CG 4.22Å; E341-L343 PolarHBondContact O-N 3.02Å; L343-W345 VanDerWaalsContact C-N 3.33Å; L343-W345 PolarHBondContact O-N 3.36Å; L343-A346 PolarHBondContact O-N 3.33Å; L343-A346 VanDerWaalsContact O-N 3.14Å; L343-Y347 HydrophobicContact CB-CD2 4.03Å; L343-Y347 HydrophobicContact CB-CE2 3.56Å; L343-Y347 HydrophobicContact CD1-CE2 4.48Å; L343-Y347 WeakPolarHBondContact O-CD2 2.95Å; L343-Y347 PolarHBondContact O-N 2.87Å; L343-M412 HydrophobicContact CD2-CB 4.38Å; L343-M412 HydrophobicContact CD2-CE 4.43Å; L343-M412 HydrophobicContact CD2-SD 4.43Å; L343-S416 VanDerWaalsContact CD1-CB 3.46Å
344	L	80.3	Confident	85.4	Confident	139 Å²	139	71.8 Å²	71.8	73%	0.728	39%	0.388	S	S	*	.	H	α-helix	trans	-58.7	-43.3	-174.1	-73.7	172.3	0	0	0	112.4	Y347 C348	L344-Y347 PolarHBondContact O-N 2.83Å; L344-C348 PolarHBondContact O-N 3.01Å; L344-C348 PolarHBondContact O-SG 2.69Å
345	W	81.7	Confident	85.5	Confident	171 Å²	171	74 Å²	74	65%	0.648	40%	0.404	S	S	*	.	H	α-helix	trans	-68	-38.1	178	-112.6	82.3	0	0	0	112.5	Y261 L343 C348 I349	Y261-W345 HydrophobicContact CE1-CB 4.4Å; L343-W345 VanDerWaalsContact C-N 3.33Å; L343-W345 PolarHBondContact O-N 3.36Å; W345-C348 PolarHBondContact O-N 3.49Å; W345-I349 HydrophobicContact CE3-CD1 3.74Å; W345-I349 HydrophobicContact CE3-CG1 4.47Å; W345-I349 HydrophobicContact CZ3-CD1 4.03Å; W345-I349 PolarHBondContact O-N 3.47Å
346	A	86.3	Confident	85.3	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-66.2	-38.5	176.9	0	0	0	0	0	112.2	A258 T262 M267 L343 I349 L350 M412	A258-A346 HydrophobicContact CB-CB 4.35Å; T262-A346 HydrophobicContact CG2-CB 3.61Å; M267-A346 HydrophobicContact SD-CB 4.45Å; L343-A346 PolarHBondContact O-N 3.33Å; L343-A346 VanDerWaalsContact O-N 3.14Å; A346-I349 PolarHBondContact O-N 3.17Å; A346-L350 WeakPolarHBondContact O-CG 3.45Å; A346-L350 PolarHBondContact O-N 2.99Å; A346-M412 HydrophobicContact CB-CE 4.25Å
347	Y	88.8	Confident	85.4	Confident	68 Å²	68	64.5 Å²	64.5	27%	0.267	36%	0.359	S	S	.	.	H	α-helix	trans	-63.8	-40.6	174.3	-73.9	-60.2	0	0	0	113.1	L343 L344 I349 L350 A351 M412 G413	L343-Y347 HydrophobicContact CB-CD2 4.03Å; L343-Y347 HydrophobicContact CB-CE2 3.56Å; L343-Y347 HydrophobicContact CD1-CE2 4.48Å; L343-Y347 WeakPolarHBondContact O-CD2 2.95Å; L343-Y347 PolarHBondContact O-N 2.87Å; L344-Y347 PolarHBondContact O-N 2.83Å; Y347-I349 VanDerWaalsContact C-N 3.27Å; Y347-I349 PolarHBondContact O-N 2.81Å; Y347-L350 PolarHBondContact O-N 2.97Å; Y347-A351 VanDerWaalsContact O-CB 3.26Å; Y347-A351 WeakPolarHBondContact O-CB 3.32Å; Y347-A351 PolarHBondContact O-N 2.98Å; Y347-M412 HydrophobicContact CD1-CE 4.33Å; Y347-M412 HydrophobicContact CE1-CB 4.46Å; Y347-M412 HydrophobicContact CE1-CE 3.98Å; Y347-M412 PolarHBondContact OH-O 3.25Å; Y347-M412 VanDerWaalsContact OH-O 3.11Å; Y347-G413 WeakPolarHBondContact OH-CA 3.27Å; Y347-G413 PolarHBondContact OH-N 3.22Å
348	C	90.1	Very high	85.8	Confident	92 Å²	92	62.1 Å²	62.1	62%	0.622	35%	0.347	S	S	*	.	H	α-helix	trans	-59.6	-41.8	175.4	-70	0	0	0	0	111.4	L344 W345 G352	L344-C348 PolarHBondContact O-N 3.01Å; L344-C348 PolarHBondContact O-SG 2.69Å; W345-C348 PolarHBondContact O-N 3.49Å; C348-G352 PolarHBondContact O-N 3.23Å
349	I	91.6	Very high	86.4	Confident	22 Å²	22	58 Å²	58	11%	0.113	34%	0.337	C	S	.	.	H	α-helix	trans	-68.9	-45	178.5	-70.8	168.8	0	0	0	111.2	F254 K255 A258 M267 W345 A346 Y347 A351 G352 S353	F254-I349 HydrophobicContact CB-CD1 4.41Å; F254-I349 HydrophobicContact CB-CG1 4.42Å; F254-I349 HydrophobicContact CB-CG2 3.95Å; K255-I349 HydrophobicContact CG-CG2 4.2Å; A258-I349 HydrophobicContact CB-CB 4.4Å; A258-I349 HydrophobicContact CB-CD1 3.72Å; A258-I349 HydrophobicContact CB-CG2 4.26Å; M267-I349 HydrophobicContact CE-CG2 4.09Å; W345-I349 HydrophobicContact CE3-CD1 3.74Å; W345-I349 HydrophobicContact CE3-CG1 4.47Å; W345-I349 HydrophobicContact CZ3-CD1 4.03Å; W345-I349 PolarHBondContact O-N 3.47Å; A346-I349 PolarHBondContact O-N 3.17Å; Y347-I349 VanDerWaalsContact C-N 3.27Å; Y347-I349 PolarHBondContact O-N 2.81Å; I349-A351 VanDerWaalsContact C-N 3.34Å; I349-A351 PolarHBondContact O-N 3.35Å; I349-G352 PolarHBondContact O-N 2.8Å; I349-S353 PolarHBondContact O-N 3.24Å
350	L	91.2	Very high	86.9	Confident	3 Å²	3	54.7 Å²	54.7	2%	0.016	32%	0.315	C	S	.	.	H	α-helix	trans	-63.6	-38.9	176.2	-72.6	-178.7	0	0	0	112.2	M267 E270 A346 Y347 S353 L354 V405 A409 M412	M267-L350 HydrophobicContact CE-CD2 3.72Å; M267-L350 HydrophobicContact CE-CG 4.05Å; M267-L350 HydrophobicContact SD-CD1 4.08Å; M267-L350 HydrophobicContact SD-CD2 3.73Å; M267-L350 HydrophobicContact SD-CG 3.86Å; E270-L350 HydrophobicContact CG-CD2 4.43Å; A346-L350 WeakPolarHBondContact O-CG 3.45Å; A346-L350 PolarHBondContact O-N 2.99Å; Y347-L350 PolarHBondContact O-N 2.97Å; L350-S353 WeakPolarHBondContact O-CB 3.46Å; L350-S353 PolarHBondContact O-N 3.17Å; L350-L354 WeakPolarHBondContact O-CB 3.36Å; L350-L354 PolarHBondContact O-N 3.09Å; L350-V405 HydrophobicContact CB-CG1 4.22Å; L350-V405 HydrophobicContact CD2-CG1 4.2Å; L350-V405 HydrophobicContact CD2-CG2 4.47Å; L350-A409 HydrophobicContact CD1-CB 4.06Å; L350-M412 HydrophobicContact CD1-CE 3.22Å; L350-M412 HydrophobicContact CD1-SD 4.23Å; L350-M412 HydrophobicContact CG-CE 4.42Å
351	A	93.1	Very high	87.4	Confident	55 Å²	55	54.4 Å²	54.4	46%	0.455	31%	0.313	S	S	.	.	H	α-helix	trans	-63.9	-44.1	175.3	0	0	0	0	0	111.6	Y347 I349 S353 L354 V355	Y347-A351 VanDerWaalsContact O-CB 3.26Å; Y347-A351 WeakPolarHBondContact O-CB 3.32Å; Y347-A351 PolarHBondContact O-N 2.98Å; I349-A351 VanDerWaalsContact C-N 3.34Å; I349-A351 PolarHBondContact O-N 3.35Å; A351-S353 VanDerWaalsContact C-N 3.33Å; A351-S353 PolarHBondContact O-N 3.34Å; A351-L354 PolarHBondContact O-N 3.29Å; A351-V355 WeakPolarHBondContact O-CG2 3.33Å; A351-V355 PolarHBondContact O-N 2.7Å
352	G	92.4	Very high	88.1	Confident	38 Å²	38	53.6 Å²	53.6	39%	0.392	31%	0.313	S	S	.	.	H	α-helix	trans	-61.5	-40.3	173.9	0	0	0	0	0	112.8	C348 I349 S356	C348-G352 PolarHBondContact O-N 3.23Å; I349-G352 PolarHBondContact O-N 2.8Å; G352-S356 PolarHBondContact O-N 2.93Å; G352-S356 VanDerWaalsContact O-N 3.09Å; G352-S356 PolarHBondContact O-OG 3.03Å
353	S	91.6	Very high	88.8	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.007	32%	0.324	C	S	.	.	H	α-helix	trans	-63.3	-47	173.9	-166.6	0	0	0	0	111.9	K255 I349 L350 A351 V355 S356 E357	K255-S353 VanDerWaalsContact CE-CB 3.48Å; K255-S353 WeakPolarHBondContact CE-OG 3.28Å; K255-S353 PolarHBondContact NZ-OG 2.74Å; K255-S353 VanDerWaalsContact NZ-OG 3.09Å; I349-S353 PolarHBondContact O-N 3.24Å; L350-S353 WeakPolarHBondContact O-CB 3.46Å; L350-S353 PolarHBondContact O-N 3.17Å; A351-S353 VanDerWaalsContact C-N 3.33Å; A351-S353 PolarHBondContact O-N 3.34Å; S353-V355 VanDerWaalsContact C-N 3.28Å; S353-V355 PolarHBondContact O-N 3.32Å; S353-S356 WeakPolarHBondContact CA-OG 3.46Å; S353-S356 PolarHBondContact O-N 2.82Å; S353-S356 VanDerWaalsContact O-N 3.16Å; S353-S356 PolarHBondContact O-OG 3.16Å; S353-E357 WeakPolarHBondContact O-CB 3.42Å; S353-E357 WeakPolarHBondContact O-CG 3.32Å; S353-E357 PolarHBondContact O-N 3.31Å; S353-E357 PolarHBondContact OG-OE1 3.07Å; S353-E357 PolarHBondContact OG-OE2 3.3Å
354	L	94.1	Very high	89.1	Confident	65 Å²	65	55.9 Å²	55.9	34%	0.34	33%	0.326	S	S	.	.	H	α-helix	trans	-59.4	-40.3	-179.5	-172.6	65.8	0	0	0	111.8	L350 A351 G358 V402 V405 I406	L350-L354 WeakPolarHBondContact O-CB 3.36Å; L350-L354 PolarHBondContact O-N 3.09Å; A351-L354 PolarHBondContact O-N 3.29Å; L354-G358 WeakPolarHBondContact O-CA 3.31Å; L354-G358 PolarHBondContact O-N 3.35Å; L354-V402 HydrophobicContact CD1-CG1 3.9Å; L354-V405 HydrophobicContact CB-CG1 3.95Å; L354-V405 HydrophobicContact CD1-CB 4.35Å; L354-V405 HydrophobicContact CD1-CG1 4.05Å; L354-I406 HydrophobicContact CD1-CD1 4.35Å; L354-I406 HydrophobicContact CD1-CG1 3.97Å
355	V	93.7	Very high	89.5	Confident	113 Å²	113	50.3 Å²	50.3	69%	0.685	30%	0.298	S	S	*	.	H	α-helix	trans	-67.4	-44.5	177	171.9	0	0	0	0	111.3	A351 S353 A359	A351-V355 WeakPolarHBondContact O-CG2 3.33Å; A351-V355 PolarHBondContact O-N 2.7Å; S353-V355 VanDerWaalsContact C-N 3.28Å; S353-V355 PolarHBondContact O-N 3.32Å; V355-A359 WeakPolarHBondContact O-CB 3.42Å; V355-A359 PolarHBondContact O-N 2.77Å
356	S	90.4	Very high	89.8	Confident	26 Å²	26	46.4 Å²	46.4	18%	0.182	29%	0.29	C	S	.	.	H	α-helix	trans	-71.9	-48.2	-177.5	50.5	0	0	0	0	112.7	N251 G352 S353 G358 A359 T360	N251-S356 PolarHBondContact ND2-OG 3.42Å; N251-S356 PolarHBondContact OD1-OG 3Å; G352-S356 PolarHBondContact O-N 2.93Å; G352-S356 VanDerWaalsContact O-N 3.09Å; G352-S356 PolarHBondContact O-OG 3.03Å; S353-S356 WeakPolarHBondContact CA-OG 3.46Å; S353-S356 PolarHBondContact O-N 2.82Å; S353-S356 VanDerWaalsContact O-N 3.16Å; S353-S356 PolarHBondContact O-OG 3.16Å; S356-G358 VanDerWaalsContact C-N 3.35Å; S356-A359 WeakPolarHBondContact O-CB 3.44Å; S356-A359 PolarHBondContact O-N 2.96Å; S356-T360 PolarHBondContact O-N 2.88Å; S356-T360 VanDerWaalsContact O-N 3.08Å
357	E	89.5	Confident	89.6	Confident	11 Å²	11	50.9 Å²	50.9	5%	0.051	31%	0.311	C	S	.	.	H	α-helix	trans	-67.3	-35.5	175.4	-67.1	167.3	168	0	0	111.4	K255 S353 A359 T360 L361 A401 V402 V405	K255-E357 IonicContact NZ-OE1 2.94Å; K255-E357 PolarHBondContact NZ-OE1 2.86Å; K255-E357 IonicContact NZ-OE2 3.49Å; S353-E357 WeakPolarHBondContact O-CB 3.42Å; S353-E357 WeakPolarHBondContact O-CG 3.32Å; S353-E357 PolarHBondContact O-N 3.31Å; S353-E357 PolarHBondContact OG-OE1 3.07Å; S353-E357 PolarHBondContact OG-OE2 3.3Å; E357-A359 VanDerWaalsContact C-N 3.31Å; E357-A359 PolarHBondContact O-N 2.56Å; E357-T360 WeakPolarHBondContact CA-OG1 3.19Å; E357-T360 PolarHBondContact O-N 3.09Å; E357-T360 PolarHBondContact O-OG1 3.1Å; E357-L361 WeakPolarHBondContact O-CB 3.33Å; E357-L361 PolarHBondContact O-N 3.18Å; E357-A401 HydrophobicContact CG-CB 4.38Å; E357-V402 HydrophobicContact CB-CG2 3.95Å; E357-V405 VanDerWaalsContact OE2-CG2 3.29Å; E357-V405 WeakPolarHBondContact OE2-CG2 3.06Å
358	G	91.9	Very high	89.4	Confident	18 Å²	18	48 Å²	48	19%	0.186	30%	0.3	C	S	.	.	H	α-helix	trans	-62.5	-39	171.8	0	0	0	0	0	112.2	L354 S356 L362	L354-G358 WeakPolarHBondContact O-CA 3.31Å; L354-G358 PolarHBondContact O-N 3.35Å; S356-G358 VanDerWaalsContact C-N 3.35Å; G358-L362 WeakPolarHBondContact O-CB 3.43Å; G358-L362 VanDerWaalsContact O-CG 3.25Å; G358-L362 WeakPolarHBondContact O-CG 3.26Å; G358-L362 PolarHBondContact O-N 3.43Å
359	A	89.6	Confident	89.2	Confident	52 Å²	52	49.2 Å²	49.2	43%	0.43	29%	0.292	S	S	.	.	H	α-helix	trans	-67.1	-42.1	175.9	0	0	0	0	0	112.2	V355 S356 E357 L362 V363	V355-A359 WeakPolarHBondContact O-CB 3.42Å; V355-A359 PolarHBondContact O-N 2.77Å; S356-A359 WeakPolarHBondContact O-CB 3.44Å; S356-A359 PolarHBondContact O-N 2.96Å; E357-A359 VanDerWaalsContact C-N 3.31Å; E357-A359 PolarHBondContact O-N 2.56Å; A359-L362 PolarHBondContact O-N 3.38Å; A359-V363 WeakPolarHBondContact O-CG2 3.33Å; A359-V363 PolarHBondContact O-N 3.29Å; A359-V363 VanDerWaalsContact O-N 3.1Å
360	T	85.9	Confident	88.9	Confident	36 Å²	36	56.5 Å²	56.5	22%	0.221	32%	0.318	C	S	.	.	H	α-helix	trans	-63.7	-44.6	176.2	56.8	0	0	0	0	111.2	S356 E357 L362 V363 A364	S356-T360 PolarHBondContact O-N 2.88Å; S356-T360 VanDerWaalsContact O-N 3.08Å; E357-T360 WeakPolarHBondContact CA-OG1 3.19Å; E357-T360 PolarHBondContact O-N 3.09Å; E357-T360 PolarHBondContact O-OG1 3.1Å; T360-L362 VanDerWaalsContact C-N 3.34Å; T360-L362 PolarHBondContact O-N 2.97Å; T360-V363 PolarHBondContact O-N 3.48Å; T360-V363 VanDerWaalsContact O-N 3.17Å; T360-A364 PolarHBondContact O-N 3.04Å
361	L	89.9	Confident	88.4	Confident	30 Å²	30	59.1 Å²	59.1	16%	0.157	33%	0.332	C	S	.	.	H	α-helix	trans	-57.9	-44.7	175.7	-179.4	58.1	0	0	0	112	E357 V363 A364 V365 L395 D398 T399 V402	E357-L361 WeakPolarHBondContact O-CB 3.33Å; E357-L361 PolarHBondContact O-N 3.18Å; L361-V363 VanDerWaalsContact C-N 3.34Å; L361-V363 PolarHBondContact O-N 3.04Å; L361-A364 PolarHBondContact O-N 3.44Å; L361-V365 HydrophobicContact CD1-CG2 4.03Å; L361-V365 HydrophobicContact CG-CG2 4.38Å; L361-V365 WeakPolarHBondContact O-CB 3.25Å; L361-V365 VanDerWaalsContact O-CG2 3.27Å; L361-V365 WeakPolarHBondContact O-CG2 3.49Å; L361-V365 PolarHBondContact O-N 3.4Å; L361-L395 HydrophobicContact CD1-CD1 3.84Å; L361-D398 HydrophobicContact CB-CB 4.06Å; L361-D398 HydrophobicContact CD1-CB 3.89Å; L361-T399 WeakPolarHBondContact CD1-OG1 3.2Å; L361-V402 HydrophobicContact CD2-CB 4.34Å; L361-V402 HydrophobicContact CD2-CG2 4.03Å
362	L	90.3	Very high	87.9	Confident	112 Å²	112	56.6 Å²	56.6	59%	0.586	31%	0.311	S	S	*	.	H	α-helix	trans	-62.6	-40.4	178.1	-76.2	171.9	0	0	0	112.3	G358 A359 T360 N366	G358-L362 WeakPolarHBondContact O-CB 3.43Å; G358-L362 VanDerWaalsContact O-CG 3.25Å; G358-L362 WeakPolarHBondContact O-CG 3.26Å; G358-L362 PolarHBondContact O-N 3.43Å; A359-L362 PolarHBondContact O-N 3.38Å; T360-L362 VanDerWaalsContact C-N 3.34Å; T360-L362 PolarHBondContact O-N 2.97Å; L362-N366 WeakPolarHBondContact O-CB 3.38Å; L362-N366 PolarHBondContact O-N 2.92Å
363	V	85.7	Confident	87.6	Confident	104 Å²	104	63.6 Å²	63.6	63%	0.63	33%	0.325	S	S	*	.	H	α-helix	trans	-63.4	-47.9	175.3	171.5	0	0	0	0	110.4	A359 T360 L361 N366 E367	A359-V363 WeakPolarHBondContact O-CG2 3.33Å; A359-V363 PolarHBondContact O-N 3.29Å; A359-V363 VanDerWaalsContact O-N 3.1Å; T360-V363 PolarHBondContact O-N 3.48Å; T360-V363 VanDerWaalsContact O-N 3.17Å; L361-V363 VanDerWaalsContact C-N 3.34Å; L361-V363 PolarHBondContact O-N 3.04Å; V363-N366 PolarHBondContact O-N 2.97Å; V363-E367 PolarHBondContact O-N 3.21Å
364	A	83.9	Confident	87.2	Confident	17 Å²	17	67.6 Å²	67.6	14%	0.14	36%	0.359	C	S	.	.	H	α-helix	trans	-59.2	-50.2	177.9	0	0	0	0	0	111.5	T360 L361 N366 E367 L368	T360-A364 PolarHBondContact O-N 3.04Å; L361-A364 PolarHBondContact O-N 3.44Å; A364-N366 VanDerWaalsContact C-N 3.33Å; A364-N366 PolarHBondContact O-N 3.43Å; A364-E367 PolarHBondContact O-N 2.68Å; A364-L368 WeakPolarHBondContact O-CD1 3.21Å; A364-L368 PolarHBondContact O-N 3.04Å
365	V	88.1	Confident	86.4	Confident	23 Å²	23	70.9 Å²	70.9	14%	0.139	37%	0.37	C	S	.	.	H	α-helix	trans	-59.2	-42.8	178.6	169.5	0	0	0	0	111.7	L361 L368 R369 F379 L395	L361-V365 HydrophobicContact CD1-CG2 4.03Å; L361-V365 HydrophobicContact CG-CG2 4.38Å; L361-V365 WeakPolarHBondContact O-CB 3.25Å; L361-V365 VanDerWaalsContact O-CG2 3.27Å; L361-V365 WeakPolarHBondContact O-CG2 3.49Å; L361-V365 PolarHBondContact O-N 3.4Å; V365-L368 PolarHBondContact O-N 3.28Å; V365-R369 HydrophobicContact CG1-CG 4.35Å; V365-R369 WeakPolarHBondContact O-CB 3.46Å; V365-R369 VanDerWaalsContact O-CG 3.27Å; V365-R369 WeakPolarHBondContact O-CG 3.37Å; V365-R369 PolarHBondContact O-N 3.41Å; V365-F379 HydrophobicContact CG1-CE2 4.39Å; V365-F379 HydrophobicContact CG1-CZ 4.41Å; V365-L395 HydrophobicContact CG2-CD1 3.63Å
366	N	86.9	Confident	85.8	Confident	89 Å²	89	69.1 Å²	69.1	48%	0.476	38%	0.375	S	S	.	.	H	α-helix	trans	-65.5	-40.1	179	-82.7	-15.5	0	0	0	112.4	L362 V363 A364 R369 R370	L362-N366 WeakPolarHBondContact O-CB 3.38Å; L362-N366 PolarHBondContact O-N 2.92Å; V363-N366 PolarHBondContact O-N 2.97Å; A364-N366 VanDerWaalsContact C-N 3.33Å; A364-N366 PolarHBondContact O-N 3.43Å; N366-R369 PolarHBondContact O-N 2.83Å; N366-R370 WeakPolarHBondContact O-CB 3.25Å; N366-R370 PolarHBondContact O-N 3.24Å
367	E	84.1	Confident	85.4	Confident	94 Å²	94	70.1 Å²	70.1	44%	0.439	38%	0.377	S	S	.	.	H	α-helix	trans	-64.5	-46.1	176.5	-174.3	56.9	-151.8	0	0	111.2	V363 A364 R369 R370 N371	V363-E367 PolarHBondContact O-N 3.21Å; A364-E367 PolarHBondContact O-N 2.68Å; E367-R369 PolarHBondContact O-N 2.93Å; E367-R370 WeakPolarHBondContact O-CB 3.47Å; E367-R370 PolarHBondContact O-N 3.03Å; E367-N371 PolarHBondContact O-N 3.02Å; E367-N371 PolarHBondContact O-ND2 3.2Å; E367-N371 PolarHBondContact OE1-ND2 2.85Å
368	L	82.8	Confident	85.3	Confident	7 Å²	7	74.2 Å²	74.2	4%	0.037	40%	0.403	C	S	.	.	H	α-helix	trans	-63	-41.3	174.9	-84.9	87.9	0	0	0	112.1	A364 V365 R370 N371 A372 F379 V383 T391 L395	A364-L368 WeakPolarHBondContact O-CD1 3.21Å; A364-L368 PolarHBondContact O-N 3.04Å; V365-L368 PolarHBondContact O-N 3.28Å; L368-R370 VanDerWaalsContact C-N 3.28Å; L368-R370 PolarHBondContact O-N 2.91Å; L368-N371 PolarHBondContact O-N 2.98Å; L368-A372 VanDerWaalsContact O-CB 3.31Å; L368-A372 WeakPolarHBondContact O-CB 3.4Å; L368-A372 PolarHBondContact O-N 3.48Å; L368-F379 HydrophobicContact CB-CD2 4.36Å; L368-F379 HydrophobicContact CB-CE2 3.74Å; L368-F379 HydrophobicContact CD2-CE2 4.47Å; L368-V383 HydrophobicContact CD2-CG2 3.68Å; L368-T391 HydrophobicContact CD1-CG2 3.54Å; L368-T391 HydrophobicContact CD2-CG2 4.01Å; L368-T391 HydrophobicContact CG-CG2 3.78Å; L368-L395 HydrophobicContact CD2-CD2 4.02Å
369	R	87.1	Confident	84.9	Confident	118 Å²	118	76.7 Å²	76.7	45%	0.445	41%	0.409	S	S	.	.	H	α-helix	trans	-62.9	-34.2	175.8	-77.8	177.3	-179.1	167.4	-0.3	112.5	V365 N366 E367 R373 F379	V365-R369 HydrophobicContact CG1-CG 4.35Å; V365-R369 WeakPolarHBondContact O-CB 3.46Å; V365-R369 VanDerWaalsContact O-CG 3.27Å; V365-R369 WeakPolarHBondContact O-CG 3.37Å; V365-R369 PolarHBondContact O-N 3.41Å; N366-R369 PolarHBondContact O-N 2.83Å; E367-R369 PolarHBondContact O-N 2.93Å; R369-R373 WeakPolarHBondContact O-CB 3.35Å; R369-R373 WeakPolarHBondContact O-CG 3.37Å; R369-R373 PolarHBondContact O-N 3.47Å; R369-R373 VanDerWaalsContact O-N 3.16Å; R369-R373 PolarHBondContact O-NE 3.38Å; R369-F379 HydrophobicContact CB-CD2 4.37Å; R369-F379 HydrophobicContact CG-CB 4.49Å; R369-F379 HydrophobicContact CG-CD2 3.42Å; R369-F379 VanDerWaalsContact CG-CD2 3.42Å; R369-F379 HydrophobicContact CG-CE2 3.87Å; R369-F379 HydrophobicContact CG-CG 4.16Å
370	R	85	Confident	84.5	Confident	175 Å²	175	82.6 Å²	82.6	66%	0.66	42%	0.421	S	S	*	.	H	α-helix	trans	-68.2	-46.2	175.2	-172.4	-178.7	-178.6	177.2	1.1	110.6	N366 E367 L368 R373 A374	N366-R370 WeakPolarHBondContact O-CB 3.25Å; N366-R370 PolarHBondContact O-N 3.24Å; E367-R370 WeakPolarHBondContact O-CB 3.47Å; E367-R370 PolarHBondContact O-N 3.03Å; L368-R370 VanDerWaalsContact C-N 3.28Å; L368-R370 PolarHBondContact O-N 2.91Å; R370-R373 PolarHBondContact O-N 3.36Å; R370-A374 PolarHBondContact O-N 3.31Å
371	N	80	Confident	84.1	Confident	58 Å²	58	85.6 Å²	85.6	31%	0.31	43%	0.431	S	S	.	.	H	α-helix	trans	-66.3	-36.6	177.9	-72	-52.4	0	0	0	112.9	E367 L368 A374 K375 Y382	E367-N371 PolarHBondContact O-N 3.02Å; E367-N371 PolarHBondContact O-ND2 3.2Å; E367-N371 PolarHBondContact OE1-ND2 2.85Å; L368-N371 PolarHBondContact O-N 2.98Å; N371-A374 PolarHBondContact O-N 3.45Å; N371-K375 PolarHBondContact O-N 2.93Å; N371-Y382 HydrophobicContact CB-CE1 4.22Å; N371-Y382 HydrophobicContact CB-CE2 4.22Å; N371-Y382 WeakPolarHBondContact CB-OH 3.27Å
372	A	84	Confident	83.6	Confident	2 Å²	2	85.3 Å²	85.3	2%	0.017	43%	0.428	C	S	.	.	H	α-helix	trans	-62	-46.7	173.3	0	0	0	0	0	111.9	L368 A374 K375 G376 M377 Y382	L368-A372 VanDerWaalsContact O-CB 3.31Å; L368-A372 WeakPolarHBondContact O-CB 3.4Å; L368-A372 PolarHBondContact O-N 3.48Å; A372-A374 VanDerWaalsContact C-N 3.35Å; A372-A374 PolarHBondContact O-N 3.1Å; A372-K375 CarbonylContact O-C 3.6Å; A372-K375 PolarHBondContact O-N 3.17Å; A372-K375 VanDerWaalsContact O-N 3.16Å; A372-G376 PolarHBondContact O-N 2.95Å; A372-G376 VanDerWaalsContact O-N 3.17Å; A372-M377 CarbonylContact C-O 3.56Å; A372-M377 PolarHBondContact O-N 3.41Å; A372-Y382 VanDerWaalsContact CA-CD2 3.44Å; A372-Y382 HydrophobicContact CB-CD1 4.25Å; A372-Y382 HydrophobicContact CB-CD2 3.87Å; A372-Y382 HydrophobicContact CB-CG 3.63Å
373	R	86.1	Confident	82.9	Confident	184 Å²	184	81.4 Å²	81.4	69%	0.694	41%	0.409	S	S	*	.	H	α-helix	trans	-62.1	-40.1	175.7	-78.6	-177.1	-86.7	-174.4	-5.6	112.5	R369 R370 K375 G376	R369-R373 WeakPolarHBondContact O-CB 3.35Å; R369-R373 WeakPolarHBondContact O-CG 3.37Å; R369-R373 PolarHBondContact O-N 3.47Å; R369-R373 VanDerWaalsContact O-N 3.16Å; R369-R373 PolarHBondContact O-NE 3.38Å; R370-R373 PolarHBondContact O-N 3.36Å; R373-K375 PolarHBondContact O-N 3.39Å; R373-G376 PolarHBondContact O-N 3.01Å
374	A	82.9	Confident	82.2	Confident	86 Å²	86	82.6 Å²	82.6	71%	0.711	41%	0.409	S	S	*	.	H	α-helix	trans	-61.8	-28.6	176.5	0	0	0	0	0	113	R370 N371 A372	R370-A374 PolarHBondContact O-N 3.31Å; N371-A374 PolarHBondContact O-N 3.45Å; A372-A374 VanDerWaalsContact C-N 3.35Å; A372-A374 PolarHBondContact O-N 3.1Å
375	K	76.3	Confident	81.5	Confident	134 Å²	134	85.5 Å²	85.5	58%	0.583	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	7.5	175.7	-62	-167.1	-167.1	166.3	0	113.9	N371 A372 R373 M377 Y382	N371-K375 PolarHBondContact O-N 2.93Å; A372-K375 CarbonylContact O-C 3.6Å; A372-K375 PolarHBondContact O-N 3.17Å; A372-K375 VanDerWaalsContact O-N 3.16Å; R373-K375 PolarHBondContact O-N 3.39Å; K375-M377 HydrophobicContact CB-CE 3.59Å; K375-M377 HydrophobicContact CB-CG 4.44Å; K375-M377 HydrophobicContact CD-CE 3.64Å; K375-M377 HydrophobicContact CG-CE 4.25Å; K375-M377 PolarHBondContact O-N 3.06Å; K375-Y382 HydrophobicContact CD-CD2 4.46Å; K375-Y382 HydrophobicContact CD-CE2 3.8Å; K375-Y382 HydrophobicContact CG-CE2 4.36Å
376	G	82.6	Confident	80.2	Confident	75 Å²	75	85.2 Å²	85.2	77%	0.773	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	22.5	-178.2	0	0	0	0	0	114.4	A372 R373	A372-G376 PolarHBondContact O-N 2.95Å; A372-G376 VanDerWaalsContact O-N 3.17Å; R373-G376 PolarHBondContact O-N 3.01Å
377	M	81.8	Confident	78.9	Confident	48 Å²	48	85.4 Å²	85.4	24%	0.236	41%	0.413	C	S	.	.			trans	-105.5	151.8	-177.9	-68.9	-169	-81.3	0	0	111.7	A372 K375 Y382	A372-M377 CarbonylContact C-O 3.56Å; A372-M377 PolarHBondContact O-N 3.41Å; K375-M377 HydrophobicContact CB-CE 3.59Å; K375-M377 HydrophobicContact CB-CG 4.44Å; K375-M377 HydrophobicContact CD-CE 3.64Å; K375-M377 HydrophobicContact CG-CE 4.25Å; K375-M377 PolarHBondContact O-N 3.06Å; M377-Y382 HydrophobicContact CE-CD2 3.57Å; M377-Y382 HydrophobicContact CE-CE2 4.13Å
378	T	86.4	Confident	78	Confident	96 Å²	96	83.4 Å²	83.4	59%	0.589	41%	0.405	S	S	*	.			trans	-67.5	150.8	168.5	60.1	0	0	0	0	110	Y380 K381 Y382	T378-Y380 VanDerWaalsContact C-N 3.32Å; T378-Y380 PolarHBondContact O-N 2.9Å; T378-K381 PolarHBondContact O-N 3.29Å; T378-K381 WeakPolarHBondContact OG1-CB 3.31Å; T378-K381 PolarHBondContact OG1-N 3.06Å; T378-Y382 WeakPolarHBondContact O-CB 3.26Å; T378-Y382 PolarHBondContact O-N 3.47Å
379	F	82.9	Confident	77	Confident	71 Å²	71	83.7 Å²	83.7	31%	0.311	41%	0.407	S	S	.	.	H	α-helix	trans	-56.1	-45.7	-179	174.9	-97.5	0	0	0	112.4	V365 L368 R369 Y382 V383 L395	V365-F379 HydrophobicContact CG1-CE2 4.39Å; V365-F379 HydrophobicContact CG1-CZ 4.41Å; L368-F379 HydrophobicContact CB-CD2 4.36Å; L368-F379 HydrophobicContact CB-CE2 3.74Å; L368-F379 HydrophobicContact CD2-CE2 4.47Å; R369-F379 HydrophobicContact CB-CD2 4.37Å; R369-F379 HydrophobicContact CG-CB 4.49Å; R369-F379 HydrophobicContact CG-CD2 3.42Å; R369-F379 VanDerWaalsContact CG-CD2 3.42Å; R369-F379 HydrophobicContact CG-CE2 3.87Å; R369-F379 HydrophobicContact CG-CG 4.16Å; F379-Y382 PolarHBondContact O-N 2.95Å; F379-V383 HydrophobicContact CD1-CG2 4.37Å; F379-V383 HydrophobicContact CD2-CG2 4.41Å; F379-V383 HydrophobicContact CE1-CG2 3.99Å; F379-V383 HydrophobicContact CE2-CG2 4.05Å; F379-V383 HydrophobicContact CZ-CG2 3.82Å; F379-V383 WeakPolarHBondContact O-CG2 3.48Å; F379-V383 PolarHBondContact O-N 2.81Å; F379-L395 HydrophobicContact CZ-CD2 4.35Å
380	Y	81.3	Confident	76	Confident	176 Å²	176	78.1 Å²	78.1	69%	0.69	39%	0.387	S	S	*	.	H	α-helix	trans	-60.6	-48.3	178.8	179.6	-97.9	0	0	0	111.8	T378 Y382 V383 M384	T378-Y380 VanDerWaalsContact C-N 3.32Å; T378-Y380 PolarHBondContact O-N 2.9Å; Y380-Y382 VanDerWaalsContact C-N 3.32Å; Y380-Y382 PolarHBondContact O-N 2.85Å; Y380-V383 PolarHBondContact O-N 2.8Å; Y380-M384 WeakPolarHBondContact O-CB 3.47Å; Y380-M384 PolarHBondContact O-N 3.43Å
381	K	79.4	Confident	75.2	Confident	99 Å²	99	72 Å²	72	43%	0.43	37%	0.368	S	S	.	.	H	α-helix	trans	-61.4	-42.8	177.1	-170.4	176.2	-175.9	-179.7	0	111	T378 V383 M384 E385	T378-K381 PolarHBondContact O-N 3.29Å; T378-K381 WeakPolarHBondContact OG1-CB 3.31Å; T378-K381 PolarHBondContact OG1-N 3.06Å; K381-V383 PolarHBondContact O-N 3.19Å; K381-M384 PolarHBondContact O-N 3.01Å; K381-E385 WeakPolarHBondContact CE-OE1 3.44Å; K381-E385 VanDerWaalsContact CE-OE2 3.29Å; K381-E385 WeakPolarHBondContact CE-OE2 3.43Å; K381-E385 VanDerWaalsContact CG-CD 3.48Å; K381-E385 HydrophobicContact CG-CG 4.18Å; K381-E385 WeakPolarHBondContact CG-OE1 3.4Å; K381-E385 IonicContact NZ-OE1 3.86Å; K381-E385 VanDerWaalsContact O-CB 3.24Å; K381-E385 WeakPolarHBondContact O-CB 3.33Å; K381-E385 WeakPolarHBondContact O-CG 3.29Å; K381-E385 PolarHBondContact O-N 3.13Å
382	Y	78	Confident	74.8	Confident	24 Å²	24	70.1 Å²	70.1	9%	0.094	36%	0.359	C	S	.	.	H	α-helix	trans	-60.3	-46.5	177.2	-173.2	-88.5	0	0	0	112.2	N371 A372 K375 M377 T378 F379 Y380 S386	N371-Y382 HydrophobicContact CB-CE1 4.22Å; N371-Y382 HydrophobicContact CB-CE2 4.22Å; N371-Y382 WeakPolarHBondContact CB-OH 3.27Å; A372-Y382 VanDerWaalsContact CA-CD2 3.44Å; A372-Y382 HydrophobicContact CB-CD1 4.25Å; A372-Y382 HydrophobicContact CB-CD2 3.87Å; A372-Y382 HydrophobicContact CB-CG 3.63Å; K375-Y382 HydrophobicContact CD-CD2 4.46Å; K375-Y382 HydrophobicContact CD-CE2 3.8Å; K375-Y382 HydrophobicContact CG-CE2 4.36Å; M377-Y382 HydrophobicContact CE-CD2 3.57Å; M377-Y382 HydrophobicContact CE-CE2 4.13Å; T378-Y382 WeakPolarHBondContact O-CB 3.26Å; T378-Y382 PolarHBondContact O-N 3.47Å; F379-Y382 PolarHBondContact O-N 2.95Å; Y380-Y382 VanDerWaalsContact C-N 3.32Å; Y380-Y382 PolarHBondContact O-N 2.85Å; Y382-S386 WeakPolarHBondContact CD1-OG 3.25Å; Y382-S386 WeakPolarHBondContact CE1-OG 3.46Å; Y382-S386 VanDerWaalsContact O-CA 3.31Å; Y382-S386 WeakPolarHBondContact O-CA 3.49Å; Y382-S386 WeakPolarHBondContact O-CB 3.28Å; Y382-S386 PolarHBondContact O-N 3.37Å; Y382-S386 PolarHBondContact O-OG 2.9Å
383	V	76.6	Confident	74.5	Confident	30 Å²	30	70.1 Å²	70.1	18%	0.182	36%	0.358	C	S	.	.	H	α-helix	trans	-65.1	-44.9	178.8	173.7	0	0	0	0	110.8	L368 F379 Y380 K381 S386 N392 L395	L368-V383 HydrophobicContact CD2-CG2 3.68Å; F379-V383 HydrophobicContact CD1-CG2 4.37Å; F379-V383 HydrophobicContact CD2-CG2 4.41Å; F379-V383 HydrophobicContact CE1-CG2 3.99Å; F379-V383 HydrophobicContact CE2-CG2 4.05Å; F379-V383 HydrophobicContact CZ-CG2 3.82Å; F379-V383 WeakPolarHBondContact O-CG2 3.48Å; F379-V383 PolarHBondContact O-N 2.81Å; Y380-V383 PolarHBondContact O-N 2.8Å; K381-V383 PolarHBondContact O-N 3.19Å; V383-S386 PolarHBondContact O-N 3.26Å; V383-N392 PolarHBondContact O-ND2 2.75Å; V383-N392 PolarHBondContact O-OD1 3.17Å; V383-L395 HydrophobicContact CG1-CD2 4.3Å; V383-L395 HydrophobicContact CG2-CD2 4.17Å
384	M	70.9	Confident	74.2	Confident	128 Å²	128	65.1 Å²	65.1	63%	0.631	35%	0.345	S	S	*	.	H	α-helix	trans	-69.5	-36.2	-177.8	-161	65.8	172.3	0	0	112.9	Y380 K381	Y380-M384 WeakPolarHBondContact O-CB 3.47Å; Y380-M384 PolarHBondContact O-N 3.43Å; K381-M384 PolarHBondContact O-N 3.01Å
385	E	67.9	Low	74.3	Confident	79 Å²	79	61.7 Å²	61.7	37%	0.369	31%	0.314	S	S	.	.	H	α-helix	trans	-92.9	-1.4	178.5	-64.4	-179.7	-178.6	0	0	113.5	K381 R387	K381-E385 WeakPolarHBondContact CE-OE1 3.44Å; K381-E385 VanDerWaalsContact CE-OE2 3.29Å; K381-E385 WeakPolarHBondContact CE-OE2 3.43Å; K381-E385 VanDerWaalsContact CG-CD 3.48Å; K381-E385 HydrophobicContact CG-CG 4.18Å; K381-E385 WeakPolarHBondContact CG-OE1 3.4Å; K381-E385 IonicContact NZ-OE1 3.86Å; K381-E385 VanDerWaalsContact O-CB 3.24Å; K381-E385 WeakPolarHBondContact O-CB 3.33Å; K381-E385 WeakPolarHBondContact O-CG 3.29Å; K381-E385 PolarHBondContact O-N 3.13Å; E385-R387 PolarHBondContact O-N 2.79Å; E385-R387 VanDerWaalsContact O-N 3.11Å
386	S	62.5	Low	74.7	Confident	16 Å²	16	57.6 Å²	57.6	11%	0.112	30%	0.298	C	S	.	.			trans	-63.1	117.2	-177.6	-90.4	0	0	0	0	111	Y382 V383 D388	Y382-S386 WeakPolarHBondContact CD1-OG 3.25Å; Y382-S386 WeakPolarHBondContact CE1-OG 3.46Å; Y382-S386 VanDerWaalsContact O-CA 3.31Å; Y382-S386 WeakPolarHBondContact O-CA 3.49Å; Y382-S386 WeakPolarHBondContact O-CB 3.28Å; Y382-S386 PolarHBondContact O-N 3.37Å; Y382-S386 PolarHBondContact O-OG 2.9Å; V383-S386 PolarHBondContact O-N 3.26Å; S386-D388 PolarHBondContact O-N 3.29Å
387	R	59.3	Low	74.9	Confident	94 Å²	94	54.4 Å²	54.4	36%	0.355	26%	0.263	S	S	.	.	S	Bend	trans	-74.6	-7.5	177.2	-67.2	-178.6	172.5	159	4.2	114	E385 P389 Q459 D483	E385-R387 PolarHBondContact O-N 2.79Å; E385-R387 VanDerWaalsContact O-N 3.11Å; R387-P389 WeakPolarHBondContact O-CD 3.1Å; R387-Q459 VanDerWaalsContact CZ-OE1 3.29Å; R387-D483 WeakPolarHBondContact CD-OD2 3.4Å; R387-D483 IonicContact NE-OD2 2.74Å
388	D	64	Low	75.3	Confident	51 Å²	51	52.8 Å²	52.8	27%	0.273	26%	0.256	S	S	.	.			trans	-99.4	91.4	173.7	-166.3	-14.2	0	0	0	110.5	R307 S386 S390 T391	R307-D388 VanDerWaalsContact CZ-CG 3.47Å; R307-D388 IonicContact CZ-OD1 3.51Å; R307-D388 IonicContact CZ-OD2 3.04Å; R307-D388 IonicContact NE-OD1 2.78Å; R307-D388 IonicContact NH1-OD1 2.67Å; R307-D388 PolarHBondContact NH1-OD1 2.69Å; R307-D388 IonicContact NH1-OD2 3.8Å; R307-D388 PolarHBondContact NH1-OD2 3.01Å; R307-D388 VanDerWaalsContact NH2-CG 3.3Å; R307-D388 IonicContact NH2-OD1 3.25Å; R307-D388 PolarHBondContact NH2-OD1 3.41Å; R307-D388 IonicContact NH2-OD2 3.75Å; R307-D388 PolarHBondContact NH2-OD2 3.12Å; S386-D388 PolarHBondContact O-N 3.29Å; D388-S390 PolarHBondContact O-N 2.94Å; D388-S390 PolarHBondContact OD1-N 3.37Å; D388-S390 VanDerWaalsContact OD1-N 3.09Å; D388-T391 PolarHBondContact O-N 3.41Å; D388-T391 VanDerWaalsContact O-N 3.09Å
389	P	62.9	Low	75.5	Confident	13 Å²	13	50.6 Å²	50.6	8%	0.084	24%	0.242	C	C	.	.	H	α-helix	trans	-60.9	-26.2	-179.7	22.6	-31.1	0	0	0	112.2	Y308 R387 T391 N392 V393	Y308-P389 HydrophobicContact CD1-CG 3.36Å; Y308-P389 HydrophobicContact CE1-CG 3.2Å; R387-P389 WeakPolarHBondContact O-CD 3.1Å; P389-T391 VanDerWaalsContact C-N 3.26Å; P389-T391 PolarHBondContact O-N 3.45Å; P389-N392 PolarHBondContact O-N 3.45Å; P389-V393 WeakPolarHBondContact O-CB 3.45Å; P389-V393 WeakPolarHBondContact O-CG2 3.4Å; P389-V393 PolarHBondContact O-N 3.4Å
390	S	64.9	Low	76	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.014	23%	0.228	C	C	.	.	H	α-helix	trans	-68.7	-27.5	178.3	-59.5	0	0	0	0	113.1	R307 D388 I394	R307-S390 WeakPolarHBondContact CG-OG 3.41Å; R307-S390 PolarHBondContact NE-OG 2.99Å; D388-S390 PolarHBondContact O-N 2.94Å; D388-S390 PolarHBondContact OD1-N 3.37Å; D388-S390 VanDerWaalsContact OD1-N 3.09Å; S390-I394 WeakPolarHBondContact O-CD1 3.28Å; S390-I394 VanDerWaalsContact O-CG1 3.25Å; S390-I394 WeakPolarHBondContact O-CG1 3.26Å; S390-I394 PolarHBondContact O-N 3.01Å
391	T	68.3	Low	76.5	Confident	45 Å²	45	39.2 Å²	39.2	28%	0.276	20%	0.197	S	C	.	.	H	α-helix	trans	-71.8	-39.9	175.1	-57.6	0	0	0	0	110.4	L368 D388 P389 L395	L368-T391 HydrophobicContact CD1-CG2 3.54Å; L368-T391 HydrophobicContact CD2-CG2 4.01Å; L368-T391 HydrophobicContact CG-CG2 3.78Å; D388-T391 PolarHBondContact O-N 3.41Å; D388-T391 VanDerWaalsContact O-N 3.09Å; P389-T391 VanDerWaalsContact C-N 3.26Å; P389-T391 PolarHBondContact O-N 3.45Å; T391-L395 PolarHBondContact O-N 2.89Å
392	N	73.1	Confident	77.2	Confident	20 Å²	20	35.5 Å²	35.5	11%	0.107	18%	0.183	C	C	.	.	H	α-helix	trans	-68.1	-37	174.8	-72.2	-4.6	0	0	0	112	V383 P389 L396	V383-N392 PolarHBondContact O-ND2 2.75Å; V383-N392 PolarHBondContact O-OD1 3.17Å; P389-N392 PolarHBondContact O-N 3.45Å; N392-L396 WeakPolarHBondContact O-CB 3.36Å; N392-L396 WeakPolarHBondContact O-CG 3.15Å; N392-L396 PolarHBondContact O-N 3.5Å
393	V	77.5	Confident	78	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.006	20%	0.198	C	C	.	.	H	α-helix	trans	-58.5	-55.2	175.9	169.9	0	0	0	0	110.5	L284 S311 P389 L395 L396 E397 L442	L284-V393 HydrophobicContact CD1-CG1 4.14Å; S311-V393 VanDerWaalsContact OG-CG2 3.31Å; S311-V393 WeakPolarHBondContact OG-CG2 3.4Å; P389-V393 WeakPolarHBondContact O-CB 3.45Å; P389-V393 WeakPolarHBondContact O-CG2 3.4Å; P389-V393 PolarHBondContact O-N 3.4Å; V393-L395 VanDerWaalsContact C-N 3.32Å; V393-L395 PolarHBondContact O-N 3.33Å; V393-L396 PolarHBondContact O-N 3.45Å; V393-E397 VanDerWaalsContact CG1-CD 3.43Å; V393-E397 HydrophobicContact CG1-CG 4.35Å; V393-E397 WeakPolarHBondContact CG1-OE1 3.36Å; V393-E397 WeakPolarHBondContact CG1-OE2 3.21Å; V393-E397 WeakPolarHBondContact O-CB 3.4Å; V393-E397 VanDerWaalsContact O-CG 3.28Å; V393-E397 WeakPolarHBondContact O-CG 3.44Å; V393-E397 PolarHBondContact O-N 2.87Å; V393-L442 HydrophobicContact CB-CD2 4.14Å; V393-L442 HydrophobicContact CG1-CD1 4.08Å; V393-L442 HydrophobicContact CG1-CD2 4.47Å; V393-L442 HydrophobicContact CG2-CD1 4.45Å; V393-L442 HydrophobicContact CG2-CD2 3.59Å
394	I	79.3	Confident	78.9	Confident	80 Å²	80	36.7 Å²	36.7	41%	0.41	19%	0.19	S	C	.	.	H	α-helix	trans	-59.4	-44.1	-178.6	-64.4	162.2	0	0	0	111	S390 L396 E397 D398	S390-I394 WeakPolarHBondContact O-CD1 3.28Å; S390-I394 VanDerWaalsContact O-CG1 3.25Å; S390-I394 WeakPolarHBondContact O-CG1 3.26Å; S390-I394 PolarHBondContact O-N 3.01Å; I394-L396 PolarHBondContact O-N 3.17Å; I394-E397 PolarHBondContact O-N 3.47Å; I394-D398 PolarHBondContact O-N 3.15Å
395	L	84.3	Confident	80	Confident	13 Å²	13	30.7 Å²	30.7	7%	0.068	16%	0.16	C	C	.	.	H	α-helix	trans	-60.9	-45.9	178.2	178.1	70.8	0	0	0	112.1	L361 V365 L368 F379 V383 T391 V393 E397 T399	L361-L395 HydrophobicContact CD1-CD1 3.84Å; V365-L395 HydrophobicContact CG2-CD1 3.63Å; L368-L395 HydrophobicContact CD2-CD2 4.02Å; F379-L395 HydrophobicContact CZ-CD2 4.35Å; V383-L395 HydrophobicContact CG1-CD2 4.3Å; V383-L395 HydrophobicContact CG2-CD2 4.17Å; T391-L395 PolarHBondContact O-N 2.89Å; V393-L395 VanDerWaalsContact C-N 3.32Å; V393-L395 PolarHBondContact O-N 3.33Å; L395-E397 VanDerWaalsContact C-N 3.33Å; L395-T399 VanDerWaalsContact O-CB 3.31Å; L395-T399 WeakPolarHBondContact O-CB 3.28Å; L395-T399 PolarHBondContact O-N 2.94Å; L395-T399 PolarHBondContact O-OG1 2.86Å
396	L	85.7	Confident	81.3	Confident	48 Å²	48	30.6 Å²	30.6	25%	0.251	16%	0.161	S	C	.	.	H	α-helix	trans	-68.3	-35.8	-179	-73.1	171.5	0	0	0	111.8	N392 V393 I394 A400 V438 F441 L442	N392-L396 WeakPolarHBondContact O-CB 3.36Å; N392-L396 WeakPolarHBondContact O-CG 3.15Å; N392-L396 PolarHBondContact O-N 3.5Å; V393-L396 PolarHBondContact O-N 3.45Å; I394-L396 PolarHBondContact O-N 3.17Å; L396-A400 VanDerWaalsContact O-CB 3.26Å; L396-A400 WeakPolarHBondContact O-CB 3.48Å; L396-A400 PolarHBondContact O-N 3.26Å; L396-V438 HydrophobicContact CB-CG1 4.06Å; L396-F441 HydrophobicContact CD1-CD1 3.34Å; L396-F441 HydrophobicContact CD1-CE1 3.36Å; L396-L442 HydrophobicContact CD1-CD2 3.85Å
397	E	86.4	Confident	82.9	Confident	9 Å²	9	32.4 Å²	32.4	4%	0.042	17%	0.169	C	C	.	.	H	α-helix	trans	-64.9	-53.2	174.8	-74.1	167.2	170.1	0	0	111.3	N280 I318 V393 I394 L395 T399 A400 A401	N280-E397 PolarHBondContact ND2-OE1 3.32Å; N280-E397 PolarHBondContact ND2-OE2 3.44Å; I318-E397 HydrophobicContact CD1-CG 4.48Å; I318-E397 WeakPolarHBondContact CD1-OE1 3.34Å; V393-E397 VanDerWaalsContact CG1-CD 3.43Å; V393-E397 HydrophobicContact CG1-CG 4.35Å; V393-E397 WeakPolarHBondContact CG1-OE1 3.36Å; V393-E397 WeakPolarHBondContact CG1-OE2 3.21Å; V393-E397 WeakPolarHBondContact O-CB 3.4Å; V393-E397 VanDerWaalsContact O-CG 3.28Å; V393-E397 WeakPolarHBondContact O-CG 3.44Å; V393-E397 PolarHBondContact O-N 2.87Å; I394-E397 PolarHBondContact O-N 3.47Å; L395-E397 VanDerWaalsContact C-N 3.33Å; E397-T399 VanDerWaalsContact C-N 3.26Å; E397-T399 PolarHBondContact O-N 3.09Å; E397-A400 WeakPolarHBondContact O-CB 3.5Å; E397-A400 PolarHBondContact O-N 3.45Å; E397-A401 PolarHBondContact O-N 2.94Å
398	D	89.1	Confident	84.6	Confident	14 Å²	14	27.9 Å²	27.9	8%	0.075	15%	0.152	C	C	.	.	H	α-helix	trans	-60.3	-37.3	177.6	-77.2	-17.3	0	0	0	111.6	L361 I394 A401 V402	L361-D398 HydrophobicContact CB-CB 4.06Å; L361-D398 HydrophobicContact CD1-CB 3.89Å; I394-D398 PolarHBondContact O-N 3.15Å; D398-A401 PolarHBondContact O-N 2.95Å; D398-V402 WeakPolarHBondContact O-CG2 3.35Å; D398-V402 PolarHBondContact O-N 2.63Å; D398-V402 VanDerWaalsContact O-N 3.13Å
399	T	91.5	Very high	86	Confident	49 Å²	49	26.8 Å²	26.8	30%	0.301	15%	0.15	S	C	.	.	H	α-helix	trans	-66.4	-42.6	175.2	-56.5	0	0	0	0	111.2	L361 L395 E397 A401 L403	L361-T399 WeakPolarHBondContact CD1-OG1 3.2Å; L395-T399 VanDerWaalsContact O-CB 3.31Å; L395-T399 WeakPolarHBondContact O-CB 3.28Å; L395-T399 PolarHBondContact O-N 2.94Å; L395-T399 PolarHBondContact O-OG1 2.86Å; E397-T399 VanDerWaalsContact C-N 3.26Å; E397-T399 PolarHBondContact O-N 3.09Å; T399-A401 VanDerWaalsContact C-N 3.34Å; T399-L403 HydrophobicContact CG2-CD1 4Å; T399-L403 HydrophobicContact CG2-CG 4.5Å; T399-L403 WeakPolarHBondContact O-CB 3.39Å; T399-L403 VanDerWaalsContact O-CG 3.31Å; T399-L403 WeakPolarHBondContact O-CG 3.24Å; T399-L403 PolarHBondContact O-N 3.45Å
400	A	92.6	Very high	87.5	Confident	2 Å²	2	30 Å²	30	2%	0.017	17%	0.169	C	C	.	.	H	α-helix	trans	-65.1	-38.5	177.2	0	0	0	0	0	111.7	L396 E397 G404 L434 L435 V438	L396-A400 VanDerWaalsContact O-CB 3.26Å; L396-A400 WeakPolarHBondContact O-CB 3.48Å; L396-A400 PolarHBondContact O-N 3.26Å; E397-A400 WeakPolarHBondContact O-CB 3.5Å; E397-A400 PolarHBondContact O-N 3.45Å; A400-G404 WeakPolarHBondContact O-CA 3.46Å; A400-G404 PolarHBondContact O-N 2.86Å; A400-L434 HydrophobicContact CB-CD2 4.49Å; A400-L434 HydrophobicContact CB-CG 4.42Å; A400-L434 WeakPolarHBondContact O-CD2 3.39Å; A400-L435 HydrophobicContact CB-CD2 4.39Å; A400-V438 HydrophobicContact CB-CG2 4.07Å
401	A	91.6	Very high	88.8	Confident	6 Å²	6	30.9 Å²	30.9	5%	0.05	18%	0.175	C	C	.	.	H	α-helix	trans	-61.9	-52.2	177.1	0	0	0	0	0	111.3	H273 E357 E397 D398 T399 L403 G404 V405	H273-A401 VanDerWaalsContact NE2-CA 3.32Å; H273-A401 WeakPolarHBondContact NE2-CA 3.46Å; H273-A401 WeakPolarHBondContact NE2-CB 3.39Å; H273-A401 PolarHBondContact NE2-N 3Å; E357-A401 HydrophobicContact CG-CB 4.38Å; E397-A401 PolarHBondContact O-N 2.94Å; D398-A401 PolarHBondContact O-N 2.95Å; T399-A401 VanDerWaalsContact C-N 3.34Å; A401-L403 PolarHBondContact O-N 3.24Å; A401-G404 PolarHBondContact O-N 2.98Å; A401-V405 WeakPolarHBondContact O-CG2 3.34Å; A401-V405 PolarHBondContact O-N 2.97Å
402	V	94.4	Very high	89.9	Confident	21 Å²	21	28.7 Å²	28.7	13%	0.127	16%	0.162	C	C	.	.	H	α-helix	trans	-60.9	-45.1	179	171	0	0	0	0	111.5	L354 E357 L361 D398 I406	L354-V402 HydrophobicContact CD1-CG1 3.9Å; E357-V402 HydrophobicContact CB-CG2 3.95Å; L361-V402 HydrophobicContact CD2-CB 4.34Å; L361-V402 HydrophobicContact CD2-CG2 4.03Å; D398-V402 WeakPolarHBondContact O-CG2 3.35Å; D398-V402 PolarHBondContact O-N 2.63Å; D398-V402 VanDerWaalsContact O-N 3.13Å; V402-I406 HydrophobicContact CG1-CD1 4.05Å; V402-I406 WeakPolarHBondContact O-CD1 3.43Å; V402-I406 VanDerWaalsContact O-CG1 3.27Å; V402-I406 WeakPolarHBondContact O-CG1 3.44Å; V402-I406 PolarHBondContact O-N 3.14Å; V402-I406 VanDerWaalsContact O-N 3.11Å
403	L	95.7	Very high	90.7	Very high	80 Å²	80	28.5 Å²	28.5	42%	0.419	17%	0.165	S	C	.	.	H	α-helix	trans	-66.4	-38.5	177.2	-71.6	176.2	0	0	0	112.1	T399 A401 I406 I407 L434	T399-L403 HydrophobicContact CG2-CD1 4Å; T399-L403 HydrophobicContact CG2-CG 4.5Å; T399-L403 WeakPolarHBondContact O-CB 3.39Å; T399-L403 VanDerWaalsContact O-CG 3.31Å; T399-L403 WeakPolarHBondContact O-CG 3.24Å; T399-L403 PolarHBondContact O-N 3.45Å; A401-L403 PolarHBondContact O-N 3.24Å; L403-I406 PolarHBondContact O-N 3.31Å; L403-I407 VanDerWaalsContact O-CG1 3.27Å; L403-I407 WeakPolarHBondContact O-CG1 3.46Å; L403-I407 PolarHBondContact O-N 2.83Å; L403-L434 HydrophobicContact CB-CD2 3.73Å; L403-L434 HydrophobicContact CD1-CD1 4.43Å
404	G	95	Very high	91.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-49.6	176.1	0	0	0	0	0	111.6	E270 A400 A401 I406 I407 A408	E270-G404 VanDerWaalsContact CD-C 3.46Å; E270-G404 WeakPolarHBondContact OE1-CA 3.34Å; A400-G404 WeakPolarHBondContact O-CA 3.46Å; A400-G404 PolarHBondContact O-N 2.86Å; A401-G404 PolarHBondContact O-N 2.98Å; G404-I406 VanDerWaalsContact C-N 3.3Å; G404-I406 PolarHBondContact O-N 2.95Å; G404-I407 PolarHBondContact O-N 2.84Å; G404-I407 VanDerWaalsContact O-N 3.16Å; G404-A408 WeakPolarHBondContact O-CB 3.46Å; G404-A408 PolarHBondContact O-N 3.37Å
405	V	94.4	Very high	91.9	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.012	17%	0.165	C	C	.	.	H	α-helix	trans	-57.6	-42.4	175	171.6	0	0	0	0	111.5	E270 L350 L354 E357 A401 A408 A409	E270-V405 PolarHBondContact OE1-N 3.36Å; E270-V405 WeakPolarHBondContact OE2-CG2 3.22Å; L350-V405 HydrophobicContact CB-CG1 4.22Å; L350-V405 HydrophobicContact CD2-CG1 4.2Å; L350-V405 HydrophobicContact CD2-CG2 4.47Å; L354-V405 HydrophobicContact CB-CG1 3.95Å; L354-V405 HydrophobicContact CD1-CB 4.35Å; L354-V405 HydrophobicContact CD1-CG1 4.05Å; E357-V405 VanDerWaalsContact OE2-CG2 3.29Å; E357-V405 WeakPolarHBondContact OE2-CG2 3.06Å; A401-V405 WeakPolarHBondContact O-CG2 3.34Å; A401-V405 PolarHBondContact O-N 2.97Å; V405-A408 PolarHBondContact O-N 3.31Å; V405-A409 WeakPolarHBondContact O-CB 3.41Å; V405-A409 PolarHBondContact O-N 2.72Å
406	I	95.8	Very high	92	Very high	76 Å²	76	31.2 Å²	31.2	39%	0.39	19%	0.186	S	C	.	.	H	α-helix	trans	-64.1	-45.3	177.8	-68.9	165.4	0	0	0	111	L354 V402 L403 G404 T410	L354-I406 HydrophobicContact CD1-CD1 4.35Å; L354-I406 HydrophobicContact CD1-CG1 3.97Å; V402-I406 HydrophobicContact CG1-CD1 4.05Å; V402-I406 WeakPolarHBondContact O-CD1 3.43Å; V402-I406 VanDerWaalsContact O-CG1 3.27Å; V402-I406 WeakPolarHBondContact O-CG1 3.44Å; V402-I406 PolarHBondContact O-N 3.14Å; V402-I406 VanDerWaalsContact O-N 3.11Å; L403-I406 PolarHBondContact O-N 3.31Å; G404-I406 VanDerWaalsContact C-N 3.3Å; G404-I406 PolarHBondContact O-N 2.95Å; I406-T410 VanDerWaalsContact O-CB 3.31Å; I406-T410 WeakPolarHBondContact O-CB 3.46Å; I406-T410 PolarHBondContact O-N 3.4Å; I406-T410 PolarHBondContact O-OG1 3.44Å
407	I	96	Very high	92.1	Very high	54 Å²	54	35.9 Å²	35.9	28%	0.277	21%	0.21	S	C	.	.	H	α-helix	trans	-60.8	-50.1	177.3	-69.6	165.3	0	0	0	109.8	L403 G404 T410 C411 V431 L434	L403-I407 VanDerWaalsContact O-CG1 3.27Å; L403-I407 WeakPolarHBondContact O-CG1 3.46Å; L403-I407 PolarHBondContact O-N 2.83Å; G404-I407 PolarHBondContact O-N 2.84Å; G404-I407 VanDerWaalsContact O-N 3.16Å; I407-T410 PolarHBondContact O-N 3.47Å; I407-C411 WeakPolarHBondContact O-CB 3.39Å; I407-C411 PolarHBondContact O-N 3.4Å; I407-V431 HydrophobicContact CB-CG2 4.28Å; I407-V431 HydrophobicContact CG2-CG2 4.04Å; I407-L434 HydrophobicContact CD1-CD2 4.2Å
408	A	93.7	Very high	92.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.3	-48.9	-179.7	0	0	0	0	0	111.9	E270 G404 V405 T410 C411 M412	E270-A408 HydrophobicContact CG-CB 3.57Å; G404-A408 WeakPolarHBondContact O-CB 3.46Å; G404-A408 PolarHBondContact O-N 3.37Å; V405-A408 PolarHBondContact O-N 3.31Å; A408-T410 VanDerWaalsContact C-N 3.32Å; A408-T410 PolarHBondContact O-N 2.84Å; A408-C411 PolarHBondContact O-N 3.42Å; A408-M412 WeakPolarHBondContact O-CB 3.35Å; A408-M412 VanDerWaalsContact O-CG 3.24Å; A408-M412 WeakPolarHBondContact O-CG 3.33Å; A408-M412 PolarHBondContact O-N 3.37Å
409	A	93.4	Very high	92.1	Very high	28 Å²	28	41.1 Å²	41.1	23%	0.231	26%	0.255	C	S	.	.	H	α-helix	trans	-60.6	-40.8	178.1	0	0	0	0	0	112	L350 V405 G413	L350-A409 HydrophobicContact CD1-CB 4.06Å; V405-A409 WeakPolarHBondContact O-CB 3.41Å; V405-A409 PolarHBondContact O-N 2.72Å; A409-G413 PolarHBondContact O-N 3.27Å
410	T	94	Very high	92	Very high	79 Å²	79	41.7 Å²	41.7	49%	0.485	26%	0.256	S	S	.	.	H	α-helix	trans	-67.3	-46.4	178.8	-54.8	0	0	0	0	111.3	I406 I407 A408 G413 L414	I406-T410 VanDerWaalsContact O-CB 3.31Å; I406-T410 WeakPolarHBondContact O-CB 3.46Å; I406-T410 PolarHBondContact O-N 3.4Å; I406-T410 PolarHBondContact O-OG1 3.44Å; I407-T410 PolarHBondContact O-N 3.47Å; A408-T410 VanDerWaalsContact C-N 3.32Å; A408-T410 PolarHBondContact O-N 2.84Å; T410-G413 WeakPolarHBondContact O-CA 3.43Å; T410-G413 PolarHBondContact O-N 3.08Å; T410-G413 VanDerWaalsContact O-N 3.14Å; T410-L414 WeakPolarHBondContact O-CG 3.42Å; T410-L414 PolarHBondContact O-N 3Å
411	C	93.3	Very high	91.8	Very high	21 Å²	21	42.8 Å²	42.8	14%	0.142	26%	0.263	C	S	.	.	H	α-helix	trans	-67.4	-41.3	-179.6	-81.9	0	0	0	0	113.2	I407 A408 G413 L414 T415 Y423 G427	I407-C411 WeakPolarHBondContact O-CB 3.39Å; I407-C411 PolarHBondContact O-N 3.4Å; A408-C411 PolarHBondContact O-N 3.42Å; C411-G413 VanDerWaalsContact C-N 3.27Å; C411-G413 PolarHBondContact O-N 3.36Å; C411-L414 PolarHBondContact O-N 3.45Å; C411-T415 PolarHBondContact O-N 3.32Å; C411-T415 PolarHBondContact O-OG1 2.94Å; C411-Y423 VanDerWaalsContact CB-O 3.23Å; C411-Y423 WeakPolarHBondContact CB-O 3.32Å; C411-Y423 PolarHBondContact SG-O 3.17Å; C411-Y423 VanDerWaalsContact SG-O 3.41Å; C411-G427 WeakPolarHBondContact SG-CA 3.34Å
412	M	90.8	Very high	91.8	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-63.8	-36.1	169.9	-67.8	-175.4	-17.6	0	0	111	M267 L343 A346 Y347 L350 A408 T415 S416	M267-M412 HydrophobicContact CB-SD 4.13Å; M267-M412 HydrophobicContact SD-SD 4.33Å; L343-M412 HydrophobicContact CD2-CB 4.38Å; L343-M412 HydrophobicContact CD2-CE 4.43Å; L343-M412 HydrophobicContact CD2-SD 4.43Å; A346-M412 HydrophobicContact CB-CE 4.25Å; Y347-M412 HydrophobicContact CD1-CE 4.33Å; Y347-M412 HydrophobicContact CE1-CB 4.46Å; Y347-M412 HydrophobicContact CE1-CE 3.98Å; Y347-M412 PolarHBondContact OH-O 3.25Å; Y347-M412 VanDerWaalsContact OH-O 3.11Å; L350-M412 HydrophobicContact CD1-CE 3.22Å; L350-M412 HydrophobicContact CD1-SD 4.23Å; L350-M412 HydrophobicContact CG-CE 4.42Å; A408-M412 WeakPolarHBondContact O-CB 3.35Å; A408-M412 VanDerWaalsContact O-CG 3.24Å; A408-M412 WeakPolarHBondContact O-CG 3.33Å; A408-M412 PolarHBondContact O-N 3.37Å; M412-T415 WeakPolarHBondContact O-CB 3.42Å; M412-T415 PolarHBondContact O-N 3.13Å; M412-S416 PolarHBondContact O-N 2.94Å
413	G	89.8	Confident	91.8	Very high	16 Å²	16	48.7 Å²	48.7	17%	0.165	29%	0.287	C	S	.	.	H	α-helix	trans	-60.1	-50.6	176.4	0	0	0	0	0	111.8	Y347 A409 T410 C411 T415 S416 I417	Y347-G413 WeakPolarHBondContact OH-CA 3.27Å; Y347-G413 PolarHBondContact OH-N 3.22Å; A409-G413 PolarHBondContact O-N 3.27Å; T410-G413 WeakPolarHBondContact O-CA 3.43Å; T410-G413 PolarHBondContact O-N 3.08Å; T410-G413 VanDerWaalsContact O-N 3.14Å; C411-G413 VanDerWaalsContact C-N 3.27Å; C411-G413 PolarHBondContact O-N 3.36Å; G413-T415 VanDerWaalsContact C-N 3.29Å; G413-T415 PolarHBondContact O-N 3.22Å; G413-S416 WeakPolarHBondContact O-CB 3.35Å; G413-S416 PolarHBondContact O-N 3.31Å; G413-I417 WeakPolarHBondContact O-CG1 3.25Å; G413-I417 PolarHBondContact O-N 2.87Å
414	L	91.3	Very high	91.7	Very high	71 Å²	71	45.2 Å²	45.2	37%	0.372	27%	0.269	S	S	.	.	H	α-helix	trans	-60.2	-40.9	174.8	-69.3	173.4	0	0	0	111.5	T410 C411 S416 I417 T418 Y423	T410-L414 WeakPolarHBondContact O-CG 3.42Å; T410-L414 PolarHBondContact O-N 3Å; C411-L414 PolarHBondContact O-N 3.45Å; L414-S416 VanDerWaalsContact C-N 3.35Å; L414-S416 PolarHBondContact O-N 3.44Å; L414-I417 PolarHBondContact O-N 2.86Å; L414-T418 VanDerWaalsContact O-CB 3.3Å; L414-T418 WeakPolarHBondContact O-CB 3.5Å; L414-T418 WeakPolarHBondContact O-CG2 3.36Å; L414-T418 PolarHBondContact O-N 2.9Å; L414-T418 PolarHBondContact O-OG1 3.34Å; L414-Y423 HydrophobicContact CB-CD1 4.24Å; L414-Y423 HydrophobicContact CB-CD2 4.15Å; L414-Y423 HydrophobicContact CB-CG 3.86Å; L414-Y423 HydrophobicContact CD1-CD1 4.07Å; L414-Y423 HydrophobicContact CD1-CE1 4.47Å
415	T	90.3	Very high	91.6	Very high	8 Å²	8	45.4 Å²	45.4	5%	0.049	27%	0.27	C	S	.	.	H	α-helix	trans	-62.3	-42.3	176	-55.7	0	0	0	0	111.8	I340 C411 M412 G413 I417 G419 N420 Y423 D424	I340-T415 HydrophobicContact CD1-CG2 3.48Å; I340-T415 VanDerWaalsContact CD1-CG2 3.48Å; I340-T415 HydrophobicContact CG1-CG2 4.14Å; C411-T415 PolarHBondContact O-N 3.32Å; C411-T415 PolarHBondContact O-OG1 2.94Å; M412-T415 WeakPolarHBondContact O-CB 3.42Å; M412-T415 PolarHBondContact O-N 3.13Å; G413-T415 VanDerWaalsContact C-N 3.29Å; G413-T415 PolarHBondContact O-N 3.22Å; T415-I417 PolarHBondContact O-N 2.81Å; T415-G419 VanDerWaalsContact O-CA 3.22Å; T415-G419 WeakPolarHBondContact O-CA 3.42Å; T415-G419 PolarHBondContact O-N 3.34Å; T415-N420 WeakPolarHBondContact CG2-O 3.32Å; T415-Y423 WeakPolarHBondContact OG1-CB 3.46Å; T415-D424 HydrophobicContact CG2-CB 4.48Å; T415-D424 WeakPolarHBondContact OG1-CB 3.42Å; T415-D424 PolarHBondContact OG1-N 3.38Å
416	S	86.8	Confident	91.7	Very high	72 Å²	72	49.5 Å²	49.5	50%	0.503	29%	0.291	S	S	.	.	H	α-helix	trans	-64	-38.7	178.3	-166.1	0	0	0	0	113.2	L343 M412 G413 L414	L343-S416 VanDerWaalsContact CD1-CB 3.46Å; M412-S416 PolarHBondContact O-N 2.94Å; G413-S416 WeakPolarHBondContact O-CB 3.35Å; G413-S416 PolarHBondContact O-N 3.31Å; L414-S416 VanDerWaalsContact C-N 3.35Å; L414-S416 PolarHBondContact O-N 3.44Å
417	I	89.3	Confident	91.7	Very high	146 Å²	146	45.9 Å²	45.9	75%	0.749	27%	0.273	S	S	*	.	H	α-helix	trans	-83.1	-41.6	-175	-63.8	166.3	0	0	0	110.8	G413 L414 T415	G413-I417 WeakPolarHBondContact O-CG1 3.25Å; G413-I417 PolarHBondContact O-N 2.87Å; L414-I417 PolarHBondContact O-N 2.86Å; T415-I417 PolarHBondContact O-N 2.81Å
418	T	89	Confident	91.7	Very high	72 Å²	72	43.3 Å²	43.3	44%	0.442	26%	0.259	S	S	.	.	H	α-helix	trans	-86.9	-19.1	-176.7	64.2	0	0	0	0	113.3	L414 N420 Y423	L414-T418 VanDerWaalsContact O-CB 3.3Å; L414-T418 WeakPolarHBondContact O-CB 3.5Å; L414-T418 WeakPolarHBondContact O-CG2 3.36Å; L414-T418 PolarHBondContact O-N 2.9Å; L414-T418 PolarHBondContact O-OG1 3.34Å; T418-N420 PolarHBondContact O-N 3.11Å; T418-N420 PolarHBondContact OG1-N 3.3Å; T418-Y423 HydrophobicContact CG2-CE2 4Å; T418-Y423 WeakPolarHBondContact OG1-CD2 3.02Å; T418-Y423 WeakPolarHBondContact OG1-CE2 3.32Å
419	G	85.6	Confident	91.8	Very high	60 Å²	60	45.1 Å²	45.1	62%	0.619	27%	0.269	S	S	*	.			trans	70.5	6.8	-171.1	0	0	0	0	0	114.2	T415 P421	T415-G419 VanDerWaalsContact O-CA 3.22Å; T415-G419 WeakPolarHBondContact O-CA 3.42Å; T415-G419 PolarHBondContact O-N 3.34Å; G419-P421 WeakPolarHBondContact O-CD 3.39Å
420	N	89.8	Confident	92	Very high	61 Å²	61	45 Å²	45	33%	0.326	27%	0.271	S	S	.	.			trans	-98.1	110	-176.1	-174.7	-12.1	0	0	0	111.7	T415 T418 L422 Y423	T415-N420 WeakPolarHBondContact CG2-O 3.32Å; T418-N420 PolarHBondContact O-N 3.11Å; T418-N420 PolarHBondContact OG1-N 3.3Å; N420-L422 PolarHBondContact O-N 2.91Å; N420-L422 VanDerWaalsContact O-N 3.09Å; N420-L422 VanDerWaalsContact OD1-CB 3.26Å; N420-L422 WeakPolarHBondContact OD1-CB 3.18Å; N420-L422 WeakPolarHBondContact OD1-CG 3.31Å; N420-L422 PolarHBondContact OD1-N 3.2Å; N420-Y423 HydrophobicContact CB-CD2 4.05Å; N420-Y423 HydrophobicContact CB-CE2 4.08Å; N420-Y423 PolarHBondContact O-N 3.49Å
421	P	88.5	Confident	92.1	Very high	25 Å²	25	41.3 Å²	41.3	16%	0.162	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-11.3	-178.3	-20	33.3	0	0	0	115.3	P337 Q338 G419 Y423 D424 S425	P337-P421 HydrophobicContact CB-CB 4.34Å; Q338-P421 VanDerWaalsContact O-CB 3.32Å; Q338-P421 WeakPolarHBondContact O-CB 3.27Å; Q338-P421 WeakPolarHBondContact O-CG 3.33Å; G419-P421 WeakPolarHBondContact O-CD 3.39Å; P421-Y423 VanDerWaalsContact C-N 3.26Å; P421-Y423 PolarHBondContact O-N 2.75Å; P421-D424 PolarHBondContact O-N 3.16Å; P421-S425 PolarHBondContact O-N 3.44Å; P421-S425 PolarHBondContact O-OG 3.33Å
422	L	92.2	Very high	92.2	Very high	62 Å²	62	40.3 Å²	40.3	33%	0.325	24%	0.241	S	C	.	.	H	α-helix	trans	-63.7	-33	179.2	-63.7	176.6	0	0	0	112.1	L334 P337 N420 D424 S425 L426	L334-L422 HydrophobicContact CD2-CB 4.47Å; L334-L422 HydrophobicContact CD2-CD2 3.78Å; P337-L422 HydrophobicContact CG-CD2 4.06Å; N420-L422 PolarHBondContact O-N 2.91Å; N420-L422 VanDerWaalsContact O-N 3.09Å; N420-L422 VanDerWaalsContact OD1-CB 3.26Å; N420-L422 WeakPolarHBondContact OD1-CB 3.18Å; N420-L422 WeakPolarHBondContact OD1-CG 3.31Å; N420-L422 PolarHBondContact OD1-N 3.2Å; L422-D424 VanDerWaalsContact C-N 3.3Å; L422-D424 PolarHBondContact O-N 2.91Å; L422-S425 PolarHBondContact O-N 2.71Å; L422-L426 WeakPolarHBondContact O-CG 3.39Å; L422-L426 PolarHBondContact O-N 3.16Å
423	Y	93.3	Very high	92.6	Very high	90 Å²	90	43.6 Å²	43.6	35%	0.353	26%	0.262	S	S	.	.	H	α-helix	trans	-63.9	-36.6	179.1	-69.3	-69.3	0	0	0	112.2	C411 L414 T415 T418 N420 P421 L426 G427	C411-Y423 VanDerWaalsContact CB-O 3.23Å; C411-Y423 WeakPolarHBondContact CB-O 3.32Å; C411-Y423 PolarHBondContact SG-O 3.17Å; C411-Y423 VanDerWaalsContact SG-O 3.41Å; L414-Y423 HydrophobicContact CB-CD1 4.24Å; L414-Y423 HydrophobicContact CB-CD2 4.15Å; L414-Y423 HydrophobicContact CB-CG 3.86Å; L414-Y423 HydrophobicContact CD1-CD1 4.07Å; L414-Y423 HydrophobicContact CD1-CE1 4.47Å; T415-Y423 WeakPolarHBondContact OG1-CB 3.46Å; T418-Y423 HydrophobicContact CG2-CE2 4Å; T418-Y423 WeakPolarHBondContact OG1-CD2 3.02Å; T418-Y423 WeakPolarHBondContact OG1-CE2 3.32Å; N420-Y423 HydrophobicContact CB-CD2 4.05Å; N420-Y423 HydrophobicContact CB-CE2 4.08Å; N420-Y423 PolarHBondContact O-N 3.49Å; P421-Y423 VanDerWaalsContact C-N 3.26Å; P421-Y423 PolarHBondContact O-N 2.75Å; Y423-L426 PolarHBondContact O-N 2.78Å; Y423-G427 PolarHBondContact O-N 2.83Å
424	D	93.1	Very high	92.9	Very high	7 Å²	7	44.6 Å²	44.6	4%	0.037	26%	0.263	C	S	.	.	H	α-helix	trans	-67.5	-39.6	174.3	-176.8	49.6	0	0	0	112.4	S264 A265 S266 I340 T415 P421 L422 L426 G427 S428	S264-D424 VanDerWaalsContact CA-OD2 3.27Å; S264-D424 WeakPolarHBondContact CA-OD2 3.29Å; S264-D424 WeakPolarHBondContact CB-OD2 3.19Å; S264-D424 VanDerWaalsContact OG-CG 3.22Å; S264-D424 PolarHBondContact OG-OD1 3.03Å; S264-D424 PolarHBondContact OG-OD2 3.07Å; S264-D424 VanDerWaalsContact OG-OD2 3.1Å; A265-D424 PolarHBondContact N-OD2 3.29Å; S266-D424 WeakPolarHBondContact CB-OD1 3.35Å; S266-D424 PolarHBondContact N-OD1 2.86Å; S266-D424 PolarHBondContact OG-O 2.8Å; S266-D424 PolarHBondContact OG-OD1 3.04Å; I340-D424 HydrophobicContact CD1-CB 3.45Å; I340-D424 VanDerWaalsContact CD1-CB 3.45Å; I340-D424 VanDerWaalsContact CD1-CG 3.45Å; I340-D424 WeakPolarHBondContact CD1-OD2 3.11Å; T415-D424 HydrophobicContact CG2-CB 4.48Å; T415-D424 WeakPolarHBondContact OG1-CB 3.42Å; T415-D424 PolarHBondContact OG1-N 3.38Å; P421-D424 PolarHBondContact O-N 3.16Å; L422-D424 VanDerWaalsContact C-N 3.3Å; L422-D424 PolarHBondContact O-N 2.91Å; D424-L426 VanDerWaalsContact C-N 3.32Å; D424-L426 PolarHBondContact O-N 2.96Å; D424-G427 PolarHBondContact O-N 2.78Å; D424-G427 VanDerWaalsContact O-N 3.14Å; D424-S428 PolarHBondContact O-N 3.26Å
425	S	94.4	Very high	93	Very high	4 Å²	4	41.3 Å²	41.3	3%	0.028	25%	0.246	C	C	.	.	H	α-helix	trans	-65	-38.1	174.5	-58.9	0	0	0	0	111.7	G330 G333 P421 L422 G427 S428 L429	G330-S425 WeakPolarHBondContact CA-O 3.47Å; G333-S425 VanDerWaalsContact CA-OG 3.24Å; G333-S425 WeakPolarHBondContact CA-OG 3.45Å; G333-S425 PolarHBondContact O-OG 2.93Å; P421-S425 PolarHBondContact O-N 3.44Å; P421-S425 PolarHBondContact O-OG 3.33Å; L422-S425 PolarHBondContact O-N 2.71Å; S425-G427 VanDerWaalsContact C-N 3.33Å; S425-S428 WeakPolarHBondContact O-CB 3.34Å; S425-S428 PolarHBondContact O-N 2.84Å; S425-L429 WeakPolarHBondContact O-CG 3.35Å; S425-L429 PolarHBondContact O-N 3.29Å; S425-L429 VanDerWaalsContact O-N 3.08Å
426	L	95.4	Very high	93.3	Very high	88 Å²	88	41.3 Å²	41.3	46%	0.461	25%	0.247	S	C	.	.	H	α-helix	trans	-65.8	-35.1	171.7	-69.4	175.2	0	0	0	112.3	L334 L422 Y423 D424 L429 G430	L334-L426 HydrophobicContact CD2-CD2 4.43Å; L334-L426 HydrophobicContact CD2-CG 4.49Å; L422-L426 WeakPolarHBondContact O-CG 3.39Å; L422-L426 PolarHBondContact O-N 3.16Å; Y423-L426 PolarHBondContact O-N 2.78Å; D424-L426 VanDerWaalsContact C-N 3.32Å; D424-L426 PolarHBondContact O-N 2.96Å; L426-L429 HydrophobicContact CD2-CD1 4.42Å; L426-L429 PolarHBondContact O-N 2.92Å; L426-G430 PolarHBondContact O-N 2.97Å
427	G	95.1	Very high	93.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.2	-47.2	173.2	0	0	0	0	0	111.7	S266 C411 Y423 D424 S425 L429 G430 V431	S266-G427 WeakPolarHBondContact OG-CA 3.42Å; C411-G427 WeakPolarHBondContact SG-CA 3.34Å; Y423-G427 PolarHBondContact O-N 2.83Å; D424-G427 PolarHBondContact O-N 2.78Å; D424-G427 VanDerWaalsContact O-N 3.14Å; S425-G427 VanDerWaalsContact C-N 3.33Å; G427-L429 VanDerWaalsContact C-N 3.34Å; G427-L429 PolarHBondContact O-N 2.51Å; G427-G430 WeakPolarHBondContact O-CA 3.02Å; G427-G430 PolarHBondContact O-N 3.03Å; G427-G430 VanDerWaalsContact O-N 3.09Å; G427-V431 WeakPolarHBondContact O-CG2 3.47Å; G427-V431 PolarHBondContact O-N 3.49Å
428	S	95.8	Very high	93.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-55.2	-44.8	172.6	-168.7	0	0	0	0	112.6	A265 S266 S269 S326 G330 D424 S425 G432	A265-S428 WeakPolarHBondContact O-CB 3.47Å; A265-S428 PolarHBondContact O-OG 3.25Å; S266-S428 PolarHBondContact OG-N 3.4Å; S269-S428 WeakPolarHBondContact OG-CA 3.5Å; S269-S428 PolarHBondContact OG-OG 2.94Å; S326-S428 PolarHBondContact O-OG 3.41Å; G330-S428 PolarHBondContact N-OG 2.86Å; D424-S428 PolarHBondContact O-N 3.26Å; S425-S428 WeakPolarHBondContact O-CB 3.34Å; S425-S428 PolarHBondContact O-N 2.84Å; S428-G432 PolarHBondContact O-N 3.26Å
429	L	96.9	Very high	94	Very high	37 Å²	37	33 Å²	33	19%	0.194	20%	0.2	C	C	.	.	H	α-helix	trans	-66	-38.4	174.9	-68.3	-178.6	0	0	0	112.7	W327 V331 L334 S425 L426 G427 G432 T433	W327-L429 HydrophobicContact CB-CD2 4.47Å; V331-L429 HydrophobicContact CG2-CD2 4.02Å; L334-L429 HydrophobicContact CD1-CD1 3.63Å; S425-L429 WeakPolarHBondContact O-CG 3.35Å; S425-L429 PolarHBondContact O-N 3.29Å; S425-L429 VanDerWaalsContact O-N 3.08Å; L426-L429 HydrophobicContact CD2-CD1 4.42Å; L426-L429 PolarHBondContact O-N 2.92Å; G427-L429 VanDerWaalsContact C-N 3.34Å; G427-L429 PolarHBondContact O-N 2.51Å; L429-G432 PolarHBondContact O-N 2.9Å; L429-T433 WeakPolarHBondContact O-CB 3.29Å; L429-T433 PolarHBondContact O-N 3.09Å; L429-T433 PolarHBondContact O-OG1 3.41Å
430	G	97.3	Very high	94.3	Very high	27 Å²	27	32.5 Å²	32.5	28%	0.278	19%	0.19	S	C	.	.	H	α-helix	trans	-63.1	-50.5	177.3	0	0	0	0	0	111.9	L426 G427 T433 L434	L426-G430 PolarHBondContact O-N 2.97Å; G427-G430 WeakPolarHBondContact O-CA 3.02Å; G427-G430 PolarHBondContact O-N 3.03Å; G427-G430 VanDerWaalsContact O-N 3.09Å; G430-T433 PolarHBondContact O-N 3.39Å; G430-L434 PolarHBondContact O-N 3.4Å
431	V	96.1	Very high	94.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.1	-48.7	174.3	176.5	0	0	0	0	110	I407 G427 T433 L434 L435	I407-V431 HydrophobicContact CB-CG2 4.28Å; I407-V431 HydrophobicContact CG2-CG2 4.04Å; G427-V431 WeakPolarHBondContact O-CG2 3.47Å; G427-V431 PolarHBondContact O-N 3.49Å; V431-T433 VanDerWaalsContact C-N 3.28Å; V431-T433 PolarHBondContact O-N 2.92Å; V431-L434 WeakPolarHBondContact O-CB 3.38Å; V431-L434 PolarHBondContact O-N 2.8Å; V431-L434 VanDerWaalsContact O-N 3.15Å; V431-L435 HydrophobicContact CG1-CD1 4.28Å; V431-L435 HydrophobicContact CG1-CG 4.38Å; V431-L435 WeakPolarHBondContact O-CG 3.39Å; V431-L435 PolarHBondContact O-N 2.79Å
432	G	96.6	Very high	94.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-56.5	-40.6	177.3	0	0	0	0	0	113.4	A323 S326 S428 L429 L435 G436	A323-G432 WeakPolarHBondContact CB-O 3.22Å; S326-G432 VanDerWaalsContact CB-CA 3.45Å; S428-G432 PolarHBondContact O-N 3.26Å; L429-G432 PolarHBondContact O-N 2.9Å; G432-L435 PolarHBondContact O-N 3.34Å; G432-G436 PolarHBondContact O-N 2.93Å
433	T	97.4	Very high	94.2	Very high	70 Å²	70	31.5 Å²	31.5	43%	0.429	18%	0.179	S	C	.	.	H	α-helix	trans	-68.6	-42.3	177.5	-56.2	0	0	0	0	112	W327 L429 G430 V431 L435 G436 V437	W327-T433 PolarHBondContact NE1-OG1 3.02Å; W327-T433 VanDerWaalsContact NE1-OG1 3.14Å; L429-T433 WeakPolarHBondContact O-CB 3.29Å; L429-T433 PolarHBondContact O-N 3.09Å; L429-T433 PolarHBondContact O-OG1 3.41Å; G430-T433 PolarHBondContact O-N 3.39Å; V431-T433 VanDerWaalsContact C-N 3.28Å; V431-T433 PolarHBondContact O-N 2.92Å; T433-L435 VanDerWaalsContact C-N 3.34Å; T433-L435 PolarHBondContact O-N 2.89Å; T433-G436 PolarHBondContact O-N 3.36Å; T433-V437 WeakPolarHBondContact O-CG2 3.48Å; T433-V437 PolarHBondContact O-N 2.77Å
434	L	95.9	Very high	94.1	Very high	36 Å²	36	34 Å²	34	19%	0.188	19%	0.189	C	C	.	.	H	α-helix	trans	-56.5	-48.7	173.6	174.8	64.9	0	0	0	111	A400 L403 I407 G430 V431 G436 V437 V438	A400-L434 HydrophobicContact CB-CD2 4.49Å; A400-L434 HydrophobicContact CB-CG 4.42Å; A400-L434 WeakPolarHBondContact O-CD2 3.39Å; L403-L434 HydrophobicContact CB-CD2 3.73Å; L403-L434 HydrophobicContact CD1-CD1 4.43Å; I407-L434 HydrophobicContact CD1-CD2 4.2Å; G430-L434 PolarHBondContact O-N 3.4Å; V431-L434 WeakPolarHBondContact O-CB 3.38Å; V431-L434 PolarHBondContact O-N 2.8Å; V431-L434 VanDerWaalsContact O-N 3.15Å; L434-G436 VanDerWaalsContact C-N 3.32Å; L434-G436 PolarHBondContact O-N 2.87Å; L434-V437 PolarHBondContact O-N 3.33Å; L434-V438 HydrophobicContact CD1-CG2 4.44Å; L434-V438 WeakPolarHBondContact O-CG2 3.17Å; L434-V438 PolarHBondContact O-N 3.46Å
435	L	94.6	Very high	93.7	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-63.2	-39.1	176.1	-60.7	-175.1	0	0	0	112.1	H273 A323 A400 V431 G432 T433 V437 V438 S439	H273-L435 HydrophobicContact CB-CD1 3.96Å; H273-L435 WeakPolarHBondContact CE1-CD2 3.34Å; H273-L435 WeakPolarHBondContact ND1-CD2 3.29Å; A323-L435 HydrophobicContact CB-CB 4.14Å; A400-L435 HydrophobicContact CB-CD2 4.39Å; V431-L435 HydrophobicContact CG1-CD1 4.28Å; V431-L435 HydrophobicContact CG1-CG 4.38Å; V431-L435 WeakPolarHBondContact O-CG 3.39Å; V431-L435 PolarHBondContact O-N 2.79Å; G432-L435 PolarHBondContact O-N 3.34Å; T433-L435 VanDerWaalsContact C-N 3.34Å; T433-L435 PolarHBondContact O-N 2.89Å; L435-V437 PolarHBondContact O-N 2.77Å; L435-V438 PolarHBondContact O-N 3.25Å; L435-S439 WeakPolarHBondContact O-CB 3.36Å; L435-S439 PolarHBondContact O-N 3.49Å; L435-S439 PolarHBondContact O-OG 2.83Å
436	G	95.7	Very high	93.3	Very high	7 Å²	7	34.5 Å²	34.5	7%	0.072	19%	0.192	C	C	.	.	H	α-helix	trans	-59.7	-45.1	176.7	0	0	0	0	0	112.4	G432 T433 L434 S439 A440	G432-G436 PolarHBondContact O-N 2.93Å; T433-G436 PolarHBondContact O-N 3.36Å; L434-G436 VanDerWaalsContact C-N 3.32Å; L434-G436 PolarHBondContact O-N 2.87Å; G436-S439 PolarHBondContact O-OG 3.31Å; G436-S439 VanDerWaalsContact O-OG 3.09Å; G436-A440 WeakPolarHBondContact O-CB 3.41Å; G436-A440 PolarHBondContact O-N 2.89Å
437	V	95.1	Very high	93	Very high	98 Å²	98	32.8 Å²	32.8	59%	0.594	19%	0.185	S	C	*	.	H	α-helix	trans	-66.8	-48.8	178.3	171.9	0	0	0	0	111.2	T433 L434 L435 A440 F441	T433-V437 WeakPolarHBondContact O-CG2 3.48Å; T433-V437 PolarHBondContact O-N 2.77Å; L434-V437 PolarHBondContact O-N 3.33Å; L435-V437 PolarHBondContact O-N 2.77Å; V437-A440 PolarHBondContact O-N 3.08Å; V437-F441 PolarHBondContact O-N 3.38Å
438	V	91.8	Very high	92.6	Very high	19 Å²	19	35.8 Å²	35.8	12%	0.115	20%	0.199	C	C	.	.	H	α-helix	trans	-62.2	-49.2	-179.6	170.9	0	0	0	0	110.6	L396 A400 L434 L435 A440 F441 L442	L396-V438 HydrophobicContact CB-CG1 4.06Å; A400-V438 HydrophobicContact CB-CG2 4.07Å; L434-V438 HydrophobicContact CD1-CG2 4.44Å; L434-V438 WeakPolarHBondContact O-CG2 3.17Å; L434-V438 PolarHBondContact O-N 3.46Å; L435-V438 PolarHBondContact O-N 3.25Å; V438-A440 PolarHBondContact O-N 2.86Å; V438-F441 WeakPolarHBondContact O-CB 3.33Å; V438-F441 PolarHBondContact O-N 2.96Å; V438-L442 HydrophobicContact CG1-CD1 4.38Å; V438-L442 HydrophobicContact CG1-CG 4.42Å; V438-L442 WeakPolarHBondContact O-CG 3.38Å; V438-L442 PolarHBondContact O-N 3.19Å
439	S	92.9	Very high	92	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.4	-38.8	178.5	57.7	0	0	0	0	113	G315 F319 L435 G436 F441 L442 I443	G315-S439 WeakPolarHBondContact O-CB 3.42Å; F319-S439 WeakPolarHBondContact CA-OG 3.06Å; F319-S439 WeakPolarHBondContact CB-OG 3.45Å; F319-S439 WeakPolarHBondContact CD2-OG 3.19Å; L435-S439 WeakPolarHBondContact O-CB 3.36Å; L435-S439 PolarHBondContact O-N 3.49Å; L435-S439 PolarHBondContact O-OG 2.83Å; G436-S439 PolarHBondContact O-OG 3.31Å; G436-S439 VanDerWaalsContact O-OG 3.09Å; S439-F441 VanDerWaalsContact C-N 3.33Å; S439-F441 PolarHBondContact O-N 3.48Å; S439-L442 PolarHBondContact O-N 3.29Å; S439-I443 WeakPolarHBondContact O-CB 3.29Å; S439-I443 WeakPolarHBondContact O-CD1 3.42Å; S439-I443 WeakPolarHBondContact O-CG1 3.35Å; S439-I443 PolarHBondContact O-N 2.92Å
440	A	93.3	Very high	91.6	Very high	49 Å²	49	37.1 Å²	37.1	41%	0.405	21%	0.208	S	C	.	.	H	α-helix	trans	-60.4	-42.2	173.7	0	0	0	0	0	111.9	G436 V437 V438 I443 Y444	G436-A440 WeakPolarHBondContact O-CB 3.41Å; G436-A440 PolarHBondContact O-N 2.89Å; V437-A440 PolarHBondContact O-N 3.08Å; V438-A440 PolarHBondContact O-N 2.86Å; A440-I443 PolarHBondContact O-N 2.86Å; A440-Y444 WeakPolarHBondContact O-CB 3.43Å; A440-Y444 PolarHBondContact O-N 3.37Å
441	F	89.4	Confident	91.1	Very high	83 Å²	83	42 Å²	42	36%	0.364	23%	0.227	S	C	.	.	H	α-helix	trans	-63.2	-43.1	173.9	179	-92.2	0	0	0	112	L396 V437 V438 S439 Y444 T445	L396-F441 HydrophobicContact CD1-CD1 3.34Å; L396-F441 HydrophobicContact CD1-CE1 3.36Å; V437-F441 PolarHBondContact O-N 3.38Å; V438-F441 WeakPolarHBondContact O-CB 3.33Å; V438-F441 PolarHBondContact O-N 2.96Å; S439-F441 VanDerWaalsContact C-N 3.33Å; S439-F441 PolarHBondContact O-N 3.48Å; F441-Y444 PolarHBondContact O-N 3.25Å; F441-T445 HydrophobicContact CD1-CG2 4.13Å; F441-T445 HydrophobicContact CD2-CG2 4.31Å; F441-T445 HydrophobicContact CE1-CG2 3.68Å; F441-T445 HydrophobicContact CE2-CG2 3.89Å; F441-T445 HydrophobicContact CG-CG2 4.43Å; F441-T445 HydrophobicContact CZ-CG2 3.56Å; F441-T445 WeakPolarHBondContact O-CB 3.41Å; F441-T445 WeakPolarHBondContact O-CG2 3.37Å; F441-T445 PolarHBondContact O-N 3.5Å; F441-T445 PolarHBondContact O-OG1 3.48Å
442	L	87.4	Confident	90.6	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-63.1	-42.8	176.3	-65.3	-172.9	0	0	0	112.2	I318 V393 L396 V438 S439 T445 N446	I318-L442 HydrophobicContact CD1-CD1 4.5Å; V393-L442 HydrophobicContact CB-CD2 4.14Å; V393-L442 HydrophobicContact CG1-CD1 4.08Å; V393-L442 HydrophobicContact CG1-CD2 4.47Å; V393-L442 HydrophobicContact CG2-CD1 4.45Å; V393-L442 HydrophobicContact CG2-CD2 3.59Å; L396-L442 HydrophobicContact CD1-CD2 3.85Å; V438-L442 HydrophobicContact CG1-CD1 4.38Å; V438-L442 HydrophobicContact CG1-CG 4.42Å; V438-L442 WeakPolarHBondContact O-CG 3.38Å; V438-L442 PolarHBondContact O-N 3.19Å; S439-L442 PolarHBondContact O-N 3.29Å; L442-T445 WeakPolarHBondContact CA-OG1 3.26Å; L442-T445 PolarHBondContact O-OG1 2.93Å; L442-N446 WeakPolarHBondContact O-CB 3.13Å; L442-N446 PolarHBondContact O-N 2.92Å; L442-N446 PolarHBondContact O-ND2 3.1Å
443	I	91.6	Very high	90	Very high	43 Å²	43	48.4 Å²	48.4	22%	0.221	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-48.1	177.1	-70.8	164.6	0	0	0	110	L312 V316 F319 S439 A440 T447	L312-I443 HydrophobicContact CD1-CB 4.22Å; L312-I443 HydrophobicContact CD1-CG1 4.32Å; L312-I443 HydrophobicContact CD1-CG2 3.88Å; V316-I443 HydrophobicContact CG2-CD1 3.97Å; V316-I443 HydrophobicContact CG2-CG1 4.06Å; F319-I443 HydrophobicContact CB-CD1 4.28Å; S439-I443 WeakPolarHBondContact O-CB 3.29Å; S439-I443 WeakPolarHBondContact O-CD1 3.42Å; S439-I443 WeakPolarHBondContact O-CG1 3.35Å; S439-I443 PolarHBondContact O-N 2.92Å; A440-I443 PolarHBondContact O-N 2.86Å; I443-T447 VanDerWaalsContact O-CB 3.26Å; I443-T447 WeakPolarHBondContact O-CB 3.27Å; I443-T447 PolarHBondContact O-N 3.3Å; I443-T447 PolarHBondContact O-OG1 2.88Å
444	Y	89.7	Confident	89.5	Confident	143 Å²	143	49 Å²	49	56%	0.561	27%	0.268	S	S	*	.	H	α-helix	trans	-61.8	-50.9	179.5	176.5	-104.9	0	0	0	111.6	A440 F441 N446 T447 E448	A440-Y444 WeakPolarHBondContact O-CB 3.43Å; A440-Y444 PolarHBondContact O-N 3.37Å; F441-Y444 PolarHBondContact O-N 3.25Å; Y444-N446 PolarHBondContact O-N 3.46Å; Y444-T447 PolarHBondContact O-N 3.34Å; Y444-E448 HydrophobicContact CD2-CG 4.4Å; Y444-E448 HydrophobicContact CE1-CG 4.19Å; Y444-E448 HydrophobicContact CE2-CG 3.97Å; Y444-E448 WeakPolarHBondContact O-CG 3.19Å; Y444-E448 PolarHBondContact O-N 3.44Å
445	T	84.3	Confident	89.1	Confident	21 Å²	21	47.6 Å²	47.6	13%	0.129	26%	0.261	C	S	.	.	H	α-helix	trans	-64.6	-39.2	-177.3	50.5	0	0	0	0	113.4	F441 L442 A449 R453	F441-T445 HydrophobicContact CD1-CG2 4.13Å; F441-T445 HydrophobicContact CD2-CG2 4.31Å; F441-T445 HydrophobicContact CE1-CG2 3.68Å; F441-T445 HydrophobicContact CE2-CG2 3.89Å; F441-T445 HydrophobicContact CG-CG2 4.43Å; F441-T445 HydrophobicContact CZ-CG2 3.56Å; F441-T445 WeakPolarHBondContact O-CB 3.41Å; F441-T445 WeakPolarHBondContact O-CG2 3.37Å; F441-T445 PolarHBondContact O-N 3.5Å; F441-T445 PolarHBondContact O-OG1 3.48Å; L442-T445 WeakPolarHBondContact CA-OG1 3.26Å; L442-T445 PolarHBondContact O-OG1 2.93Å; T445-A449 PolarHBondContact O-N 3.09Å; T445-A449 VanDerWaalsContact O-N 3.11Å; T445-R453 PolarHBondContact O-NH2 2.96Å
446	N	87.2	Confident	88.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-73.2	-34.2	175.8	-76.4	-69.9	0	0	0	112.8	S311 L312 L442 Y444 A449 L450	S311-N446 WeakPolarHBondContact CB-OD1 3.49Å; S311-N446 PolarHBondContact OG-ND2 3.33Å; S311-N446 PolarHBondContact OG-OD1 3.25Å; L312-N446 HydrophobicContact CB-CB 4.11Å; L442-N446 WeakPolarHBondContact O-CB 3.13Å; L442-N446 PolarHBondContact O-N 2.92Å; L442-N446 PolarHBondContact O-ND2 3.1Å; Y444-N446 PolarHBondContact O-N 3.46Å; N446-A449 PolarHBondContact O-N 2.88Å; N446-L450 WeakPolarHBondContact O-CG 3.35Å; N446-L450 PolarHBondContact O-N 3.18Å
447	T	89.6	Confident	88.2	Confident	51 Å²	51	54.8 Å²	54.8	31%	0.313	30%	0.301	S	S	.	.	H	α-helix	trans	-62.5	-46.8	174.6	-60.5	0	0	0	0	110.3	I443 Y444 A449 L450 L451	I443-T447 VanDerWaalsContact O-CB 3.26Å; I443-T447 WeakPolarHBondContact O-CB 3.27Å; I443-T447 PolarHBondContact O-N 3.3Å; I443-T447 PolarHBondContact O-OG1 2.88Å; Y444-T447 PolarHBondContact O-N 3.34Å; T447-A449 VanDerWaalsContact C-N 3.33Å; T447-A449 PolarHBondContact O-N 3.21Å; T447-L450 WeakPolarHBondContact O-CB 3.11Å; T447-L450 PolarHBondContact O-N 3.29Å; T447-L450 VanDerWaalsContact O-N 3.11Å; T447-L451 HydrophobicContact CG2-CD1 4.37Å; T447-L451 WeakPolarHBondContact O-CG 3.42Å; T447-L451 PolarHBondContact O-N 3.26Å
448	E	86	Confident	87.6	Confident	63 Å²	63	55.2 Å²	55.2	29%	0.294	30%	0.296	S	S	.	.	H	α-helix	trans	-60.9	-40.6	176	-72.5	-67.1	121.9	0	0	112.4	Y444 L450 L451 G452 R453	Y444-E448 HydrophobicContact CD2-CG 4.4Å; Y444-E448 HydrophobicContact CE1-CG 4.19Å; Y444-E448 HydrophobicContact CE2-CG 3.97Å; Y444-E448 WeakPolarHBondContact O-CG 3.19Å; Y444-E448 PolarHBondContact O-N 3.44Å; E448-L450 VanDerWaalsContact C-N 3.3Å; E448-L450 PolarHBondContact O-N 2.68Å; E448-L451 PolarHBondContact O-N 3.16Å; E448-G452 PolarHBondContact O-N 3.49Å; E448-R453 VanDerWaalsContact CB-NE 3.34Å; E448-R453 WeakPolarHBondContact O-CG 2.83Å
449	A	83.3	Confident	87.3	Confident	13 Å²	13	55.9 Å²	55.9	11%	0.107	30%	0.298	C	S	.	.	H	α-helix	trans	-62.5	-37.3	174.3	0	0	0	0	0	112.3	Y308 T445 N446 T447 G452	Y308-A449 HydrophobicContact CD1-CB 3.84Å; Y308-A449 HydrophobicContact CD2-CB 4.28Å; Y308-A449 HydrophobicContact CE1-CB 4.04Å; Y308-A449 HydrophobicContact CE2-CB 4.46Å; Y308-A449 HydrophobicContact CG-CB 3.98Å; T445-A449 PolarHBondContact O-N 3.09Å; T445-A449 VanDerWaalsContact O-N 3.11Å; N446-A449 PolarHBondContact O-N 2.88Å; T447-A449 VanDerWaalsContact C-N 3.33Å; T447-A449 PolarHBondContact O-N 3.21Å; A449-G452 PolarHBondContact O-N 3.32Å
450	L	87.8	Confident	87.2	Confident	52 Å²	52	57.1 Å²	57.1	27%	0.272	31%	0.306	S	S	.	.	H	α-helix	trans	-71.5	-31.4	176.7	-75.8	168.4	0	0	0	113.8	N305 Y308 I309 L312 N446 T447 E448 G452	N305-L450 HydrophobicContact CB-CD2 4.25Å; Y308-L450 HydrophobicContact CD2-CD2 4.45Å; I309-L450 HydrophobicContact CG1-CD1 4.36Å; I309-L450 HydrophobicContact CG1-CD2 3.64Å; L312-L450 HydrophobicContact CB-CD1 4.37Å; L312-L450 HydrophobicContact CD2-CD1 3.7Å; N446-L450 WeakPolarHBondContact O-CG 3.35Å; N446-L450 PolarHBondContact O-N 3.18Å; T447-L450 WeakPolarHBondContact O-CB 3.11Å; T447-L450 PolarHBondContact O-N 3.29Å; T447-L450 VanDerWaalsContact O-N 3.11Å; E448-L450 VanDerWaalsContact C-N 3.3Å; E448-L450 PolarHBondContact O-N 2.68Å; L450-G452 PolarHBondContact O-N 2.93Å
451	L	88.4	Confident	86.9	Confident	130 Å²	130	60.1 Å²	60.1	68%	0.681	31%	0.311	S	S	*	.	H	α-helix	trans	-67.9	-19.9	174.7	-70.3	174.1	0	0	0	112.3	T447 E448	T447-L451 HydrophobicContact CG2-CD1 4.37Å; T447-L451 WeakPolarHBondContact O-CG 3.42Å; T447-L451 PolarHBondContact O-N 3.26Å; E448-L451 PolarHBondContact O-N 3.16Å
452	G	83.6	Confident	86.8	Confident	33 Å²	33	62.8 Å²	62.8	34%	0.34	32%	0.319	S	S	.	.			trans	91.6	88.7	-179.7	0	0	0	0	0	111.1	E448 A449 L450	E448-G452 PolarHBondContact O-N 3.49Å; A449-G452 PolarHBondContact O-N 3.32Å; L450-G452 PolarHBondContact O-N 2.93Å
453	R	84.1	Confident	86.9	Confident	102 Å²	102	62.9 Å²	62.9	39%	0.385	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-69.6	143.4	176	-69.5	-179	174.6	170.7	-2.8	110.9	T445 E448 T482 D483	T445-R453 PolarHBondContact O-NH2 2.96Å; E448-R453 VanDerWaalsContact CB-NE 3.34Å; E448-R453 WeakPolarHBondContact O-CG 2.83Å; R453-T482 WeakPolarHBondContact O-CA 3.29Å; R453-D483 PolarHBondContact O-N 3.44Å
454	S	87.7	Confident	86.8	Confident	82 Å²	82	61.9 Å²	61.9	57%	0.573	32%	0.315	S	S	*	.	B	Isolated β-bridge	trans	-64.9	151.2	168.3	-168.8	0	0	0	0	110.4	A481	S454-A481 CarbonylContact C-O 3.53Å; S454-A481 WeakPolarHBondContact CA-O 3.23Å; S454-A481 PolarHBondContact OG-O 3Å
455	I	88.7	Confident	86.6	Confident	7 Å²	7	58.9 Å²	58.9	4%	0.036	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-67.4	169.6	167.6	69.6	178.1	0	0	0	110.4	Q459 V460 L463 A481 D483 V489	I455-Q459 HydrophobicContact CD1-CB 3.79Å; I455-Q459 HydrophobicContact CG1-CB 4.18Å; I455-V460 HydrophobicContact CD1-CG2 3.94Å; I455-V460 HydrophobicContact CG1-CG2 3.37Å; I455-L463 HydrophobicContact CD1-CD1 3.79Å; I455-A481 HydrophobicContact CD1-CB 3.57Å; I455-A481 HydrophobicContact CG1-CB 3.64Å; I455-A481 PolarHBondContact N-O 3.39Å; I455-D483 HydrophobicContact CG2-CB 4.43Å; I455-V489 HydrophobicContact CD1-CG1 4.16Å; I455-V489 HydrophobicContact CG2-CB 4.27Å; I455-V489 HydrophobicContact CG2-CG1 3.64Å; I455-V489 HydrophobicContact CG2-CG2 3.64Å
456	Q	84.4	Confident	86.8	Confident	66 Å²	66	59.1 Å²	59.1	31%	0.308	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-56.7	136.6	-179.8	-88.1	172.7	13.6	0	0	110.4	E458 Q459 V460	Q456-E458 PolarHBondContact O-N 3.32Å; Q456-E458 VanDerWaalsContact O-N 3.13Å; Q456-Q459 HydrophobicContact CB-CB 4.43Å; Q456-Q459 HydrophobicContact CB-CG 4.22Å; Q456-Q459 WeakPolarHBondContact O-CA 3.17Å; Q456-Q459 WeakPolarHBondContact O-CB 3.46Å; Q456-Q459 PolarHBondContact O-N 2.82Å; Q456-V460 PolarHBondContact O-N 3.48Å
457	P	84.9	Confident	86.9	Confident	94 Å²	94	59.1 Å²	59.1	61%	0.61	31%	0.307	S	S	*	.	H	α-helix	trans	-51.6	-37.9	-179.6	-27.6	34.9	0	0	0	113.2	Q459 V460 Q461	P457-Q459 VanDerWaalsContact C-N 3.29Å; P457-Q459 PolarHBondContact O-N 3.06Å; P457-V460 PolarHBondContact O-N 3.31Å; P457-Q461 WeakPolarHBondContact O-CB 3.44Å; P457-Q461 PolarHBondContact O-N 2.84Å
458	E	83.3	Confident	86.8	Confident	108 Å²	108	62.1 Å²	62.1	51%	0.505	32%	0.317	S	S	.	.	H	α-helix	trans	-69.8	-25.9	178.5	-54.4	75.7	-166.1	0	0	112.4	Q456 R462	Q456-E458 PolarHBondContact O-N 3.32Å; Q456-E458 VanDerWaalsContact O-N 3.13Å; E458-R462 WeakPolarHBondContact O-CB 2.99Å; E458-R462 VanDerWaalsContact O-CG 3.27Å; E458-R462 WeakPolarHBondContact O-CG 3.24Å; E458-R462 PolarHBondContact O-N 3.47Å; E458-R462 PolarHBondContact O-NE 2.91Å
459	Q	86.4	Confident	86.9	Confident	32 Å²	32	65.5 Å²	65.5	15%	0.15	34%	0.338	C	S	.	.	H	α-helix	trans	-77.9	-41.5	170.8	-69.4	-171.6	-63.9	0	0	111.2	R387 I455 Q456 P457 Q461 R462 L463	R387-Q459 VanDerWaalsContact CZ-OE1 3.29Å; I455-Q459 HydrophobicContact CD1-CB 3.79Å; I455-Q459 HydrophobicContact CG1-CB 4.18Å; Q456-Q459 HydrophobicContact CB-CB 4.43Å; Q456-Q459 HydrophobicContact CB-CG 4.22Å; Q456-Q459 WeakPolarHBondContact O-CA 3.17Å; Q456-Q459 WeakPolarHBondContact O-CB 3.46Å; Q456-Q459 PolarHBondContact O-N 2.82Å; P457-Q459 VanDerWaalsContact C-N 3.29Å; P457-Q459 PolarHBondContact O-N 3.06Å; Q459-Q461 VanDerWaalsContact C-N 3.34Å; Q459-R462 VanDerWaalsContact CG-NH2 3.31Å; Q459-R462 PolarHBondContact O-N 3.5Å; Q459-L463 WeakPolarHBondContact O-CG 3.49Å; Q459-L463 PolarHBondContact O-N 2.84Å; Q459-L463 VanDerWaalsContact O-N 3.1Å
460	V	89.6	Confident	87.2	Confident	26 Å²	26	65.6 Å²	65.6	16%	0.158	34%	0.336	C	S	.	.	H	α-helix	trans	-57.6	-51.5	174.5	-176.5	0	0	0	0	109.7	I455 Q456 P457 R462 L463 T464 V479 A481	I455-V460 HydrophobicContact CD1-CG2 3.94Å; I455-V460 HydrophobicContact CG1-CG2 3.37Å; Q456-V460 PolarHBondContact O-N 3.48Å; P457-V460 PolarHBondContact O-N 3.31Å; V460-R462 VanDerWaalsContact C-N 3.33Å; V460-R462 PolarHBondContact O-N 2.97Å; V460-L463 WeakPolarHBondContact O-CB 3.4Å; V460-L463 PolarHBondContact O-N 3.32Å; V460-T464 PolarHBondContact O-N 2.89Å; V460-T464 PolarHBondContact O-OG1 3.47Å; V460-T464 VanDerWaalsContact O-OG1 3.12Å; V460-V479 HydrophobicContact CG1-CG1 3.79Å; V460-A481 HydrophobicContact CG2-CB 4.05Å
461	Q	87.7	Confident	87.3	Confident	113 Å²	113	67.8 Å²	67.8	53%	0.528	35%	0.354	S	S	.	.	H	α-helix	trans	-57.8	-44.2	-179.7	-176.2	176.4	-6.3	0	0	111.9	P457 Q459 L463 T464 E465	P457-Q461 WeakPolarHBondContact O-CB 3.44Å; P457-Q461 PolarHBondContact O-N 2.84Å; Q459-Q461 VanDerWaalsContact C-N 3.34Å; Q461-L463 VanDerWaalsContact C-N 3.32Å; Q461-L463 PolarHBondContact O-N 2.97Å; Q461-T464 PolarHBondContact O-N 2.87Å; Q461-E465 HydrophobicContact CG-CG 4.27Å; Q461-E465 VanDerWaalsContact CG-OE1 3.3Å; Q461-E465 WeakPolarHBondContact CG-OE1 3.36Å; Q461-E465 PolarHBondContact NE2-OE1 2.81Å; Q461-E465 WeakPolarHBondContact O-CB 3.3Å; Q461-E465 VanDerWaalsContact O-CG 3.31Å; Q461-E465 WeakPolarHBondContact O-CG 3.41Å; Q461-E465 PolarHBondContact O-N 3.02Å
462	R	86.6	Confident	87.5	Confident	139 Å²	139	61.7 Å²	61.7	53%	0.525	32%	0.322	S	S	.	.	H	α-helix	trans	-60.7	-37.9	175.6	-81.2	-177.9	-73.7	174	-9.4	113.6	E458 Q459 V460 L466	E458-R462 WeakPolarHBondContact O-CB 2.99Å; E458-R462 VanDerWaalsContact O-CG 3.27Å; E458-R462 WeakPolarHBondContact O-CG 3.24Å; E458-R462 PolarHBondContact O-N 3.47Å; E458-R462 PolarHBondContact O-NE 2.91Å; Q459-R462 VanDerWaalsContact CG-NH2 3.31Å; Q459-R462 PolarHBondContact O-N 3.5Å; V460-R462 VanDerWaalsContact C-N 3.33Å; V460-R462 PolarHBondContact O-N 2.97Å; R462-L466 WeakPolarHBondContact O-CB 3.46Å; R462-L466 PolarHBondContact O-N 3.41Å; R462-L466 VanDerWaalsContact O-N 3.15Å
463	L	91	Very high	87.9	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-70.6	-39.4	176.5	-65.5	172.2	0	0	0	111.2	I455 Q459 V460 Q461 L466 L467 F491 L554 N558 V561	I455-L463 HydrophobicContact CD1-CD1 3.79Å; Q459-L463 WeakPolarHBondContact O-CG 3.49Å; Q459-L463 PolarHBondContact O-N 2.84Å; Q459-L463 VanDerWaalsContact O-N 3.1Å; V460-L463 WeakPolarHBondContact O-CB 3.4Å; V460-L463 PolarHBondContact O-N 3.32Å; Q461-L463 VanDerWaalsContact C-N 3.32Å; Q461-L463 PolarHBondContact O-N 2.97Å; L463-L466 PolarHBondContact O-N 3.07Å; L463-L467 PolarHBondContact O-N 2.82Å; L463-F491 HydrophobicContact CB-CD2 4.14Å; L463-F491 HydrophobicContact CB-CE2 3.65Å; L463-F491 HydrophobicContact CB-CZ 4.17Å; L463-F491 HydrophobicContact CD1-CD2 3.56Å; L463-F491 HydrophobicContact CD1-CE2 3.94Å; L463-F491 HydrophobicContact CD1-CG 4.36Å; L463-F491 HydrophobicContact CG-CD2 4.47Å; L463-F491 HydrophobicContact CG-CE2 4.45Å; L463-L554 HydrophobicContact CB-CD2 4.49Å; L463-L554 HydrophobicContact CD2-CD2 3.98Å; L463-N558 HydrophobicContact CD2-CB 3.96Å; L463-N558 VanDerWaalsContact CD2-CG 3.49Å; L463-N558 WeakPolarHBondContact CD2-OD1 3.49Å; L463-V561 HydrophobicContact CD1-CG2 3.89Å; L463-V561 HydrophobicContact CD2-CG2 3.99Å
464	T	88.1	Confident	88.1	Confident	22 Å²	22	62.5 Å²	62.5	14%	0.135	32%	0.316	C	S	.	.	H	α-helix	trans	-63.9	-50.3	175	-58.3	0	0	0	0	111.1	V460 Q461 L466 L467 E468 I476	V460-T464 PolarHBondContact O-N 2.89Å; V460-T464 PolarHBondContact O-OG1 3.47Å; V460-T464 VanDerWaalsContact O-OG1 3.12Å; Q461-T464 PolarHBondContact O-N 2.87Å; T464-L466 PolarHBondContact O-N 3.02Å; T464-L467 WeakPolarHBondContact O-CB 3.35Å; T464-L467 PolarHBondContact O-N 3.47Å; T464-E468 HydrophobicContact CG2-CG 4.2Å; T464-E468 WeakPolarHBondContact O-CG 3.25Å; T464-E468 PolarHBondContact O-N 2.94Å; T464-I476 HydrophobicContact CG2-CD1 4.14Å
465	E	86.1	Confident	87.9	Confident	79 Å²	79	60.1 Å²	60.1	37%	0.369	30%	0.301	S	S	.	.	H	α-helix	trans	-57.7	-38.1	177.5	-75.4	171.2	-174.6	0	0	111.7	Q461 L467 E468 N469	Q461-E465 HydrophobicContact CG-CG 4.27Å; Q461-E465 VanDerWaalsContact CG-OE1 3.3Å; Q461-E465 WeakPolarHBondContact CG-OE1 3.36Å; Q461-E465 PolarHBondContact NE2-OE1 2.81Å; Q461-E465 WeakPolarHBondContact O-CB 3.3Å; Q461-E465 VanDerWaalsContact O-CG 3.31Å; Q461-E465 WeakPolarHBondContact O-CG 3.41Å; Q461-E465 PolarHBondContact O-N 3.02Å; E465-L467 VanDerWaalsContact C-N 3.3Å; E465-L467 PolarHBondContact O-N 2.78Å; E465-E468 PolarHBondContact O-N 3.09Å; E465-N469 WeakPolarHBondContact O-CB 3.19Å; E465-N469 VanDerWaalsContact O-CG 3.23Å; E465-N469 PolarHBondContact O-N 2.82Å; E465-N469 PolarHBondContact O-ND2 3.4Å
466	L	87.8	Confident	87.9	Confident	27 Å²	27	60.9 Å²	60.9	14%	0.141	31%	0.305	C	S	.	.	H	α-helix	trans	-60.2	-41.6	176.4	-176.4	164.3	0	0	0	111.7	R462 L463 T464 E553 L554 R557	R462-L466 WeakPolarHBondContact O-CB 3.46Å; R462-L466 PolarHBondContact O-N 3.41Å; R462-L466 VanDerWaalsContact O-N 3.15Å; L463-L466 PolarHBondContact O-N 3.07Å; T464-L466 PolarHBondContact O-N 3.02Å; L466-E553 HydrophobicContact CD2-CG 4.47Å; L466-L554 HydrophobicContact CB-CD2 4.5Å; L466-L554 HydrophobicContact CD1-CD2 3.99Å; L466-L554 HydrophobicContact CD2-CD2 3.63Å; L466-L554 HydrophobicContact CD2-CG 3.99Å; L466-L554 HydrophobicContact CG-CD2 4.26Å; L466-R557 HydrophobicContact CD1-CB 3.95Å; L466-R557 VanDerWaalsContact CD1-CD 3.42Å; L466-R557 HydrophobicContact CD1-CG 4.33Å
467	L	89.1	Confident	88.1	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-73.5	-40.6	176	-72.2	175.8	0	0	0	112.3	L463 T464 E465 N469 D470 V473 I476 F491 L550 L554 L566	L463-L467 PolarHBondContact O-N 2.82Å; T464-L467 WeakPolarHBondContact O-CB 3.35Å; T464-L467 PolarHBondContact O-N 3.47Å; E465-L467 VanDerWaalsContact C-N 3.3Å; E465-L467 PolarHBondContact O-N 2.78Å; L467-N469 PolarHBondContact O-N 2.97Å; L467-D470 PolarHBondContact O-N 3.41Å; L467-D470 VanDerWaalsContact O-N 3.12Å; L467-V473 WeakPolarHBondContact O-CB 3.45Å; L467-V473 WeakPolarHBondContact O-CG2 3.39Å; L467-I476 HydrophobicContact CB-CD1 3.21Å; L467-I476 HydrophobicContact CB-CG1 4.42Å; L467-I476 HydrophobicContact CD1-CD1 3.99Å; L467-I476 HydrophobicContact CG-CD1 4.26Å; L467-F491 HydrophobicContact CD1-CE1 3.77Å; L467-F491 HydrophobicContact CD1-CZ 3.97Å; L467-L550 HydrophobicContact CD2-CB 4.09Å; L467-L550 HydrophobicContact CD2-CD1 4.33Å; L467-L550 HydrophobicContact CD2-CD2 4.26Å; L467-L550 HydrophobicContact CD2-CG 4.48Å; L467-L554 HydrophobicContact CD1-CD1 4.09Å; L467-L554 HydrophobicContact CD2-CD1 3.72Å; L467-L554 HydrophobicContact CD2-CG 4.13Å; L467-L554 HydrophobicContact CG-CD1 4.01Å; L467-L554 HydrophobicContact CG-CD2 4.3Å; L467-L554 HydrophobicContact CG-CG 4.41Å; L467-L566 HydrophobicContact CD1-CD2 4.01Å; L467-L566 HydrophobicContact CD2-CD1 4.2Å
468	E	87.8	Confident	88.4	Confident	113 Å²	113	60.7 Å²	60.7	53%	0.528	30%	0.298	S	S	.	.	H	α-helix	trans	-64.1	-26	178.6	-71.5	178.7	163.3	0	0	112.7	T464 E465 D470 I476	T464-E468 HydrophobicContact CG2-CG 4.2Å; T464-E468 WeakPolarHBondContact O-CG 3.25Å; T464-E468 PolarHBondContact O-N 2.94Å; E465-E468 PolarHBondContact O-N 3.09Å; E468-D470 VanDerWaalsContact C-N 3.25Å; E468-D470 PolarHBondContact O-N 3.25Å; E468-I476 HydrophobicContact CG-CD1 3.65Å; E468-I476 HydrophobicContact CG-CG1 4.25Å
469	N	87.6	Confident	88.8	Confident	135 Å²	135	57.8 Å²	57.8	72%	0.722	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-6.2	176.9	-77.2	-50.9	0	0	0	113.8	E465 L467	E465-N469 WeakPolarHBondContact O-CB 3.19Å; E465-N469 VanDerWaalsContact O-CG 3.23Å; E465-N469 PolarHBondContact O-N 2.82Å; E465-N469 PolarHBondContact O-ND2 3.4Å; L467-N469 PolarHBondContact O-N 2.97Å
470	D	91.6	Very high	89.1	Confident	15 Å²	15	61.1 Å²	61.1	8%	0.08	30%	0.301	C	S	.	.	S	Bend	trans	-86.9	131.4	179	-167.7	-80.4	0	0	0	111.7	L467 E468 S472 V473 R549 L550	L467-D470 PolarHBondContact O-N 3.41Å; L467-D470 VanDerWaalsContact O-N 3.12Å; E468-D470 VanDerWaalsContact C-N 3.25Å; E468-D470 PolarHBondContact O-N 3.25Å; D470-S472 PolarHBondContact O-N 2.9Å; D470-S472 VanDerWaalsContact O-N 3.15Å; D470-S472 VanDerWaalsContact OD1-CB 3.31Å; D470-S472 WeakPolarHBondContact OD1-CB 3.32Å; D470-S472 PolarHBondContact OD1-N 2.85Å; D470-S472 PolarHBondContact OD1-OG 3.14Å; D470-V473 HydrophobicContact CB-CG2 4.11Å; D470-V473 PolarHBondContact O-N 3.48Å; D470-R549 IonicContact OD1-NH2 2.76Å; D470-R549 PolarHBondContact OD1-NH2 2.8Å; D470-R549 IonicContact OD2-CZ 3.86Å; D470-R549 IonicContact OD2-NH1 3.15Å; D470-R549 PolarHBondContact OD2-NH1 3.45Å; D470-R549 IonicContact OD2-NH2 2.94Å; D470-R549 PolarHBondContact OD2-NH2 3.28Å; D470-L550 HydrophobicContact CB-CD2 3.76Å; D470-L550 WeakPolarHBondContact OD2-CD2 3.25Å
471	P	89.8	Confident	89.3	Confident	98 Å²	98	60 Å²	60	64%	0.636	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-19.6	-176.4	27	-36.5	0	0	0	114.2	V473	P471-V473 VanDerWaalsContact C-N 3.29Å
472	S	90.8	Very high	89.5	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.014	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-13.9	175.7	69.1	0	0	0	0	112.9	D470 F497 D498	D470-S472 PolarHBondContact O-N 2.9Å; D470-S472 VanDerWaalsContact O-N 3.15Å; D470-S472 VanDerWaalsContact OD1-CB 3.31Å; D470-S472 WeakPolarHBondContact OD1-CB 3.32Å; D470-S472 PolarHBondContact OD1-N 2.85Å; D470-S472 PolarHBondContact OD1-OG 3.14Å; S472-F497 CarbonylContact O-C 3.53Å; S472-F497 VanDerWaalsContact O-CA 3.29Å; S472-F497 WeakPolarHBondContact O-CA 3.2Å; S472-F497 WeakPolarHBondContact O-CD1 3.45Å; S472-D498 PolarHBondContact O-N 3.14Å
473	V	92	Very high	89.5	Confident	16 Å²	16	51.2 Å²	51.2	10%	0.097	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	123.4	-177.9	177	0	0	0	0	109.7	L467 D470 P471 I476 V495 L550	L467-V473 WeakPolarHBondContact O-CB 3.45Å; L467-V473 WeakPolarHBondContact O-CG2 3.39Å; D470-V473 HydrophobicContact CB-CG2 4.11Å; D470-V473 PolarHBondContact O-N 3.48Å; P471-V473 VanDerWaalsContact C-N 3.29Å; V473-I476 HydrophobicContact CG1-CD1 4.25Å; V473-I476 HydrophobicContact CG1-CG1 3.75Å; V473-V495 HydrophobicContact CB-CG1 4.4Å; V473-V495 HydrophobicContact CG1-CG1 3.89Å; V473-V495 HydrophobicContact CG2-CG1 3.9Å; V473-L550 HydrophobicContact CG2-CD1 3.73Å
474	R	89.6	Confident	89.1	Confident	136 Å²	136	52.4 Å²	52.4	51%	0.513	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-43	174.4	-170.1	-178.4	-57.5	120.3	-2.3	111.8	D496 F497 D498	R474-D496 WeakPolarHBondContact CA-O 3.42Å; R474-D496 HydrophobicContact CB-CB 4.46Å; R474-D496 WeakPolarHBondContact CB-O 3.41Å; R474-D496 WeakPolarHBondContact CD-OD2 3.23Å; R474-D496 IonicContact CZ-OD2 2.73Å; R474-D496 PolarHBondContact N-O 2.73Å; R474-D496 VanDerWaalsContact NH1-CG 3.31Å; R474-D496 IonicContact NH1-OD1 2.85Å; R474-D496 PolarHBondContact NH1-OD1 3.38Å; R474-D496 IonicContact NH1-OD2 3.14Å; R474-D496 PolarHBondContact NH1-OD2 2.85Å; R474-F497 PolarHBondContact NH1-O 2.99Å; R474-D498 IonicContact NH2-OD1 3.52Å; R474-D498 PolarHBondContact NH2-OD1 2.9Å
475	A	82.8	Confident	88.6	Confident	31 Å²	31	51.4 Å²	51.4	26%	0.256	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	159.5	179.4	0	0	0	0	0	111.2	D496	A475-D496 HydrophobicContact CB-CB 4.2Å; A475-D496 PolarHBondContact N-O 3.48Å; A475-D496 PolarHBondContact O-N 2.91Å
476	I	89.8	Confident	87.9	Confident	23 Å²	23	51.9 Å²	51.9	12%	0.118	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	133.7	178.1	-49.8	177.1	0	0	0	109	T464 L467 E468 V473 V479 A493 E494	T464-I476 HydrophobicContact CG2-CD1 4.14Å; L467-I476 HydrophobicContact CB-CD1 3.21Å; L467-I476 HydrophobicContact CB-CG1 4.42Å; L467-I476 HydrophobicContact CD1-CD1 3.99Å; L467-I476 HydrophobicContact CG-CD1 4.26Å; E468-I476 HydrophobicContact CG-CD1 3.65Å; E468-I476 HydrophobicContact CG-CG1 4.25Å; V473-I476 HydrophobicContact CG1-CD1 4.25Å; V473-I476 HydrophobicContact CG1-CG1 3.75Å; I476-V479 HydrophobicContact CG2-CG2 3.49Å; I476-V479 VanDerWaalsContact CG2-CG2 3.49Å; I476-A493 HydrophobicContact CG2-CB 3.85Å; I476-E494 CarbonylContact C-O 3.52Å; I476-E494 WeakPolarHBondContact CA-O 3.4Å
477	H	87.3	Confident	87.3	Confident	94 Å²	94	53.1 Å²	53.1	44%	0.435	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	164.1	-177.9	-60	-85.1	0	0	0	110.8	V479 E494 L569	H477-V479 VanDerWaalsContact C-N 3.26Å; H477-V479 PolarHBondContact O-N 3.38Å; H477-E494 HydrophobicContact CB-CB 4.18Å; H477-E494 PolarHBondContact N-O 3Å; H477-E494 PolarHBondContact O-N 3.35Å; H477-L569 HydrophobicContact CB-CD1 4.01Å; H477-L569 WeakPolarHBondContact CD2-CD1 3.47Å
478	D	91.3	Very high	87	Confident	62 Å²	62	56 Å²	56	33%	0.332	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	45	42.8	175.7	-164.5	46	0	0	0	115.4	K480 E494	D478-K480 PolarHBondContact O-N 2.89Å; D478-K480 WeakPolarHBondContact OD1-CE 3.35Å; D478-K480 IonicContact OD1-NZ 3.62Å; D478-K480 PolarHBondContact OD1-NZ 3.36Å; D478-K480 WeakPolarHBondContact OD2-CE 3.25Å; D478-K480 IonicContact OD2-NZ 2.88Å; D478-K480 PolarHBondContact OD2-NZ 3.42Å; D478-E494 HydrophobicContact CB-CB 4.4Å; D478-E494 HydrophobicContact CB-CG 4Å
479	V	92.1	Very high	87.2	Confident	47 Å²	47	50.8 Å²	50.8	29%	0.285	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	119.3	179.9	-177.1	0	0	0	0	110.3	V460 I476 H477 F491 A493	V460-V479 HydrophobicContact CG1-CG1 3.79Å; I476-V479 HydrophobicContact CG2-CG2 3.49Å; I476-V479 VanDerWaalsContact CG2-CG2 3.49Å; H477-V479 VanDerWaalsContact C-N 3.26Å; H477-V479 PolarHBondContact O-N 3.38Å; V479-F491 HydrophobicContact CG1-CE2 3.6Å; V479-F491 HydrophobicContact CG1-CZ 3.84Å; V479-A493 HydrophobicContact CG2-CB 4.16Å
480	K	93.6	Very high	87.4	Confident	102 Å²	102	48 Å²	48	44%	0.443	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	121.3	179	-73.4	167.2	179.6	150.4	0	109.5	D478 F491 K492	D478-K480 PolarHBondContact O-N 2.89Å; D478-K480 WeakPolarHBondContact OD1-CE 3.35Å; D478-K480 IonicContact OD1-NZ 3.62Å; D478-K480 PolarHBondContact OD1-NZ 3.36Å; D478-K480 WeakPolarHBondContact OD2-CE 3.25Å; D478-K480 IonicContact OD2-NZ 2.88Å; D478-K480 PolarHBondContact OD2-NZ 3.42Å; K480-F491 CarbonylContact O-C 3.48Å; K480-F491 WeakPolarHBondContact O-CA 3.03Å; K480-K492 HydrophobicContact CB-CB 4.38Å; K480-K492 PolarHBondContact N-O 2.78Å; K480-K492 PolarHBondContact O-N 3.07Å
481	A	93.2	Very high	87.5	Confident	3 Å²	3	47.2 Å²	47.2	3%	0.025	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	106.5	-179.6	0	0	0	0	0	110.6	S454 I455 V460 R490 F491	S454-A481 CarbonylContact C-O 3.53Å; S454-A481 WeakPolarHBondContact CA-O 3.23Å; S454-A481 PolarHBondContact OG-O 3Å; I455-A481 HydrophobicContact CD1-CB 3.57Å; I455-A481 HydrophobicContact CG1-CB 3.64Å; I455-A481 PolarHBondContact N-O 3.39Å; V460-A481 HydrophobicContact CG2-CB 4.05Å; A481-R490 CarbonylContact C-O 3.58Å; A481-R490 VanDerWaalsContact CA-O 3.26Å; A481-R490 WeakPolarHBondContact CA-O 3.49Å; A481-F491 HydrophobicContact CB-CD2 3.89Å
482	T	91.4	Very high	87.8	Confident	45 Å²	45	44.8 Å²	44.8	28%	0.276	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	135.5	-172.7	-51.6	0	0	0	0	111.3	R453 V489 R490	R453-T482 WeakPolarHBondContact O-CA 3.29Å; T482-V489 WeakPolarHBondContact O-CA 3.29Å; T482-R490 PolarHBondContact N-O 3.1Å; T482-R490 PolarHBondContact O-N 2.88Å
483	D	86.9	Confident	88	Confident	23 Å²	23	44.7 Å²	44.7	12%	0.123	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	121.6	170	-168.6	-8	0	0	0	110.1	R387 R453 I455 G485	R387-D483 WeakPolarHBondContact CD-OD2 3.4Å; R387-D483 IonicContact NE-OD2 2.74Å; R453-D483 PolarHBondContact O-N 3.44Å; I455-D483 HydrophobicContact CG2-CB 4.43Å; D483-G485 VanDerWaalsContact C-N 3.35Å; D483-G485 WeakPolarHBondContact OD1-CA 3.23Å; D483-G485 PolarHBondContact OD1-N 3.07Å
484	L	82.8	Confident	88.2	Confident	28 Å²	28	46.4 Å²	46.4	15%	0.147	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	1.7	176.3	-60.7	-179.7	0	0	0	112.5	S304 K488 R490	S304-L484 VanDerWaalsContact CB-O 3.29Å; S304-L484 WeakPolarHBondContact CB-O 3.48Å; S304-L484 PolarHBondContact OG-O 3.34Å; L484-K488 HydrophobicContact CB-CB 4.23Å; L484-K488 WeakPolarHBondContact CB-O 3.43Å; L484-K488 PolarHBondContact N-O 3.35Å; L484-R490 HydrophobicContact CD1-CB 4.01Å; L484-R490 HydrophobicContact CD2-CB 4.28Å; L484-R490 HydrophobicContact CG-CB 4.1Å
485	G	77.5	Confident	88.4	Confident	1 Å²	1	40 Å²	40	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	83.7	163.6	-175.1	0	0	0	0	0	113.5	Y308 D483 G487 K488	Y308-G485 WeakPolarHBondContact OH-CA 3.38Å; D483-G485 VanDerWaalsContact C-N 3.35Å; D483-G485 WeakPolarHBondContact OD1-CA 3.23Å; D483-G485 PolarHBondContact OD1-N 3.07Å; G485-G487 PolarHBondContact O-N 2.94Å; G485-K488 WeakPolarHBondContact O-CB 3.23Å; G485-K488 PolarHBondContact O-N 3.42Å; G485-K488 VanDerWaalsContact O-N 3.15Å
486	L	71.2	Confident	88.9	Confident	88 Å²	88	40.7 Å²	40.7	46%	0.461	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	31.2	-176.9	-57.5	172.2	0	0	0	113.6	K488	L486-K488 VanDerWaalsContact C-N 3.28Å; L486-K488 PolarHBondContact O-N 3.43Å
487	G	75.1	Confident	89.2	Confident	53 Å²	53	40.2 Å²	40.2	55%	0.546	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	21.3	-179.4	0	0	0	0	0	113.9	G485	G485-G487 PolarHBondContact O-N 2.94Å
488	K	83.7	Confident	89.4	Confident	60 Å²	60	37.4 Å²	37.4	26%	0.261	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	131.4	174.7	-61.4	176.9	-174.3	176.2	0	109.7	L484 G485 L486 E560	L484-K488 HydrophobicContact CB-CB 4.23Å; L484-K488 WeakPolarHBondContact CB-O 3.43Å; L484-K488 PolarHBondContact N-O 3.35Å; G485-K488 WeakPolarHBondContact O-CB 3.23Å; G485-K488 PolarHBondContact O-N 3.42Å; G485-K488 VanDerWaalsContact O-N 3.15Å; L486-K488 VanDerWaalsContact C-N 3.28Å; L486-K488 PolarHBondContact O-N 3.43Å; K488-E560 CarbonylContact C-O 3.53Å
489	V	90.4	Very high	89.5	Confident	4 Å²	4	36.2 Å²	36.2	2%	0.024	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	140.7	178.9	176.1	0	0	0	0	109.6	I455 T482 E560 V561 R562 H563	I455-V489 HydrophobicContact CD1-CG1 4.16Å; I455-V489 HydrophobicContact CG2-CB 4.27Å; I455-V489 HydrophobicContact CG2-CG1 3.64Å; I455-V489 HydrophobicContact CG2-CG2 3.64Å; T482-V489 WeakPolarHBondContact O-CA 3.29Å; V489-E560 HydrophobicContact CG2-CG 4.43Å; V489-E560 PolarHBondContact N-O 3.46Å; V489-V561 HydrophobicContact CB-CG2 4.24Å; V489-V561 HydrophobicContact CG1-CG2 4.25Å; V489-R562 PolarHBondContact O-N 2.77Å; V489-H563 PolarHBondContact O-N 3.36Å
490	R	92.1	Very high	89.5	Confident	76 Å²	76	43.8 Å²	43.8	29%	0.287	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	123.5	163.5	-178.1	173.4	-173.3	-172	-0.4	108.7	Y301 A481 T482 L484 H563 D565	Y301-R490 VanDerWaalsContact OH-CZ 3.3Å; Y301-R490 PolarHBondContact OH-NH1 2.74Å; Y301-R490 PolarHBondContact OH-NH2 3.13Å; A481-R490 CarbonylContact C-O 3.58Å; A481-R490 VanDerWaalsContact CA-O 3.26Å; A481-R490 WeakPolarHBondContact CA-O 3.49Å; T482-R490 PolarHBondContact N-O 3.1Å; T482-R490 PolarHBondContact O-N 2.88Å; L484-R490 HydrophobicContact CD1-CB 4.01Å; L484-R490 HydrophobicContact CD2-CB 4.28Å; L484-R490 HydrophobicContact CG-CB 4.1Å; R490-H563 CarbonylContact C-O 3.52Å; R490-H563 WeakPolarHBondContact CA-O 3.15Å; R490-H563 HydrophobicContact CB-CB 4.22Å; R490-H563 HydrophobicContact CG-CB 3.99Å; R490-D565 IonicContact NH2-OD2 3.87Å
491	F	95.4	Very high	89.5	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	130.9	175.6	-177	-91.4	0	0	0	109	L463 L467 V479 K480 A481 A493 L554 V561 H563 V564 D565 L566	L463-F491 HydrophobicContact CB-CD2 4.14Å; L463-F491 HydrophobicContact CB-CE2 3.65Å; L463-F491 HydrophobicContact CB-CZ 4.17Å; L463-F491 HydrophobicContact CD1-CD2 3.56Å; L463-F491 HydrophobicContact CD1-CE2 3.94Å; L463-F491 HydrophobicContact CD1-CG 4.36Å; L463-F491 HydrophobicContact CG-CD2 4.47Å; L463-F491 HydrophobicContact CG-CE2 4.45Å; L467-F491 HydrophobicContact CD1-CE1 3.77Å; L467-F491 HydrophobicContact CD1-CZ 3.97Å; V479-F491 HydrophobicContact CG1-CE2 3.6Å; V479-F491 HydrophobicContact CG1-CZ 3.84Å; K480-F491 CarbonylContact O-C 3.48Å; K480-F491 WeakPolarHBondContact O-CA 3.03Å; A481-F491 HydrophobicContact CB-CD2 3.89Å; F491-A493 HydrophobicContact CE1-CB 3.73Å; F491-A493 HydrophobicContact CZ-CB 4.03Å; F491-L554 HydrophobicContact CD1-CD1 4.32Å; F491-L554 HydrophobicContact CE1-CD1 4.23Å; F491-V561 HydrophobicContact CB-CG1 3.58Å; F491-H563 PolarHBondContact N-O 3.32Å; F491-V564 HydrophobicContact CD1-CG1 4.22Å; F491-V564 CarbonylContact O-C 3.41Å; F491-V564 VanDerWaalsContact O-CA 3.3Å; F491-V564 WeakPolarHBondContact O-CA 3.39Å; F491-D565 PolarHBondContact O-N 2.86Å; F491-L566 HydrophobicContact CD1-CD2 4.42Å; F491-L566 HydrophobicContact CE1-CD2 4.04Å
492	K	95.7	Very high	89.5	Confident	46 Å²	46	40.9 Å²	40.9	20%	0.2	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	138.5	172.9	169.6	171.2	168.8	158.4	0	108.3	K480 D565 E567	K480-K492 HydrophobicContact CB-CB 4.38Å; K480-K492 PolarHBondContact N-O 2.78Å; K480-K492 PolarHBondContact O-N 3.07Å; K492-D565 VanDerWaalsContact CA-O 3.25Å; K492-D565 WeakPolarHBondContact CA-O 3.46Å; K492-D565 HydrophobicContact CB-CB 4.25Å; K492-D565 HydrophobicContact CG-CB 4.44Å; K492-E567 VanDerWaalsContact CE-CD 3.5Å; K492-E567 WeakPolarHBondContact CE-OE1 3.26Å; K492-E567 WeakPolarHBondContact CE-OE2 3.38Å; K492-E567 IonicContact NZ-OE1 2.95Å; K492-E567 PolarHBondContact NZ-OE1 3.2Å; K492-E567 IonicContact NZ-OE2 3.01Å; K492-E567 PolarHBondContact NZ-OE2 3.04Å
493	A	95.4	Very high	89.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	148.2	171.8	0	0	0	0	0	110.4	I476 V479 F491 V495 D565 L566 E567	I476-A493 HydrophobicContact CG2-CB 3.85Å; V479-A493 HydrophobicContact CG2-CB 4.16Å; F491-A493 HydrophobicContact CE1-CB 3.73Å; F491-A493 HydrophobicContact CZ-CB 4.03Å; A493-V495 HydrophobicContact CB-CG2 4.43Å; A493-D565 PolarHBondContact N-O 2.88Å; A493-L566 HydrophobicContact CB-CD2 4.02Å; A493-L566 WeakPolarHBondContact O-CA 3.48Å; A493-E567 PolarHBondContact O-N 2.82Å
494	E	95.3	Very high	89.8	Confident	53 Å²	53	47.6 Å²	47.6	25%	0.248	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	129.6	167.4	-67.8	176.4	-179.3	0	0	108	I476 H477 D478 E567 L569	I476-E494 CarbonylContact C-O 3.52Å; I476-E494 WeakPolarHBondContact CA-O 3.4Å; H477-E494 HydrophobicContact CB-CB 4.18Å; H477-E494 PolarHBondContact N-O 3Å; H477-E494 PolarHBondContact O-N 3.35Å; D478-E494 HydrophobicContact CB-CB 4.4Å; D478-E494 HydrophobicContact CB-CG 4Å; E494-E567 CarbonylContact C-O 2.98Å; E494-E567 WeakPolarHBondContact CA-O 3.49Å; E494-E567 HydrophobicContact CG-CB 4.32Å; E494-L569 HydrophobicContact CB-CD1 4.22Å; E494-L569 HydrophobicContact CB-CD2 3.82Å; E494-L569 HydrophobicContact CB-CG 3.88Å; E494-L569 HydrophobicContact CG-CD2 4.37Å; E494-L569 WeakPolarHBondContact OE2-CD2 3.43Å
495	V	94.3	Very high	90.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	123	-170.1	-174.2	0	0	0	0	109.4	V473 A493 F497 L566 E567 L569	V473-V495 HydrophobicContact CB-CG1 4.4Å; V473-V495 HydrophobicContact CG1-CG1 3.89Å; V473-V495 HydrophobicContact CG2-CG1 3.9Å; A493-V495 HydrophobicContact CB-CG2 4.43Å; V495-F497 HydrophobicContact CB-CD2 4.19Å; V495-F497 HydrophobicContact CB-CE2 3.65Å; V495-F497 HydrophobicContact CB-CZ 4.13Å; V495-F497 HydrophobicContact CG1-CD2 3.92Å; V495-F497 HydrophobicContact CG1-CE1 4.22Å; V495-F497 HydrophobicContact CG1-CE2 3.58Å; V495-F497 HydrophobicContact CG1-CG 4.39Å; V495-F497 HydrophobicContact CG1-CZ 3.75Å; V495-L566 HydrophobicContact CG2-CB 4.42Å; V495-L566 HydrophobicContact CG2-CD2 4.14Å; V495-E567 PolarHBondContact N-O 3.23Å; V495-L569 PolarHBondContact O-N 3.23Å
496	D	93.3	Very high	90.8	Very high	46 Å²	46	47.5 Å²	47.5	25%	0.246	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	117	168	178.6	19.6	0	0	0	108.2	R474 A475 L569	R474-D496 WeakPolarHBondContact CA-O 3.42Å; R474-D496 HydrophobicContact CB-CB 4.46Å; R474-D496 WeakPolarHBondContact CB-O 3.41Å; R474-D496 WeakPolarHBondContact CD-OD2 3.23Å; R474-D496 IonicContact CZ-OD2 2.73Å; R474-D496 PolarHBondContact N-O 2.73Å; R474-D496 VanDerWaalsContact NH1-CG 3.31Å; R474-D496 IonicContact NH1-OD1 2.85Å; R474-D496 PolarHBondContact NH1-OD1 3.38Å; R474-D496 IonicContact NH1-OD2 3.14Å; R474-D496 PolarHBondContact NH1-OD2 2.85Å; A475-D496 HydrophobicContact CB-CB 4.2Å; A475-D496 PolarHBondContact N-O 3.48Å; A475-D496 PolarHBondContact O-N 2.91Å; D496-L569 HydrophobicContact CB-CD1 4.07Å
497	F	94.5	Very high	91.7	Very high	13 Å²	13	45.5 Å²	45.5	6%	0.057	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	143.7	-178.4	-75.4	-91.1	0	0	0	111.8	S472 R474 V495 G499 V502 L543 E546 V547 L550 I568	S472-F497 CarbonylContact O-C 3.53Å; S472-F497 VanDerWaalsContact O-CA 3.29Å; S472-F497 WeakPolarHBondContact O-CA 3.2Å; S472-F497 WeakPolarHBondContact O-CD1 3.45Å; R474-F497 PolarHBondContact NH1-O 2.99Å; V495-F497 HydrophobicContact CB-CD2 4.19Å; V495-F497 HydrophobicContact CB-CE2 3.65Å; V495-F497 HydrophobicContact CB-CZ 4.13Å; V495-F497 HydrophobicContact CG1-CD2 3.92Å; V495-F497 HydrophobicContact CG1-CE1 4.22Å; V495-F497 HydrophobicContact CG1-CE2 3.58Å; V495-F497 HydrophobicContact CG1-CG 4.39Å; V495-F497 HydrophobicContact CG1-CZ 3.75Å; F497-G499 PolarHBondContact O-N 2.78Å; F497-V502 HydrophobicContact CB-CG2 4.49Å; F497-L543 HydrophobicContact CB-CD1 3.65Å; F497-L543 HydrophobicContact CD1-CD1 3.82Å; F497-L543 HydrophobicContact CD2-CD1 3.73Å; F497-L543 HydrophobicContact CE1-CD1 4.38Å; F497-L543 HydrophobicContact CE2-CD1 4.29Å; F497-L543 HydrophobicContact CG-CD1 3.45Å; F497-L543 VanDerWaalsContact CG-CD1 3.45Å; F497-E546 HydrophobicContact CE1-CB 4.43Å; F497-V547 HydrophobicContact CE1-CG2 4.4Å; F497-V547 HydrophobicContact CE2-CG2 3.75Å; F497-V547 HydrophobicContact CZ-CB 4.47Å; F497-V547 HydrophobicContact CZ-CG2 3.53Å; F497-L550 HydrophobicContact CE1-CD1 3.63Å; F497-L550 HydrophobicContact CZ-CD1 3.92Å; F497-I568 HydrophobicContact CD2-CG1 4.08Å; F497-I568 HydrophobicContact CD2-CG2 4.31Å; F497-I568 HydrophobicContact CE2-CG1 3.86Å
498	D	92.6	Very high	92.4	Very high	36 Å²	36	49.8 Å²	49.8	19%	0.193	23%	0.234	C	C	.	.			trans	-76.6	95.1	169.5	-166.8	2.7	0	0	0	111.6	S472 R474 R500 V501 V502	S472-D498 PolarHBondContact O-N 3.14Å; R474-D498 IonicContact NH2-OD1 3.52Å; R474-D498 PolarHBondContact NH2-OD1 2.9Å; D498-R500 PolarHBondContact O-N 3.45Å; D498-R500 WeakPolarHBondContact OD1-CB 3.18Å; D498-R500 PolarHBondContact OD1-N 2.99Å; D498-V501 HydrophobicContact CB-CB 4.25Å; D498-V501 HydrophobicContact CB-CG2 4.07Å; D498-V501 PolarHBondContact O-N 3.04Å; D498-V502 WeakPolarHBondContact O-CG2 3.35Å; D498-V502 PolarHBondContact O-N 3.45Å
499	G	92.6	Very high	92.6	Very high	37 Å²	37	53.2 Å²	53.2	38%	0.381	25%	0.249	S	C	.	.	H	α-helix	trans	-51	-26.5	175.2	0	0	0	0	0	114.1	F497 T503	F497-G499 PolarHBondContact O-N 2.78Å; G499-T503 VanDerWaalsContact O-CB 3.23Å; G499-T503 WeakPolarHBondContact O-CB 3.42Å; G499-T503 PolarHBondContact O-N 3.39Å; G499-T503 PolarHBondContact O-OG1 3.32Å
500	R	93.1	Very high	92.5	Very high	205 Å²	205	56.7 Å²	56.7	77%	0.774	27%	0.265	S	S	*	.	H	α-helix	trans	-68.9	-44.4	175	-63.4	-178.5	-178.5	-144.2	0.4	111.9	D498 T503 R504	D498-R500 PolarHBondContact O-N 3.45Å; D498-R500 WeakPolarHBondContact OD1-CB 3.18Å; D498-R500 PolarHBondContact OD1-N 2.99Å; R500-T503 PolarHBondContact O-N 3.3Å; R500-R504 WeakPolarHBondContact O-CB 3.43Å; R500-R504 PolarHBondContact O-N 3.4Å
501	V	92.3	Very high	92.3	Very high	40 Å²	40	57.4 Å²	57.4	24%	0.242	28%	0.275	C	S	.	.	H	α-helix	trans	-68	-43.6	178.2	175.7	0	0	0	0	110.1	D498 T503 R504 S505	D498-V501 HydrophobicContact CB-CB 4.25Å; D498-V501 HydrophobicContact CB-CG2 4.07Å; D498-V501 PolarHBondContact O-N 3.04Å; V501-T503 PolarHBondContact O-N 3.38Å; V501-R504 PolarHBondContact O-N 2.66Å; V501-S505 PolarHBondContact O-N 3.18Å
502	V	93.6	Very high	91.9	Very high	4 Å²	4	63.1 Å²	63.1	2%	0.024	30%	0.299	C	S	.	.	H	α-helix	trans	-60.4	-45.9	175.7	178.1	0	0	0	0	111	F497 D498 R504 S505 Y506 I539 T542 L543	F497-V502 HydrophobicContact CB-CG2 4.49Å; D498-V502 WeakPolarHBondContact O-CG2 3.35Å; D498-V502 PolarHBondContact O-N 3.45Å; V502-R504 VanDerWaalsContact C-N 3.32Å; V502-R504 PolarHBondContact O-N 2.65Å; V502-S505 PolarHBondContact O-N 3.26Å; V502-Y506 PolarHBondContact O-N 3.42Å; V502-I539 HydrophobicContact CG1-CG2 4.36Å; V502-T542 HydrophobicContact CG1-CG2 4.21Å; V502-L543 HydrophobicContact CG1-CB 3.99Å; V502-L543 HydrophobicContact CG2-CD1 4.05Å
503	T	93.3	Very high	91.6	Very high	46 Å²	46	66.4 Å²	66.4	28%	0.282	32%	0.319	S	S	.	.	H	α-helix	trans	-64.1	-38.4	177	-56.9	0	0	0	0	111.2	G499 R500 V501 Y506 L507 I539	G499-T503 VanDerWaalsContact O-CB 3.23Å; G499-T503 WeakPolarHBondContact O-CB 3.42Å; G499-T503 PolarHBondContact O-N 3.39Å; G499-T503 PolarHBondContact O-OG1 3.32Å; R500-T503 PolarHBondContact O-N 3.3Å; V501-T503 PolarHBondContact O-N 3.38Å; T503-Y506 WeakPolarHBondContact O-CB 3.38Å; T503-Y506 PolarHBondContact O-N 3.45Å; T503-L507 HydrophobicContact CG2-CD1 4.08Å; T503-L507 HydrophobicContact CG2-CG 4.3Å; T503-L507 WeakPolarHBondContact O-CB 3.33Å; T503-L507 VanDerWaalsContact O-CG 3.26Å; T503-L507 WeakPolarHBondContact O-CG 3.39Å; T503-L507 PolarHBondContact O-N 3.19Å; T503-I539 HydrophobicContact CG2-CD1 4.05Å
504	R	91.6	Very high	91.3	Very high	164 Å²	164	71.7 Å²	71.7	62%	0.619	34%	0.344	S	S	*	.	H	α-helix	trans	-63.4	-45.5	175.1	-173.8	176.9	-74	154.9	-4.7	111.7	R500 V501 V502 Y506 L507 E508	R500-R504 WeakPolarHBondContact O-CB 3.43Å; R500-R504 PolarHBondContact O-N 3.4Å; V501-R504 PolarHBondContact O-N 2.66Å; V502-R504 VanDerWaalsContact C-N 3.32Å; V502-R504 PolarHBondContact O-N 2.65Å; R504-Y506 VanDerWaalsContact C-N 3.25Å; R504-Y506 PolarHBondContact O-N 3.03Å; R504-L507 PolarHBondContact O-N 2.8Å; R504-L507 VanDerWaalsContact O-N 3.14Å; R504-E508 WeakPolarHBondContact O-CG 3.47Å; R504-E508 PolarHBondContact O-N 3.09Å
505	S	89.8	Confident	90.9	Very high	21 Å²	21	70.4 Å²	70.4	15%	0.147	34%	0.338	C	S	.	.	H	α-helix	trans	-59.1	-35.5	173.9	174.8	0	0	0	0	112.2	V501 V502 E546	V501-S505 PolarHBondContact O-N 3.18Å; V502-S505 PolarHBondContact O-N 3.26Å; S505-E546 PolarHBondContact OG-OE1 2.91Å
506	Y	92.2	Very high	90.7	Very high	6 Å²	6	75 Å²	75	2%	0.024	36%	0.362	C	S	.	.	H	α-helix	trans	-66	-51.2	172	169	-111	0	0	0	111.6	V502 T503 R504 E508 K509 Q510 M515 H535 N538 I539	V502-Y506 PolarHBondContact O-N 3.42Å; T503-Y506 WeakPolarHBondContact O-CB 3.38Å; T503-Y506 PolarHBondContact O-N 3.45Å; R504-Y506 VanDerWaalsContact C-N 3.25Å; R504-Y506 PolarHBondContact O-N 3.03Å; Y506-E508 VanDerWaalsContact C-N 3.32Å; Y506-E508 PolarHBondContact O-N 3.35Å; Y506-K509 WeakPolarHBondContact O-CB 3.29Å; Y506-K509 PolarHBondContact O-N 3.43Å; Y506-K509 VanDerWaalsContact O-N 3.09Å; Y506-Q510 HydrophobicContact CD2-CG 4.35Å; Y506-Q510 HydrophobicContact CE1-CG 4Å; Y506-Q510 HydrophobicContact CE2-CG 3.77Å; Y506-M515 HydrophobicContact CE1-CE 4.28Å; Y506-H535 HydrophobicContact CE1-CB 4.38Å; Y506-H535 AromaticContact CE1-ND1 3.75Å; Y506-H535 AromaticContact CZ-ND1 3.7Å; Y506-H535 PolarHBondContact OH-ND1 3.19Å; Y506-N538 HydrophobicContact CD2-CB 4Å; Y506-N538 HydrophobicContact CE2-CB 3.31Å; Y506-N538 PolarHBondContact OH-ND2 3.16Å; Y506-I539 HydrophobicContact CD1-CD1 4.34Å; Y506-I539 HydrophobicContact CD1-CG1 3.65Å; Y506-I539 HydrophobicContact CE1-CG1 4.2Å; Y506-I539 HydrophobicContact CG-CG1 3.98Å
507	L	90.7	Very high	90.5	Very high	45 Å²	45	78.5 Å²	78.5	24%	0.236	38%	0.377	C	S	.	.	H	α-helix	trans	-62.9	-35.5	-177.2	-71.9	173.1	0	0	0	112.9	T503 R504 K509 Q510 F512 M515	T503-L507 HydrophobicContact CG2-CD1 4.08Å; T503-L507 HydrophobicContact CG2-CG 4.3Å; T503-L507 WeakPolarHBondContact O-CB 3.33Å; T503-L507 VanDerWaalsContact O-CG 3.26Å; T503-L507 WeakPolarHBondContact O-CG 3.39Å; T503-L507 PolarHBondContact O-N 3.19Å; R504-L507 PolarHBondContact O-N 2.8Å; R504-L507 VanDerWaalsContact O-N 3.14Å; L507-K509 PolarHBondContact O-N 2.78Å; L507-K509 VanDerWaalsContact O-N 3.15Å; L507-Q510 PolarHBondContact O-N 2.84Å; L507-F512 HydrophobicContact CB-CE1 4.34Å; L507-F512 HydrophobicContact CB-CE2 4.04Å; L507-F512 HydrophobicContact CB-CZ 3.6Å; L507-F512 HydrophobicContact CD1-CE1 4.36Å; L507-F512 HydrophobicContact CD1-CZ 4.17Å; L507-F512 HydrophobicContact CD2-CE1 4.3Å; L507-F512 HydrophobicContact CD2-CZ 4.38Å; L507-F512 HydrophobicContact CG-CZ 4.27Å; L507-F512 WeakPolarHBondContact O-CE2 3.3Å; L507-M515 HydrophobicContact CD2-CE 3.92Å; L507-M515 HydrophobicContact CD2-SD 3.88Å
508	E	88.4	Confident	90.2	Very high	143 Å²	143	80.4 Å²	80.4	67%	0.668	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-22	175.2	-76.4	172.1	-169.2	0	0	113.4	R504 Y506	R504-E508 WeakPolarHBondContact O-CG 3.47Å; R504-E508 PolarHBondContact O-N 3.09Å; Y506-E508 VanDerWaalsContact C-N 3.32Å; Y506-E508 PolarHBondContact O-N 3.35Å
509	K	87.6	Confident	90.2	Very high	132 Å²	132	81.7 Å²	81.7	57%	0.574	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-5.8	178	-62	167.9	-171.1	157.8	0	112.9	Y506 L507	Y506-K509 WeakPolarHBondContact O-CB 3.29Å; Y506-K509 PolarHBondContact O-N 3.43Å; Y506-K509 VanDerWaalsContact O-N 3.09Å; L507-K509 PolarHBondContact O-N 2.78Å; L507-K509 VanDerWaalsContact O-N 3.15Å
510	Q	88.5	Confident	90.1	Very high	78 Å²	78	86.4 Å²	86.4	36%	0.364	41%	0.405	S	S	.	.	S	Bend	trans	-103.1	155.3	-178.9	-59.4	-55.6	-45.7	0	0	111	Y506 L507 F512 M515	Y506-Q510 HydrophobicContact CD2-CG 4.35Å; Y506-Q510 HydrophobicContact CE1-CG 4Å; Y506-Q510 HydrophobicContact CE2-CG 3.77Å; L507-Q510 PolarHBondContact O-N 2.84Å; Q510-F512 PolarHBondContact O-N 3.31Å; Q510-M515 HydrophobicContact CB-CE 3.63Å; Q510-M515 HydrophobicContact CG-CE 3.73Å
511	D	89.4	Confident	90	Very high	91 Å²	91	83.5 Å²	83.5	49%	0.487	40%	0.4	S	S	.	.			trans	-78.2	107.9	167.2	-170.5	-32	0	0	0	108.8	D513 Q514 M515	D511-D513 VanDerWaalsContact C-N 3.29Å; D511-D513 PolarHBondContact O-N 3.3Å; D511-D513 PolarHBondContact OD1-N 2.9Å; D511-Q514 HydrophobicContact CB-CB 3.92Å; D511-Q514 PolarHBondContact O-N 3.49Å; D511-Q514 PolarHBondContact OD1-N 3.21Å; D511-M515 PolarHBondContact O-N 3.36Å
512	F	86.9	Confident	90	Very high	119 Å²	119	83.2 Å²	83.2	52%	0.522	40%	0.398	S	S	.	.	H	α-helix	trans	-61.8	-36.5	-179.5	-92.7	-84	0	0	0	112.4	L507 Q510 M515 L516	L507-F512 HydrophobicContact CB-CE1 4.34Å; L507-F512 HydrophobicContact CB-CE2 4.04Å; L507-F512 HydrophobicContact CB-CZ 3.6Å; L507-F512 HydrophobicContact CD1-CE1 4.36Å; L507-F512 HydrophobicContact CD1-CZ 4.17Å; L507-F512 HydrophobicContact CD2-CE1 4.3Å; L507-F512 HydrophobicContact CD2-CZ 4.38Å; L507-F512 HydrophobicContact CG-CZ 4.27Å; L507-F512 WeakPolarHBondContact O-CE2 3.3Å; Q510-F512 PolarHBondContact O-N 3.31Å; F512-M515 PolarHBondContact O-N 3.2Å; F512-L516 VanDerWaalsContact O-CB 3.3Å; F512-L516 WeakPolarHBondContact O-CB 3.35Å; F512-L516 PolarHBondContact O-N 2.78Å
513	D	88.6	Confident	89.9	Confident	116 Å²	116	91.8 Å²	91.8	62%	0.62	44%	0.435	S	S	*	.	H	α-helix	trans	-70.6	-40.3	-177.7	-67.5	-41.6	0	0	0	110.3	D511 L516 Q517	D511-D513 VanDerWaalsContact C-N 3.29Å; D511-D513 PolarHBondContact O-N 3.3Å; D511-D513 PolarHBondContact OD1-N 2.9Å; D513-L516 PolarHBondContact O-N 2.94Å; D513-Q517 WeakPolarHBondContact O-CG 3.27Å; D513-Q517 PolarHBondContact O-N 2.92Å
514	Q	88.4	Confident	89.9	Confident	110 Å²	110	92 Å²	92	51%	0.514	44%	0.437	S	S	.	.	H	α-helix	trans	-64.3	-44.6	174.5	-168.4	175.2	23.7	0	0	111.7	D511 L516 Q517 E518	D511-Q514 HydrophobicContact CB-CB 3.92Å; D511-Q514 PolarHBondContact O-N 3.49Å; D511-Q514 PolarHBondContact OD1-N 3.21Å; Q514-L516 VanDerWaalsContact C-N 3.28Å; Q514-L516 PolarHBondContact O-N 2.96Å; Q514-Q517 PolarHBondContact O-N 2.85Å; Q514-E518 WeakPolarHBondContact O-CG 3.48Å; Q514-E518 PolarHBondContact O-N 3.23Å
515	M	88	Confident	89.8	Confident	27 Å²	27	88.9 Å²	88.9	13%	0.133	44%	0.437	C	S	.	.	H	α-helix	trans	-64.3	-35.4	177.4	-167.7	-179.5	-56.6	0	0	111.9	Y506 L507 Q510 D511 F512 E518 I519 F531	Y506-M515 HydrophobicContact CE1-CE 4.28Å; L507-M515 HydrophobicContact CD2-CE 3.92Å; L507-M515 HydrophobicContact CD2-SD 3.88Å; Q510-M515 HydrophobicContact CB-CE 3.63Å; Q510-M515 HydrophobicContact CG-CE 3.73Å; D511-M515 PolarHBondContact O-N 3.36Å; F512-M515 PolarHBondContact O-N 3.2Å; M515-E518 PolarHBondContact O-N 3.45Å; M515-I519 WeakPolarHBondContact O-CG2 3.1Å; M515-I519 PolarHBondContact O-N 3.3Å; M515-F531 HydrophobicContact CG-CE2 4.13Å; M515-F531 HydrophobicContact CG-CZ 3.87Å; M515-F531 HydrophobicContact SD-CZ 4.43Å
516	L	89.3	Confident	89.6	Confident	95 Å²	95	93.9 Å²	93.9	50%	0.497	46%	0.458	S	S	.	.	H	α-helix	trans	-67.7	-36	175.9	-166.5	70.4	0	0	0	112	F512 D513 Q514 I519 Q520	F512-L516 VanDerWaalsContact O-CB 3.3Å; F512-L516 WeakPolarHBondContact O-CB 3.35Å; F512-L516 PolarHBondContact O-N 2.78Å; D513-L516 PolarHBondContact O-N 2.94Å; Q514-L516 VanDerWaalsContact C-N 3.28Å; Q514-L516 PolarHBondContact O-N 2.96Å; L516-I519 HydrophobicContact CD1-CG2 4.27Å; L516-I519 WeakPolarHBondContact O-CG2 3.4Å; L516-Q520 WeakPolarHBondContact O-CG 3.41Å; L516-Q520 PolarHBondContact O-N 3.37Å
517	Q	89.7	Confident	89.3	Confident	120 Å²	120	97.5 Å²	97.5	56%	0.561	48%	0.475	S	S	*	.	H	α-helix	trans	-67.3	-46.9	171.4	-71.7	174	5.1	0	0	111.1	D513 Q514 I519 Q520 E521	D513-Q517 WeakPolarHBondContact O-CG 3.27Å; D513-Q517 PolarHBondContact O-N 2.92Å; Q514-Q517 PolarHBondContact O-N 2.85Å; Q517-I519 VanDerWaalsContact C-N 3.31Å; Q517-I519 PolarHBondContact O-N 3.49Å; Q517-Q520 WeakPolarHBondContact O-CB 3.09Å; Q517-Q520 PolarHBondContact O-N 3.45Å; Q517-Q520 VanDerWaalsContact O-N 3.07Å; Q517-E521 WeakPolarHBondContact O-CG 3.32Å; Q517-E521 PolarHBondContact O-N 3.01Å; Q517-E521 VanDerWaalsContact O-N 3.09Å
518	E	88.6	Confident	89.3	Confident	54 Å²	54	99.2 Å²	99.2	25%	0.252	49%	0.485	S	S	.	.	H	α-helix	trans	-55.6	-44.4	177.9	-74.4	-173.6	-176	0	0	111.6	Q514 M515 Q520 E521 V522 F531 K534 H535	Q514-E518 WeakPolarHBondContact O-CG 3.48Å; Q514-E518 PolarHBondContact O-N 3.23Å; M515-E518 PolarHBondContact O-N 3.45Å; E518-Q520 PolarHBondContact O-N 2.77Å; E518-E521 PolarHBondContact O-N 2.84Å; E518-V522 WeakPolarHBondContact O-CG2 3.38Å; E518-V522 PolarHBondContact O-N 3.41Å; E518-F531 HydrophobicContact CB-CD2 4.42Å; E518-F531 HydrophobicContact CB-CE2 4.1Å; E518-K534 IonicContact OE1-NZ 3.95Å; E518-K534 PolarHBondContact OE1-NZ 3.08Å; E518-K534 IonicContact OE2-NZ 2.85Å; E518-K534 PolarHBondContact OE2-NZ 2.91Å; E518-H535 IonicContact OE2-NE2 2.62Å
519	I	91.4	Very high	89.1	Confident	62 Å²	62	96.7 Å²	96.7	32%	0.318	47%	0.473	S	S	.	.	H	α-helix	trans	-71.5	-28	179	-166	62	0	0	0	113.2	M515 L516 Q517 E521 V522 L528 F531	M515-I519 WeakPolarHBondContact O-CG2 3.1Å; M515-I519 PolarHBondContact O-N 3.3Å; L516-I519 HydrophobicContact CD1-CG2 4.27Å; L516-I519 WeakPolarHBondContact O-CG2 3.4Å; Q517-I519 VanDerWaalsContact C-N 3.31Å; Q517-I519 PolarHBondContact O-N 3.49Å; I519-E521 VanDerWaalsContact C-N 3.3Å; I519-V522 HydrophobicContact CD1-CB 4.47Å; I519-V522 HydrophobicContact CD1-CG2 4.32Å; I519-V522 PolarHBondContact O-N 2.94Å; I519-L528 HydrophobicContact CD1-CD1 4.09Å; I519-F531 HydrophobicContact CB-CE2 4.2Å; I519-F531 HydrophobicContact CB-CZ 4.12Å; I519-F531 HydrophobicContact CD1-CD1 3.81Å; I519-F531 HydrophobicContact CD1-CD2 4.43Å; I519-F531 HydrophobicContact CD1-CE1 3.77Å; I519-F531 HydrophobicContact CD1-CE2 4.38Å; I519-F531 HydrophobicContact CD1-CG 4.16Å; I519-F531 HydrophobicContact CD1-CZ 4.06Å; I519-F531 HydrophobicContact CG1-CZ 4.48Å
520	Q	91.6	Very high	89.1	Confident	137 Å²	137	95 Å²	95	64%	0.64	47%	0.474	S	S	*	.	H	α-helix	trans	-70.9	-27.2	173.8	-75.7	173.5	16.5	0	0	112.4	L516 Q517 E518	L516-Q520 WeakPolarHBondContact O-CG 3.41Å; L516-Q520 PolarHBondContact O-N 3.37Å; Q517-Q520 WeakPolarHBondContact O-CB 3.09Å; Q517-Q520 PolarHBondContact O-N 3.45Å; Q517-Q520 VanDerWaalsContact O-N 3.07Å; E518-Q520 PolarHBondContact O-N 2.77Å
521	E	90.3	Very high	89.3	Confident	143 Å²	143	92.8 Å²	92.8	67%	0.668	46%	0.463	S	S	*	.	H	α-helix	trans	-77.5	-21.5	176.8	-70	-177.3	172.4	0	0	113.1	Q517 E518 I519 K523	Q517-E521 WeakPolarHBondContact O-CG 3.32Å; Q517-E521 PolarHBondContact O-N 3.01Å; Q517-E521 VanDerWaalsContact O-N 3.09Å; E518-E521 PolarHBondContact O-N 2.84Å; I519-E521 VanDerWaalsContact C-N 3.3Å; E521-K523 PolarHBondContact O-N 3.05Å
522	V	92.1	Very high	89.4	Confident	35 Å²	35	94.2 Å²	94.2	21%	0.212	47%	0.468	C	S	.	.			trans	-66.7	110.5	176.6	173.4	0	0	0	0	110.3	E518 I519 E527 L528 F531	E518-V522 WeakPolarHBondContact O-CG2 3.38Å; E518-V522 PolarHBondContact O-N 3.41Å; I519-V522 HydrophobicContact CD1-CB 4.47Å; I519-V522 HydrophobicContact CD1-CG2 4.32Å; I519-V522 PolarHBondContact O-N 2.94Å; V522-E527 HydrophobicContact CB-CB 4.43Å; V522-E527 HydrophobicContact CG1-CB 3.93Å; V522-E527 HydrophobicContact CG2-CB 4.34Å; V522-L528 HydrophobicContact CG1-CB 3.65Å; V522-L528 HydrophobicContact CG1-CD1 4.25Å; V522-F531 HydrophobicContact CG2-CB 4.2Å
523	K	92.2	Very high	89.5	Confident	184 Å²	184	92.1 Å²	92.1	80%	0.8	46%	0.462	S	S	*	.			trans	-116.1	-22.9	-179.5	-69.1	171.6	-171.9	173.6	0	112.7	E521 E527	E521-K523 PolarHBondContact O-N 3.05Å; K523-E527 PolarHBondContact N-OE2 3.31Å
524	T	92.6	Very high	89.4	Confident	51 Å²	51	91 Å²	91	31%	0.313	45%	0.452	S	S	.	.	S	Bend	trans	-107.8	151.6	-178.5	67	0	0	0	0	112.3	E526 E527 L528	T524-E526 PolarHBondContact O-N 3.26Å; T524-E527 PolarHBondContact N-OE2 3.03Å; T524-E527 VanDerWaalsContact N-OE2 3.14Å; T524-E527 PolarHBondContact O-N 3.38Å; T524-E527 WeakPolarHBondContact OG1-CB 3.31Å; T524-E527 WeakPolarHBondContact OG1-CG 3.47Å; T524-E527 PolarHBondContact OG1-N 3.37Å; T524-E527 PolarHBondContact OG1-OE1 3.41Å; T524-E527 VanDerWaalsContact OG1-OE1 3.12Å; T524-E527 PolarHBondContact OG1-OE2 3.19Å; T524-L528 PolarHBondContact O-N 3.27Å; T524-L528 VanDerWaalsContact O-N 3.09Å
525	P	89.4	Confident	89.5	Confident	98 Å²	98	86.5 Å²	86.5	64%	0.636	43%	0.43	S	S	*	.	H	α-helix	trans	-55.9	-34.1	173	-25.5	34.9	0	0	0	113.4	L528 E529	P525-L528 PolarHBondContact O-N 2.9Å; P525-E529 PolarHBondContact O-N 3.37Å
526	E	85.8	Confident	89.6	Confident	125 Å²	125	86.7 Å²	86.7	58%	0.584	44%	0.439	S	S	*	.	H	α-helix	trans	-69.9	-39.2	179	-65	73.8	-162.5	0	0	112.2	T524 E529 T530	T524-E526 PolarHBondContact O-N 3.26Å; E526-E529 PolarHBondContact O-N 2.9Å; E526-T530 PolarHBondContact O-N 3.17Å; E526-T530 PolarHBondContact O-OG1 2.89Å
527	E	86.4	Confident	89.6	Confident	82 Å²	82	85.9 Å²	85.9	38%	0.383	43%	0.433	S	S	.	.	H	α-helix	trans	-65.5	-39.5	173	-76.1	156.8	-154.6	0	0	111.4	V522 K523 T524 T530 F531	V522-E527 HydrophobicContact CB-CB 4.43Å; V522-E527 HydrophobicContact CG1-CB 3.93Å; V522-E527 HydrophobicContact CG2-CB 4.34Å; K523-E527 PolarHBondContact N-OE2 3.31Å; T524-E527 PolarHBondContact N-OE2 3.03Å; T524-E527 VanDerWaalsContact N-OE2 3.14Å; T524-E527 PolarHBondContact O-N 3.38Å; T524-E527 WeakPolarHBondContact OG1-CB 3.31Å; T524-E527 WeakPolarHBondContact OG1-CG 3.47Å; T524-E527 PolarHBondContact OG1-N 3.37Å; T524-E527 PolarHBondContact OG1-OE1 3.41Å; T524-E527 VanDerWaalsContact OG1-OE1 3.12Å; T524-E527 PolarHBondContact OG1-OE2 3.19Å; E527-T530 WeakPolarHBondContact O-CB 3.5Å; E527-T530 PolarHBondContact O-N 3.46Å; E527-F531 WeakPolarHBondContact O-CB 3.49Å; E527-F531 PolarHBondContact O-N 3.45Å
528	L	89.4	Confident	89.5	Confident	82 Å²	82	82.6 Å²	82.6	43%	0.429	42%	0.419	S	S	.	.	H	α-helix	trans	-64.3	-42.5	175.9	-178.4	62.5	0	0	0	111.5	I519 V522 T524 P525 T530 F531 M532	I519-L528 HydrophobicContact CD1-CD1 4.09Å; V522-L528 HydrophobicContact CG1-CB 3.65Å; V522-L528 HydrophobicContact CG1-CD1 4.25Å; T524-L528 PolarHBondContact O-N 3.27Å; T524-L528 VanDerWaalsContact O-N 3.09Å; P525-L528 PolarHBondContact O-N 2.9Å; L528-T530 VanDerWaalsContact C-N 3.3Å; L528-T530 PolarHBondContact O-N 3.21Å; L528-F531 PolarHBondContact O-N 3.46Å; L528-M532 HydrophobicContact CD1-CG 4.34Å; L528-M532 WeakPolarHBondContact O-CB 3.12Å; L528-M532 VanDerWaalsContact O-CG 3.3Å; L528-M532 WeakPolarHBondContact O-CG 3.35Å; L528-M532 PolarHBondContact O-N 3.35Å
529	E	86.2	Confident	89.7	Confident	90 Å²	90	82 Å²	82	42%	0.421	42%	0.417	S	S	.	.	H	α-helix	trans	-59.2	-44.8	173.9	-175.5	175.4	178.9	0	0	110.4	R120 P525 E526 F531 M532 L533	R120-E529 IonicContact CZ-OE1 2.83Å; R120-E529 IonicContact NH2-OE1 3.86Å; R120-E529 PolarHBondContact NH2-OE1 3.4Å; P525-E529 PolarHBondContact O-N 3.37Å; E526-E529 PolarHBondContact O-N 2.9Å; E529-F531 PolarHBondContact O-N 3.47Å; E529-M532 PolarHBondContact O-N 3.39Å; E529-L533 HydrophobicContact CG-CD1 3.86Å; E529-L533 HydrophobicContact CG-CG 4.26Å; E529-L533 WeakPolarHBondContact O-CB 3.44Å; E529-L533 WeakPolarHBondContact O-CG 3.45Å; E529-L533 PolarHBondContact O-N 2.98Å
530	T	87.4	Confident	89.7	Confident	97 Å²	97	84.4 Å²	84.4	60%	0.595	43%	0.43	S	S	*	.	H	α-helix	trans	-62.6	-43.8	179.4	-55.7	0	0	0	0	112.1	E526 E527 L528 L533 K534	E526-T530 PolarHBondContact O-N 3.17Å; E526-T530 PolarHBondContact O-OG1 2.89Å; E527-T530 WeakPolarHBondContact O-CB 3.5Å; E527-T530 PolarHBondContact O-N 3.46Å; L528-T530 VanDerWaalsContact C-N 3.3Å; L528-T530 PolarHBondContact O-N 3.21Å; T530-L533 PolarHBondContact O-N 2.98Å; T530-K534 WeakPolarHBondContact O-CB 3.49Å; T530-K534 PolarHBondContact O-N 3.45Å
531	F	91.3	Very high	89.5	Confident	31 Å²	31	81.3 Å²	81.3	14%	0.136	42%	0.418	C	S	.	.	H	α-helix	trans	-59.4	-50.5	174.8	178.1	-88.6	0	0	0	111.4	M515 E518 I519 V522 E527 L528 E529 L533 K534 H535	M515-F531 HydrophobicContact CG-CE2 4.13Å; M515-F531 HydrophobicContact CG-CZ 3.87Å; M515-F531 HydrophobicContact SD-CZ 4.43Å; E518-F531 HydrophobicContact CB-CD2 4.42Å; E518-F531 HydrophobicContact CB-CE2 4.1Å; I519-F531 HydrophobicContact CB-CE2 4.2Å; I519-F531 HydrophobicContact CB-CZ 4.12Å; I519-F531 HydrophobicContact CD1-CD1 3.81Å; I519-F531 HydrophobicContact CD1-CD2 4.43Å; I519-F531 HydrophobicContact CD1-CE1 3.77Å; I519-F531 HydrophobicContact CD1-CE2 4.38Å; I519-F531 HydrophobicContact CD1-CG 4.16Å; I519-F531 HydrophobicContact CD1-CZ 4.06Å; I519-F531 HydrophobicContact CG1-CZ 4.48Å; V522-F531 HydrophobicContact CG2-CB 4.2Å; E527-F531 WeakPolarHBondContact O-CB 3.49Å; E527-F531 PolarHBondContact O-N 3.45Å; L528-F531 PolarHBondContact O-N 3.46Å; E529-F531 PolarHBondContact O-N 3.47Å; F531-L533 VanDerWaalsContact C-N 3.31Å; F531-L533 PolarHBondContact O-N 2.99Å; F531-K534 PolarHBondContact O-N 2.87Å; F531-H535 AromaticContact CD1-CD2 3.85Å; F531-H535 AromaticContact CD2-CD2 3.74Å; F531-H535 AromaticContact CD2-NE2 3.7Å; F531-H535 AromaticContact CE1-CD2 3.56Å; F531-H535 AromaticContact CE2-CD2 3.45Å; F531-H535 VanDerWaalsContact CE2-CD2 3.45Å; F531-H535 WeakPolarHBondContact CE2-CD2 3.46Å; F531-H535 AromaticContact CE2-NE2 3.2Å; F531-H535 WeakPolarHBondContact CE2-NE2 3.31Å; F531-H535 AromaticContact CG-CD2 3.93Å; F531-H535 AromaticContact CZ-CD2 3.35Å; F531-H535 WeakPolarHBondContact CZ-CD2 3.4Å; F531-H535 AromaticContact CZ-NE2 3.46Å; F531-H535 WeakPolarHBondContact CZ-NE2 3.36Å; F531-H535 PolarHBondContact O-CD2 3.05Å; F531-H535 VanDerWaalsContact O-CD2 3.23Å; F531-H535 PolarHBondContact O-N 2.87Å
532	M	91.6	Very high	89.5	Confident	121 Å²	121	75.1 Å²	75.1	60%	0.596	39%	0.389	S	S	*	.	H	α-helix	trans	-62.8	-36.9	179.5	-72.2	-64.6	-64.2	0	0	112.4	L528 E529 G536	L528-M532 HydrophobicContact CD1-CG 4.34Å; L528-M532 WeakPolarHBondContact O-CB 3.12Å; L528-M532 VanDerWaalsContact O-CG 3.3Å; L528-M532 WeakPolarHBondContact O-CG 3.35Å; L528-M532 PolarHBondContact O-N 3.35Å; E529-M532 PolarHBondContact O-N 3.39Å; M532-G536 WeakPolarHBondContact O-CA 3.37Å; M532-G536 PolarHBondContact O-N 2.86Å
533	L	88.6	Confident	89.6	Confident	75 Å²	75	74.5 Å²	74.5	39%	0.393	39%	0.385	S	S	.	.	H	α-helix	trans	-67.5	-44.2	176.2	-71.7	172.5	0	0	0	111.7	E529 T530 F531 G536 E537	E529-L533 HydrophobicContact CG-CD1 3.86Å; E529-L533 HydrophobicContact CG-CG 4.26Å; E529-L533 WeakPolarHBondContact O-CB 3.44Å; E529-L533 WeakPolarHBondContact O-CG 3.45Å; E529-L533 PolarHBondContact O-N 2.98Å; T530-L533 PolarHBondContact O-N 2.98Å; F531-L533 VanDerWaalsContact C-N 3.31Å; F531-L533 PolarHBondContact O-N 2.99Å; L533-G536 PolarHBondContact O-N 3.48Å; L533-E537 WeakPolarHBondContact O-CB 3.46Å; L533-E537 PolarHBondContact O-N 3.11Å
534	K	87.3	Confident	89.6	Confident	92 Å²	92	67 Å²	67	40%	0.4	36%	0.359	S	S	.	.	H	α-helix	trans	-57.7	-51.8	176.5	177.1	-172	172.2	-167.3	0	111.1	E518 T530 F531 N538	E518-K534 IonicContact OE1-NZ 3.95Å; E518-K534 PolarHBondContact OE1-NZ 3.08Å; E518-K534 IonicContact OE2-NZ 2.85Å; E518-K534 PolarHBondContact OE2-NZ 2.91Å; T530-K534 WeakPolarHBondContact O-CB 3.49Å; T530-K534 PolarHBondContact O-N 3.45Å; F531-K534 PolarHBondContact O-N 2.87Å; K534-N538 PolarHBondContact O-N 2.93Å; K534-N538 PolarHBondContact O-ND2 2.89Å
535	H	90.9	Very high	89.4	Confident	15 Å²	15	66.4 Å²	66.4	7%	0.069	36%	0.36	C	S	.	.	H	α-helix	trans	-74.3	-36.3	-178.7	-68.1	-67	0	0	0	112.4	Y506 E518 F531 E537 N538 I539	Y506-H535 HydrophobicContact CE1-CB 4.38Å; Y506-H535 AromaticContact CE1-ND1 3.75Å; Y506-H535 AromaticContact CZ-ND1 3.7Å; Y506-H535 PolarHBondContact OH-ND1 3.19Å; E518-H535 IonicContact OE2-NE2 2.62Å; F531-H535 AromaticContact CD1-CD2 3.85Å; F531-H535 AromaticContact CD2-CD2 3.74Å; F531-H535 AromaticContact CD2-NE2 3.7Å; F531-H535 AromaticContact CE1-CD2 3.56Å; F531-H535 AromaticContact CE2-CD2 3.45Å; F531-H535 VanDerWaalsContact CE2-CD2 3.45Å; F531-H535 WeakPolarHBondContact CE2-CD2 3.46Å; F531-H535 AromaticContact CE2-NE2 3.2Å; F531-H535 WeakPolarHBondContact CE2-NE2 3.31Å; F531-H535 AromaticContact CG-CD2 3.93Å; F531-H535 AromaticContact CZ-CD2 3.35Å; F531-H535 WeakPolarHBondContact CZ-CD2 3.4Å; F531-H535 AromaticContact CZ-NE2 3.46Å; F531-H535 WeakPolarHBondContact CZ-NE2 3.36Å; F531-H535 PolarHBondContact O-CD2 3.05Å; F531-H535 VanDerWaalsContact O-CD2 3.23Å; F531-H535 PolarHBondContact O-N 2.87Å; H535-E537 VanDerWaalsContact C-N 3.35Å; H535-E537 PolarHBondContact O-N 3.47Å; H535-N538 PolarHBondContact O-N 3.38Å; H535-I539 VanDerWaalsContact O-CG1 3.27Å; H535-I539 WeakPolarHBondContact O-CG1 3.46Å; H535-I539 PolarHBondContact O-N 3.49Å
536	G	90.7	Very high	89.5	Confident	31 Å²	31	62.8 Å²	62.8	32%	0.32	34%	0.335	S	S	.	.	H	α-helix	trans	-58.7	-43.3	175.2	0	0	0	0	0	112.8	M532 L533 I539 I540	M532-G536 WeakPolarHBondContact O-CA 3.37Å; M532-G536 PolarHBondContact O-N 2.86Å; L533-G536 PolarHBondContact O-N 3.48Å; G536-I539 PolarHBondContact O-N 2.84Å; G536-I540 WeakPolarHBondContact O-CG1 3.22Å; G536-I540 PolarHBondContact O-N 3.41Å; G536-I540 VanDerWaalsContact O-N 3.14Å
537	E	87.9	Confident	89.8	Confident	78 Å²	78	57.5 Å²	57.5	36%	0.364	31%	0.31	S	S	.	.	H	α-helix	trans	-59.7	-47	175.1	-175.1	173.7	-156.5	0	0	111.8	F131 R156 L533 H535 I539 I540 D541	F131-E537 WeakPolarHBondContact CE2-OE1 3.3Å; F131-E537 WeakPolarHBondContact CZ-OE1 3.48Å; R156-E537 IonicContact CZ-OE1 3.59Å; R156-E537 IonicContact NH1-OE1 2.74Å; R156-E537 IonicContact NH2-OE1 2.7Å; R156-E537 PolarHBondContact NH2-OE1 3.23Å; R156-E537 IonicContact NH2-OE2 2.95Å; L533-E537 WeakPolarHBondContact O-CB 3.46Å; L533-E537 PolarHBondContact O-N 3.11Å; H535-E537 VanDerWaalsContact C-N 3.35Å; H535-E537 PolarHBondContact O-N 3.47Å; E537-I539 VanDerWaalsContact C-N 3.33Å; E537-I539 PolarHBondContact O-N 3.33Å; E537-I540 PolarHBondContact O-N 3.23Å; E537-D541 PolarHBondContact O-N 2.85Å
538	N	88.6	Confident	90.1	Very high	51 Å²	51	55.6 Å²	55.6	27%	0.273	30%	0.303	S	S	.	.	H	α-helix	trans	-68.5	-30.1	-179.7	-65	-45.4	0	0	0	113.5	Y506 K534 H535 D541 T542	Y506-N538 HydrophobicContact CD2-CB 4Å; Y506-N538 HydrophobicContact CE2-CB 3.31Å; Y506-N538 PolarHBondContact OH-ND2 3.16Å; K534-N538 PolarHBondContact O-N 2.93Å; K534-N538 PolarHBondContact O-ND2 2.89Å; H535-N538 PolarHBondContact O-N 3.38Å; N538-D541 PolarHBondContact O-N 2.98Å; N538-T542 WeakPolarHBondContact O-CB 3.35Å; N538-T542 PolarHBondContact O-N 3.2Å; N538-T542 PolarHBondContact O-OG1 2.63Å
539	I	92.6	Very high	90.3	Very high	42 Å²	42	56.1 Å²	56.1	22%	0.215	30%	0.299	C	S	.	.	H	α-helix	trans	-66.2	-42.3	173.4	-70.1	164.5	0	0	0	109.9	V502 T503 Y506 H535 G536 E537 T542 L543	V502-I539 HydrophobicContact CG1-CG2 4.36Å; T503-I539 HydrophobicContact CG2-CD1 4.05Å; Y506-I539 HydrophobicContact CD1-CD1 4.34Å; Y506-I539 HydrophobicContact CD1-CG1 3.65Å; Y506-I539 HydrophobicContact CE1-CG1 4.2Å; Y506-I539 HydrophobicContact CG-CG1 3.98Å; H535-I539 VanDerWaalsContact O-CG1 3.27Å; H535-I539 WeakPolarHBondContact O-CG1 3.46Å; H535-I539 PolarHBondContact O-N 3.49Å; G536-I539 PolarHBondContact O-N 2.84Å; E537-I539 VanDerWaalsContact C-N 3.33Å; E537-I539 PolarHBondContact O-N 3.33Å; I539-T542 WeakPolarHBondContact O-CB 3.45Å; I539-T542 PolarHBondContact O-N 2.88Å; I539-L543 PolarHBondContact O-N 3.26Å
540	I	91.6	Very high	90.6	Very high	113 Å²	113	51.9 Å²	51.9	58%	0.579	28%	0.279	S	S	*	.	H	α-helix	trans	-65.7	-38.6	175.1	-62.9	-61.8	0	0	0	111.4	G536 E537 T542 L543 G544	G536-I540 WeakPolarHBondContact O-CG1 3.22Å; G536-I540 PolarHBondContact O-N 3.41Å; G536-I540 VanDerWaalsContact O-N 3.14Å; E537-I540 PolarHBondContact O-N 3.23Å; I540-T542 VanDerWaalsContact C-N 3.28Å; I540-T542 PolarHBondContact O-N 3.4Å; I540-L543 WeakPolarHBondContact O-CB 3.46Å; I540-L543 PolarHBondContact O-N 3.32Å; I540-G544 PolarHBondContact O-N 3.1Å; I540-G544 VanDerWaalsContact O-N 3.07Å
541	D	87.8	Confident	90.9	Very high	72 Å²	72	48.6 Å²	48.6	39%	0.385	26%	0.257	S	S	.	.	H	α-helix	trans	-62	-38.2	172.3	-71.9	-42.8	0	0	0	112.1	R156 E537 N538 G544 A545	R156-D541 IonicContact CZ-OD2 3.96Å; R156-D541 IonicContact NH1-OD1 2.9Å; R156-D541 PolarHBondContact NH1-OD1 2.83Å; R156-D541 IonicContact NH1-OD2 3.43Å; R156-D541 PolarHBondContact NH1-OD2 3.23Å; E537-D541 PolarHBondContact O-N 2.85Å; N538-D541 PolarHBondContact O-N 2.98Å; D541-G544 PolarHBondContact O-N 3.49Å; D541-A545 PolarHBondContact O-N 2.7Å
542	T	89.8	Confident	90.8	Very high	12 Å²	12	51.1 Å²	51.1	7%	0.074	27%	0.268	C	S	.	.	H	α-helix	trans	-66.9	-39.7	176.3	-56.8	0	0	0	0	111.3	V502 N538 I539 I540 G544 A545 E546	V502-T542 HydrophobicContact CG1-CG2 4.21Å; N538-T542 WeakPolarHBondContact O-CB 3.35Å; N538-T542 PolarHBondContact O-N 3.2Å; N538-T542 PolarHBondContact O-OG1 2.63Å; I539-T542 WeakPolarHBondContact O-CB 3.45Å; I539-T542 PolarHBondContact O-N 2.88Å; I540-T542 VanDerWaalsContact C-N 3.28Å; I540-T542 PolarHBondContact O-N 3.4Å; T542-G544 VanDerWaalsContact C-N 3.32Å; T542-G544 PolarHBondContact O-N 3.49Å; T542-A545 WeakPolarHBondContact O-CA 3.27Å; T542-A545 VanDerWaalsContact O-CB 3.31Å; T542-A545 WeakPolarHBondContact O-CB 3.45Å; T542-A545 PolarHBondContact O-N 2.87Å; T542-E546 PolarHBondContact O-N 2.67Å
543	L	93.4	Very high	90.8	Very high	23 Å²	23	47.8 Å²	47.8	12%	0.12	25%	0.251	C	S	.	.	H	α-helix	trans	-57.4	-45.6	172.3	178.1	59.9	0	0	0	111.4	F497 V502 I539 I540 A545 E546 V547 I568	F497-L543 HydrophobicContact CB-CD1 3.65Å; F497-L543 HydrophobicContact CD1-CD1 3.82Å; F497-L543 HydrophobicContact CD2-CD1 3.73Å; F497-L543 HydrophobicContact CE1-CD1 4.38Å; F497-L543 HydrophobicContact CE2-CD1 4.29Å; F497-L543 HydrophobicContact CG-CD1 3.45Å; F497-L543 VanDerWaalsContact CG-CD1 3.45Å; V502-L543 HydrophobicContact CG1-CB 3.99Å; V502-L543 HydrophobicContact CG2-CD1 4.05Å; I539-L543 PolarHBondContact O-N 3.26Å; I540-L543 WeakPolarHBondContact O-CB 3.46Å; I540-L543 PolarHBondContact O-N 3.32Å; L543-A545 VanDerWaalsContact C-N 3.26Å; L543-A545 PolarHBondContact O-N 2.9Å; L543-E546 PolarHBondContact O-N 3.46Å; L543-E546 VanDerWaalsContact O-N 3.13Å; L543-V547 WeakPolarHBondContact O-CG2 3.48Å; L543-V547 PolarHBondContact O-N 2.73Å; L543-I568 HydrophobicContact CD2-CD1 3.69Å; L543-I568 HydrophobicContact CD2-CG1 4.37Å; L543-I568 HydrophobicContact CD2-CG2 4.17Å; L543-I568 HydrophobicContact CG-CD1 3.81Å; L543-I568 HydrophobicContact CG-CG1 4.48Å
544	G	91.4	Very high	91	Very high	25 Å²	25	44.2 Å²	44.2	26%	0.258	23%	0.233	S	C	.	.	H	α-helix	trans	-59.9	-35.6	173.4	0	0	0	0	0	112.9	R157 I540 D541 T542 D548	R157-G544 PolarHBondContact NH1-O 3.03Å; I540-G544 PolarHBondContact O-N 3.1Å; I540-G544 VanDerWaalsContact O-N 3.07Å; D541-G544 PolarHBondContact O-N 3.49Å; T542-G544 VanDerWaalsContact C-N 3.32Å; T542-G544 PolarHBondContact O-N 3.49Å; G544-D548 PolarHBondContact O-N 2.97Å
545	A	88.9	Confident	91.2	Very high	39 Å²	39	43.3 Å²	43.3	32%	0.322	23%	0.229	S	C	.	.	H	α-helix	trans	-63.7	-39.9	173.1	0	0	0	0	0	113.3	R157 D541 T542 L543 R549	R157-A545 VanDerWaalsContact NH1-CA 3.3Å; D541-A545 PolarHBondContact O-N 2.7Å; T542-A545 WeakPolarHBondContact O-CA 3.27Å; T542-A545 VanDerWaalsContact O-CB 3.31Å; T542-A545 WeakPolarHBondContact O-CB 3.45Å; T542-A545 PolarHBondContact O-N 2.87Å; L543-A545 VanDerWaalsContact C-N 3.26Å; L543-A545 PolarHBondContact O-N 2.9Å; A545-R549 PolarHBondContact O-N 3.04Å
546	E	91.4	Very high	91.1	Very high	23 Å²	23	51.3 Å²	51.3	11%	0.107	26%	0.263	C	S	.	.	H	α-helix	trans	-67	-42.7	176.5	-66.3	-57.1	149.7	0	0	112.1	F497 S505 T542 L543 D548 R549 L550	F497-E546 HydrophobicContact CE1-CB 4.43Å; S505-E546 PolarHBondContact OG-OE1 2.91Å; T542-E546 PolarHBondContact O-N 2.67Å; L543-E546 PolarHBondContact O-N 3.46Å; L543-E546 VanDerWaalsContact O-N 3.13Å; E546-D548 VanDerWaalsContact C-N 3.35Å; E546-D548 PolarHBondContact O-N 2.98Å; E546-R549 WeakPolarHBondContact O-CB 3.39Å; E546-R549 PolarHBondContact O-N 3.09Å; E546-R549 VanDerWaalsContact O-N 3.17Å; E546-R549 IonicContact OE2-CZ 2.93Å; E546-R549 VanDerWaalsContact OE2-CZ 3.26Å; E546-R549 IonicContact OE2-NE 2.66Å; E546-R549 PolarHBondContact OE2-NE 2.86Å; E546-R549 IonicContact OE2-NH2 3.78Å; E546-R549 PolarHBondContact OE2-NH2 3.15Å; E546-L550 WeakPolarHBondContact O-CG 3.24Å; E546-L550 PolarHBondContact O-N 3.42Å
547	V	93.8	Very high	91	Very high	13 Å²	13	57.3 Å²	57.3	8%	0.079	28%	0.276	C	S	.	.	H	α-helix	trans	-53.4	-52.6	175.3	171.7	0	0	0	0	110.8	F497 L543 R549 L550 E551 L566 I568	F497-V547 HydrophobicContact CE1-CG2 4.4Å; F497-V547 HydrophobicContact CE2-CG2 3.75Å; F497-V547 HydrophobicContact CZ-CB 4.47Å; F497-V547 HydrophobicContact CZ-CG2 3.53Å; L543-V547 WeakPolarHBondContact O-CG2 3.48Å; L543-V547 PolarHBondContact O-N 2.73Å; V547-R549 VanDerWaalsContact C-N 3.33Å; V547-R549 PolarHBondContact O-N 3.45Å; V547-L550 WeakPolarHBondContact O-CB 3.32Å; V547-L550 PolarHBondContact O-N 2.84Å; V547-E551 WeakPolarHBondContact O-CG 3.46Å; V547-E551 PolarHBondContact O-N 3.32Å; V547-L566 HydrophobicContact CG1-CB 4Å; V547-I568 HydrophobicContact CG2-CD1 4.07Å; V547-I568 HydrophobicContact CG2-CG1 3.99Å
548	D	91	Very high	91.2	Very high	43 Å²	43	54.9 Å²	54.9	23%	0.23	27%	0.266	C	S	.	.	H	α-helix	trans	-69	-29.6	-179.1	-75.3	-89.4	0	0	0	114.1	R157 G544 E546 L550 E551 K552	R157-D548 IonicContact CZ-OD1 3.2Å; R157-D548 IonicContact CZ-OD2 2.81Å; R157-D548 IonicContact NE-OD2 2.97Å; R157-D548 VanDerWaalsContact NH1-CG 3.32Å; R157-D548 IonicContact NH1-OD2 3.01Å; R157-D548 PolarHBondContact NH1-OD2 2.99Å; R157-D548 IonicContact NH2-OD1 2.93Å; R157-D548 PolarHBondContact NH2-OD1 3Å; R157-D548 IonicContact NH2-OD2 2.82Å; R157-D548 PolarHBondContact NH2-OD2 2.66Å; G544-D548 PolarHBondContact O-N 2.97Å; E546-D548 VanDerWaalsContact C-N 3.35Å; E546-D548 PolarHBondContact O-N 2.98Å; D548-L550 VanDerWaalsContact C-N 3.34Å; D548-E551 PolarHBondContact O-N 3.25Å; D548-K552 WeakPolarHBondContact O-CB 3.22Å; D548-K552 VanDerWaalsContact O-CG 3.26Å; D548-K552 WeakPolarHBondContact O-CG 3.42Å; D548-K552 PolarHBondContact O-N 3.19Å
549	R	93.4	Very high	91.1	Very high	92 Å²	92	57.5 Å²	57.5	35%	0.347	29%	0.286	S	S	.	.	H	α-helix	trans	-59.7	-49.5	171.4	179.7	-177.2	66	92.3	-3.7	109.4	D470 A545 E546 V547 K552 E553	D470-R549 IonicContact OD1-NH2 2.76Å; D470-R549 PolarHBondContact OD1-NH2 2.8Å; D470-R549 IonicContact OD2-CZ 3.86Å; D470-R549 IonicContact OD2-NH1 3.15Å; D470-R549 PolarHBondContact OD2-NH1 3.45Å; D470-R549 IonicContact OD2-NH2 2.94Å; D470-R549 PolarHBondContact OD2-NH2 3.28Å; A545-R549 PolarHBondContact O-N 3.04Å; E546-R549 WeakPolarHBondContact O-CB 3.39Å; E546-R549 PolarHBondContact O-N 3.09Å; E546-R549 VanDerWaalsContact O-N 3.17Å; E546-R549 IonicContact OE2-CZ 2.93Å; E546-R549 VanDerWaalsContact OE2-CZ 3.26Å; E546-R549 IonicContact OE2-NE 2.66Å; E546-R549 PolarHBondContact OE2-NE 2.86Å; E546-R549 IonicContact OE2-NH2 3.78Å; E546-R549 PolarHBondContact OE2-NH2 3.15Å; V547-R549 VanDerWaalsContact C-N 3.33Å; V547-R549 PolarHBondContact O-N 3.45Å; R549-K552 PolarHBondContact O-N 3.36Å; R549-E553 IonicContact NH1-OE2 3.56Å; R549-E553 WeakPolarHBondContact O-CB 3.15Å; R549-E553 PolarHBondContact O-N 3.04Å
550	L	93.3	Very high	90.7	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-61.9	-44	178.1	-68.2	175.9	0	0	0	111.8	L467 D470 V473 F497 E546 V547 D548 K552 E553 L554 L566	L467-L550 HydrophobicContact CD2-CB 4.09Å; L467-L550 HydrophobicContact CD2-CD1 4.33Å; L467-L550 HydrophobicContact CD2-CD2 4.26Å; L467-L550 HydrophobicContact CD2-CG 4.48Å; D470-L550 HydrophobicContact CB-CD2 3.76Å; D470-L550 WeakPolarHBondContact OD2-CD2 3.25Å; V473-L550 HydrophobicContact CG2-CD1 3.73Å; F497-L550 HydrophobicContact CE1-CD1 3.63Å; F497-L550 HydrophobicContact CZ-CD1 3.92Å; E546-L550 WeakPolarHBondContact O-CG 3.24Å; E546-L550 PolarHBondContact O-N 3.42Å; V547-L550 WeakPolarHBondContact O-CB 3.32Å; V547-L550 PolarHBondContact O-N 2.84Å; D548-L550 VanDerWaalsContact C-N 3.34Å; L550-K552 VanDerWaalsContact C-N 3.35Å; L550-K552 PolarHBondContact O-N 3.14Å; L550-E553 PolarHBondContact O-N 3.31Å; L550-L554 WeakPolarHBondContact O-CB 3.17Å; L550-L554 PolarHBondContact O-N 2.76Å; L550-L566 HydrophobicContact CB-CD1 3.7Å
551	E	92.9	Very high	90.6	Very high	28 Å²	28	53.3 Å²	53.3	13%	0.131	26%	0.263	C	S	.	.	H	α-helix	trans	-59.9	-44.1	176.7	-71.3	-158.9	-178.7	0	0	112.9	V547 D548 E553 K555 V564 L566	V547-E551 WeakPolarHBondContact O-CG 3.46Å; V547-E551 PolarHBondContact O-N 3.32Å; D548-E551 PolarHBondContact O-N 3.25Å; E551-E553 VanDerWaalsContact C-N 3.34Å; E551-K555 WeakPolarHBondContact O-CD 3.05Å; E551-K555 VanDerWaalsContact O-CG 3.28Å; E551-K555 WeakPolarHBondContact O-CG 3.44Å; E551-K555 PolarHBondContact O-N 3.43Å; E551-K555 IonicContact OE2-NZ 2.83Å; E551-K555 PolarHBondContact OE2-NZ 3.35Å; E551-V564 HydrophobicContact CB-CB 4.4Å; E551-V564 HydrophobicContact CB-CG1 4.2Å; E551-V564 HydrophobicContact CG-CB 4.25Å; E551-V564 HydrophobicContact CG-CG1 3.78Å; E551-L566 HydrophobicContact CG-CB 4.45Å; E551-L566 HydrophobicContact CG-CD1 3.86Å; E551-L566 HydrophobicContact CG-CG 3.96Å; E551-L566 PolarHBondContact OE1-N 2.91Å
552	K	90.4	Very high	90.5	Very high	84 Å²	84	56.8 Å²	56.8	37%	0.365	27%	0.271	S	S	.	.	H	α-helix	trans	-66	-40.1	178	-74.7	174	-173.5	-176.4	0	111.3	D162 D548 R549 L550 K555 K556	D162-K552 WeakPolarHBondContact OD1-CE 3.37Å; D162-K552 IonicContact OD1-NZ 3.26Å; D162-K552 PolarHBondContact OD1-NZ 3.27Å; D162-K552 WeakPolarHBondContact OD2-CE 3.48Å; D162-K552 IonicContact OD2-NZ 3.2Å; D162-K552 PolarHBondContact OD2-NZ 3.42Å; D548-K552 WeakPolarHBondContact O-CB 3.22Å; D548-K552 VanDerWaalsContact O-CG 3.26Å; D548-K552 WeakPolarHBondContact O-CG 3.42Å; D548-K552 PolarHBondContact O-N 3.19Å; R549-K552 PolarHBondContact O-N 3.36Å; L550-K552 VanDerWaalsContact C-N 3.35Å; L550-K552 PolarHBondContact O-N 3.14Å; K552-K555 PolarHBondContact O-N 3.17Å; K552-K556 VanDerWaalsContact O-CB 3.25Å; K552-K556 WeakPolarHBondContact O-CB 3.47Å; K552-K556 PolarHBondContact O-N 2.7Å
553	E	91.2	Very high	90.5	Very high	51 Å²	51	58.7 Å²	58.7	24%	0.238	28%	0.279	C	S	.	.	H	α-helix	trans	-64.1	-44.8	178.1	-176.9	160.7	-166.9	0	0	111.9	L466 R549 L550 E551 K556 R557	L466-E553 HydrophobicContact CD2-CG 4.47Å; R549-E553 IonicContact NH1-OE2 3.56Å; R549-E553 WeakPolarHBondContact O-CB 3.15Å; R549-E553 PolarHBondContact O-N 3.04Å; L550-E553 PolarHBondContact O-N 3.31Å; E551-E553 VanDerWaalsContact C-N 3.34Å; E553-K556 PolarHBondContact O-N 3.41Å; E553-R557 WeakPolarHBondContact O-CB 3.37Å; E553-R557 WeakPolarHBondContact O-CG 3.38Å; E553-R557 PolarHBondContact O-N 2.92Å; E553-R557 IonicContact OE1-CZ 2.95Å; E553-R557 IonicContact OE1-NE 3.9Å; E553-R557 PolarHBondContact OE1-NE 3.14Å; E553-R557 IonicContact OE1-NH2 3Å; E553-R557 PolarHBondContact OE1-NH2 3.43Å
554	L	92.4	Very high	90.5	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-56.3	-51.4	171.8	-81.6	171.3	0	0	0	111.6	L463 L466 L467 F491 L550 K556 R557 N558 V564 L566	L463-L554 HydrophobicContact CB-CD2 4.49Å; L463-L554 HydrophobicContact CD2-CD2 3.98Å; L466-L554 HydrophobicContact CB-CD2 4.5Å; L466-L554 HydrophobicContact CD1-CD2 3.99Å; L466-L554 HydrophobicContact CD2-CD2 3.63Å; L466-L554 HydrophobicContact CD2-CG 3.99Å; L466-L554 HydrophobicContact CG-CD2 4.26Å; L467-L554 HydrophobicContact CD1-CD1 4.09Å; L467-L554 HydrophobicContact CD2-CD1 3.72Å; L467-L554 HydrophobicContact CD2-CG 4.13Å; L467-L554 HydrophobicContact CG-CD1 4.01Å; L467-L554 HydrophobicContact CG-CD2 4.3Å; L467-L554 HydrophobicContact CG-CG 4.41Å; F491-L554 HydrophobicContact CD1-CD1 4.32Å; F491-L554 HydrophobicContact CE1-CD1 4.23Å; L550-L554 WeakPolarHBondContact O-CB 3.17Å; L550-L554 PolarHBondContact O-N 2.76Å; L554-K556 VanDerWaalsContact C-N 3.28Å; L554-K556 PolarHBondContact O-N 3.48Å; L554-R557 PolarHBondContact O-N 3.2Å; L554-N558 WeakPolarHBondContact O-CB 3.39Å; L554-N558 PolarHBondContact O-N 3.33Å; L554-V564 HydrophobicContact CB-CG2 4.3Å; L554-V564 HydrophobicContact CD1-CG1 3.78Å; L554-L566 HydrophobicContact CD1-CD1 4.4Å; L554-L566 HydrophobicContact CD1-CD2 4.38Å
555	K	90.9	Very high	90.6	Very high	73 Å²	73	59.8 Å²	59.8	32%	0.317	28%	0.279	S	S	.	.	H	α-helix	trans	-61.3	-36.1	179.2	-71.9	164.5	-175.2	153.1	0	112.3	E551 K552 N558 V564	E551-K555 WeakPolarHBondContact O-CD 3.05Å; E551-K555 VanDerWaalsContact O-CG 3.28Å; E551-K555 WeakPolarHBondContact O-CG 3.44Å; E551-K555 PolarHBondContact O-N 3.43Å; E551-K555 IonicContact OE2-NZ 2.83Å; E551-K555 PolarHBondContact OE2-NZ 3.35Å; K552-K555 PolarHBondContact O-N 3.17Å; K555-N558 CarbonylContact O-C 3.56Å; K555-V564 HydrophobicContact CD-CG2 4.34Å; K555-V564 HydrophobicContact CG-CG2 3.79Å
556	K	90.4	Very high	90.9	Very high	182 Å²	182	58.4 Å²	58.4	79%	0.791	27%	0.266	S	S	*	.	H	α-helix	trans	-73.3	-42.1	-178.9	-174.4	-179.8	179.2	-176.1	0	112.2	K552 E553 L554	K552-K556 VanDerWaalsContact O-CB 3.25Å; K552-K556 WeakPolarHBondContact O-CB 3.47Å; K552-K556 PolarHBondContact O-N 2.7Å; E553-K556 PolarHBondContact O-N 3.41Å; L554-K556 VanDerWaalsContact C-N 3.28Å; L554-K556 PolarHBondContact O-N 3.48Å
557	R	89	Confident	91.1	Very high	157 Å²	157	60.7 Å²	60.7	59%	0.592	28%	0.277	S	S	*	.	H	α-helix	trans	-77.1	-27.7	178.9	-69.6	177.7	-179.2	-139.7	11.5	112.1	L466 E553 L554	L466-R557 HydrophobicContact CD1-CB 3.95Å; L466-R557 VanDerWaalsContact CD1-CD 3.42Å; L466-R557 HydrophobicContact CD1-CG 4.33Å; E553-R557 WeakPolarHBondContact O-CB 3.37Å; E553-R557 WeakPolarHBondContact O-CG 3.38Å; E553-R557 PolarHBondContact O-N 2.92Å; E553-R557 IonicContact OE1-CZ 2.95Å; E553-R557 IonicContact OE1-NE 3.9Å; E553-R557 PolarHBondContact OE1-NE 3.14Å; E553-R557 IonicContact OE1-NH2 3Å; E553-R557 PolarHBondContact OE1-NH2 3.43Å; L554-R557 PolarHBondContact O-N 3.2Å
558	N	90.3	Very high	91	Very high	27 Å²	27	64.3 Å²	64.3	14%	0.144	30%	0.295	C	S	.	.			trans	-129.3	82.8	-179	-65.6	90	0	0	0	111.4	L463 L554 K555 E560 V561	L463-N558 HydrophobicContact CD2-CB 3.96Å; L463-N558 VanDerWaalsContact CD2-CG 3.49Å; L463-N558 WeakPolarHBondContact CD2-OD1 3.49Å; L554-N558 WeakPolarHBondContact O-CB 3.39Å; L554-N558 PolarHBondContact O-N 3.33Å; K555-N558 CarbonylContact O-C 3.56Å; N558-E560 PolarHBondContact ND2-OE1 3.03Å; N558-E560 PolarHBondContact O-N 2.92Å; N558-V561 HydrophobicContact CB-CB 4.34Å; N558-V561 HydrophobicContact CB-CG2 3.81Å; N558-V561 PolarHBondContact O-N 3Å
559	P	86.3	Confident	90.6	Very high	106 Å²	106	68.3 Å²	68.3	69%	0.688	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-21.5	-177.9	-23.8	34	0	0	0	114.6	V561	P559-V561 VanDerWaalsContact C-N 3.3Å
560	E	84.9	Confident	90.5	Very high	64 Å²	64	67.1 Å²	67.1	30%	0.299	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-27.1	173.3	65.8	-82.3	-167	0	0	113.1	K488 V489 N558 R562	K488-E560 CarbonylContact C-O 3.53Å; V489-E560 HydrophobicContact CG2-CG 4.43Å; V489-E560 PolarHBondContact N-O 3.46Å; N558-E560 PolarHBondContact ND2-OE1 3.03Å; N558-E560 PolarHBondContact O-N 2.92Å; E560-R562 PolarHBondContact O-N 3.32Å; E560-R562 VanDerWaalsContact O-N 3.15Å
561	V	90.3	Very high	90.3	Very high	3 Å²	3	70.6 Å²	70.6	2%	0.018	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	90.5	179.3	-172.1	0	0	0	0	109.3	L463 V489 F491 N558 P559 V564	L463-V561 HydrophobicContact CD1-CG2 3.89Å; L463-V561 HydrophobicContact CD2-CG2 3.99Å; V489-V561 HydrophobicContact CB-CG2 4.24Å; V489-V561 HydrophobicContact CG1-CG2 4.25Å; F491-V561 HydrophobicContact CB-CG1 3.58Å; N558-V561 HydrophobicContact CB-CB 4.34Å; N558-V561 HydrophobicContact CB-CG2 3.81Å; N558-V561 PolarHBondContact O-N 3Å; P559-V561 VanDerWaalsContact C-N 3.3Å; V561-V564 HydrophobicContact CG1-CG2 3.52Å
562	R	85.6	Confident	90.2	Very high	145 Å²	145	72.9 Å²	72.9	55%	0.547	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	-34.6	-174.3	-171.9	172.8	-179.5	144.5	-0.8	112.9	V489 E560	V489-R562 PolarHBondContact O-N 2.77Å; E560-R562 PolarHBondContact O-N 3.32Å; E560-R562 VanDerWaalsContact O-N 3.15Å
563	H	89.2	Confident	90.2	Very high	53 Å²	53	72.3 Å²	72.3	25%	0.245	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	115.1	-179.5	-59.8	-75.6	0	0	0	107.7	Y301 V489 R490 F491	Y301-H563 AromaticContact CD1-CE1 3.85Å; Y301-H563 AromaticContact CD1-NE2 3.82Å; Y301-H563 AromaticContact CE1-ND1 3.91Å; V489-H563 PolarHBondContact O-N 3.36Å; R490-H563 CarbonylContact C-O 3.52Å; R490-H563 WeakPolarHBondContact CA-O 3.15Å; R490-H563 HydrophobicContact CB-CB 4.22Å; R490-H563 HydrophobicContact CG-CB 3.99Å; F491-H563 PolarHBondContact N-O 3.32Å
564	V	93.8	Very high	90.1	Very high	13 Å²	13	73.6 Å²	73.6	8%	0.079	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	137.3	173.9	-177	0	0	0	0	106.4	F491 E551 L554 K555 V561 L566	F491-V564 HydrophobicContact CD1-CG1 4.22Å; F491-V564 CarbonylContact O-C 3.41Å; F491-V564 VanDerWaalsContact O-CA 3.3Å; F491-V564 WeakPolarHBondContact O-CA 3.39Å; E551-V564 HydrophobicContact CB-CB 4.4Å; E551-V564 HydrophobicContact CB-CG1 4.2Å; E551-V564 HydrophobicContact CG-CB 4.25Å; E551-V564 HydrophobicContact CG-CG1 3.78Å; L554-V564 HydrophobicContact CB-CG2 4.3Å; L554-V564 HydrophobicContact CD1-CG1 3.78Å; K555-V564 HydrophobicContact CD-CG2 4.34Å; K555-V564 HydrophobicContact CG-CG2 3.79Å; V561-V564 HydrophobicContact CG1-CG2 3.52Å; V564-L566 HydrophobicContact CG1-CD1 4.49Å; V564-L566 HydrophobicContact CG1-CD2 4.11Å; V564-L566 HydrophobicContact CG1-CG 3.91Å
565	D	94.1	Very high	89.9	Confident	57 Å²	57	78.5 Å²	78.5	31%	0.305	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	98	-179.2	-155.5	-5.4	0	0	0	107	R490 F491 K492 A493	R490-D565 IonicContact NH2-OD2 3.87Å; F491-D565 PolarHBondContact O-N 2.86Å; K492-D565 VanDerWaalsContact CA-O 3.25Å; K492-D565 WeakPolarHBondContact CA-O 3.46Å; K492-D565 HydrophobicContact CB-CB 4.25Å; K492-D565 HydrophobicContact CG-CB 4.44Å; A493-D565 PolarHBondContact N-O 2.88Å
566	L	95.1	Very high	89.9	Confident	11 Å²	11	78.9 Å²	78.9	6%	0.058	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	112.3	178.8	-61.2	-178.4	0	0	0	109.1	L467 F491 A493 V495 V547 L550 E551 L554 V564	L467-L566 HydrophobicContact CD1-CD2 4.01Å; L467-L566 HydrophobicContact CD2-CD1 4.2Å; F491-L566 HydrophobicContact CD1-CD2 4.42Å; F491-L566 HydrophobicContact CE1-CD2 4.04Å; A493-L566 HydrophobicContact CB-CD2 4.02Å; A493-L566 WeakPolarHBondContact O-CA 3.48Å; V495-L566 HydrophobicContact CG2-CB 4.42Å; V495-L566 HydrophobicContact CG2-CD2 4.14Å; V547-L566 HydrophobicContact CG1-CB 4Å; L550-L566 HydrophobicContact CB-CD1 3.7Å; E551-L566 HydrophobicContact CG-CB 4.45Å; E551-L566 HydrophobicContact CG-CD1 3.86Å; E551-L566 HydrophobicContact CG-CG 3.96Å; E551-L566 PolarHBondContact OE1-N 2.91Å; L554-L566 HydrophobicContact CD1-CD1 4.4Å; L554-L566 HydrophobicContact CD1-CD2 4.38Å; V564-L566 HydrophobicContact CG1-CD1 4.49Å; V564-L566 HydrophobicContact CG1-CD2 4.11Å; V564-L566 HydrophobicContact CG1-CG 3.91Å
567	E	94	Very high	89.8	Confident	70 Å²	70	70.9 Å²	70.9	33%	0.327	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	136.4	179.5	-68.4	179.2	-173.8	0	0	109.7	K492 A493 E494 V495	K492-E567 VanDerWaalsContact CE-CD 3.5Å; K492-E567 WeakPolarHBondContact CE-OE1 3.26Å; K492-E567 WeakPolarHBondContact CE-OE2 3.38Å; K492-E567 IonicContact NZ-OE1 2.95Å; K492-E567 PolarHBondContact NZ-OE1 3.2Å; K492-E567 IonicContact NZ-OE2 3.01Å; K492-E567 PolarHBondContact NZ-OE2 3.04Å; A493-E567 PolarHBondContact O-N 2.82Å; E494-E567 CarbonylContact C-O 2.98Å; E494-E567 WeakPolarHBondContact CA-O 3.49Å; E494-E567 HydrophobicContact CG-CB 4.32Å; V495-E567 PolarHBondContact N-O 3.23Å
568	I	92.1	Very high	89.9	Confident	89 Å²	89	63.8 Å²	63.8	46%	0.456	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	135.3	176.2	-58.8	155.6	0	0	0	108.5	F497 L543 V547	F497-I568 HydrophobicContact CD2-CG1 4.08Å; F497-I568 HydrophobicContact CD2-CG2 4.31Å; F497-I568 HydrophobicContact CE2-CG1 3.86Å; L543-I568 HydrophobicContact CD2-CD1 3.69Å; L543-I568 HydrophobicContact CD2-CG1 4.37Å; L543-I568 HydrophobicContact CD2-CG2 4.17Å; L543-I568 HydrophobicContact CG-CD1 3.81Å; L543-I568 HydrophobicContact CG-CG1 4.48Å; V547-I568 HydrophobicContact CG2-CD1 4.07Å; V547-I568 HydrophobicContact CG2-CG1 3.99Å
569	L	83.3	Confident	89.9	Confident	127 Å²	127	67.1 Å²	67.1	67%	0.665	34%	0.335	S	S	*	.			trans	-76.1	0	178.1	-79.8	166.8	0	0	0	115.5	H477 E494 V495 D496	H477-L569 HydrophobicContact CB-CD1 4.01Å; H477-L569 WeakPolarHBondContact CD2-CD1 3.47Å; E494-L569 HydrophobicContact CB-CD1 4.22Å; E494-L569 HydrophobicContact CB-CD2 3.82Å; E494-L569 HydrophobicContact CB-CG 3.88Å; E494-L569 HydrophobicContact CG-CD2 4.37Å; E494-L569 WeakPolarHBondContact OE2-CD2 3.43Å; V495-L569 PolarHBondContact O-N 3.23Å; D496-L569 HydrophobicContact CB-CD1 4.07Å

Retrieved 569 of 569 residues in 1285.1 ms (Link to these results)

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