G4VSY1_SCHMA Loading...

Putative p30 dbc protein

AlphaFold DB , UniProt , Accession G4VSY1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 880 aa.

						>G4VSY1_SCHMA|G4VSY1
MANRWGRNAPYGGAGGGGSGYMGSGVVGVGFYMGGPTPNDRRPYNAAPVAKPFYGGYREDNYNRRSDRRDDFRGGKRGQPKGRSPEKRYHDTPPSQRKDHRAFGKRQSSFSRYEVKIPKGLFNVSSSSLPDLRHRYPHLNISGDFYECTSLWVESFPMHEPFQLGSGTDYHVFHRDVDPPTPLDSALLNPPDADYSYSARVMLMACPQLGELYKNTCRMADDANGAGKVLPDKSIHFLVGGRAKSETMALGGPWSPSLDGPDPQGNPMTLIKTAIRTFKGLTGLDLSSCTEWVRFMELKYYRMPDTKAPAFTEAEEEREITSERPEVVVFFIPNAAHLIPSEEQWAKTKEYYNSILQKQLTVEKVEDESMVEQQDGDMSVADVSVEEPEESIARSDIEPTHYSKLDVNTLKVSDLRNELAARKLDTKGLKVNLVARLQSALDEEKKADAPEDIKIDEEIKAEQTPNKISSPSATQPKDDSKDLSEKDRRRLERLYRLGDKPAIVIHPNKSAKGGRFDCHRVSLFSLLDYHTEDQKEHNFEVSLFAEQFHEMLQRDAAFTIFKAIHDAPEKEIKPEQDGKLENGFDSDEPDSKRRRNDSQNGHCDEQDEIKVRRLRRTVNPALLFAFTYFDMSRAGYIREHDLCEILHLLGLRYSRTQMRKLVARVATRRDHVSYHNLTDSDIVEGDEKDVVSMNLNVKEDVEVTRMLALGNRALFDMTVPQAPARIVLGGGNTEQMLKRVELAEAVKQKLEFQFFQIKDELEKTRVKVNSFKDTEDELRAENRDLASRLKSEQKQLHEYKSQANTYNHLLRSARDQMDKALFDINKQFDKEKAKREAEKAAADAEKAKAEEEANKLKEKDDKVEDCEKSEEKEWEVVDAV
					

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	35	Very low	41.5	Very low	243 Å²	243	175.8 Å²	175.8	100%	1.197	89%	0.89	S	S	*	*				0	89.6	0	-58.8	144.8	-174.7	0	0	106.5
2	A	37.7	Very low	41.4	Very low	90 Å²	90	167.6 Å²	167.6	74%	0.744	88%	0.882	S	S	*	*			cis	74.1	91.7	28.1	0	0	0	0	0	114.3
3	N	48	Very low	41.4	Very low	156 Å²	156	161 Å²	161	83%	0.834	88%	0.879	S	S	*	*				-157.3	158.7	113.6	-101	-22.1	0	0	0	111.8
4	R	36.7	Very low	41.2	Very low	240 Å²	240	157.6 Å²	157.6	91%	0.906	88%	0.883	S	S	*	*			trans	-148.7	107.7	-168.1	-174.9	-161.6	-156.6	-157.5	10.4	110.6
5	W	47	Very low	41.2	Very low	241 Å²	241	152.5 Å²	152.5	91%	0.913	88%	0.88	S	S	*	*			trans	-126.3	147.9	170.5	-63.9	62.9	0	0	0	107.1
6	G	42.1	Very low	41.1	Very low	73 Å²	73	148.1 Å²	148.1	75%	0.753	88%	0.878	S	S	*	*			cis	162.4	110.4	-3.1	0	0	0	0	0	107
7	R	37.1	Very low	41	Very low	249 Å²	249	144.6 Å²	144.6	94%	0.94	88%	0.881	S	S	*	*			trans	-72.8	147.5	-178	-69	-173.1	-179.8	-158.5	1.1	110.4
8	N	41.1	Very low	40.9	Very low	167 Å²	167	141.2 Å²	141.2	89%	0.893	88%	0.879	S	S	*	*			trans	-152.6	139.8	135.6	-107.7	-17.2	0	0	0	111.8
9	A	41.7	Very low	40.7	Very low	93 Å²	93	140.8 Å²	140.8	77%	0.769	88%	0.882	S	S	*	*			trans	-165.4	130.2	170.3	0	0	0	0	0	107.8
10	P	50.2	Low	40.7	Very low	135 Å²	135	137.3 Å²	137.3	88%	0.877	87%	0.874	S	S	*	*			trans	-102.2	163	173.6	33.6	-25.2	0	0	0	113.3
11	Y	39.7	Very low	40.6	Very low	247 Å²	247	140.3 Å²	140.3	97%	0.969	87%	0.87	S	S	*	*			trans	-95.1	159.3	-175.8	-120.8	-115.5	0	0	0	112.3
12	G	40.8	Very low	40.9	Very low	77 Å²	77	137.1 Å²	137.1	79%	0.794	85%	0.854	S	S	*	*			trans	156.9	134.7	163	0	0	0	0	0	111.6
13	G	40.9	Very low	41	Very low	82 Å²	82	136.7 Å²	136.7	85%	0.845	86%	0.859	S	S	*	*			cis	-165.6	162.9	-7.4	0	0	0	0	0	109
14	A	38.8	Very low	40.6	Very low	113 Å²	113	135.4 Å²	135.4	93%	0.934	86%	0.862	S	S	*	*			trans	-118.6	136.9	-170.7	0	0	0	0	0	114
15	G	41.2	Very low	40.8	Very low	81 Å²	81	127.1 Å²	127.1	84%	0.835	85%	0.851	S	S	*	*			trans	161.5	153.8	172.9	0	0	0	0	0	111.4
16	G	39.8	Very low	40.5	Very low	82 Å²	82	121.8 Å²	121.8	85%	0.845	85%	0.845	S	S	*	*			cis	165.7	82.8	-7.4	0	0	0	0	0	115.4
17	G	39	Very low	40.4	Very low	90 Å²	90	125 Å²	125	93%	0.928	85%	0.85	S	S	*	*			trans	83.2	162.9	162.6	0	0	0	0	0	117.6
18	G	39.8	Very low	40.6	Very low	83 Å²	83	116 Å²	116	86%	0.856	84%	0.835	S	S	*	*			trans	138.5	118.9	175	0	0	0	0	0	113.8
19	S	37.2	Very low	40.6	Very low	133 Å²	133	114.8 Å²	114.8	93%	0.93	83%	0.833	S	S	*	*			trans	-141.7	137.5	172.7	178.5	0	0	0	0	109.3
20	G	39.6	Very low	40.5	Very low	70 Å²	70	113.4 Å²	113.4	72%	0.722	83%	0.827	S	S	*	*			trans	-174.7	86.4	-171.8	0	0	0	0	0	117
21	Y	39.5	Very low	39.9	Very low	202 Å²	202	114.8 Å²	114.8	79%	0.792	82%	0.82	S	S	*	*			trans	33.5	116.5	140.6	-86.9	-102.4	0	0	0	123.4
22	M	41.2	Very low	40	Very low	175 Å²	175	111.6 Å²	111.6	86%	0.862	81%	0.807	S	S	*	*				57.7	131.1	126.8	-63.8	-171.1	177.9	0	0	123.8
23	G	39.5	Very low	40.1	Very low	81 Å²	81	116.1 Å²	116.1	84%	0.835	81%	0.81	S	S	*	*			trans	-158.2	158	157.6	0	0	0	0	0	109.9
24	S	40.8	Very low	40.1	Very low	129 Å²	129	115.7 Å²	115.7	90%	0.902	81%	0.806	S	S	*	*			trans	-148.5	153.4	-164.7	-171.1	0	0	0	0	116.7
25	G	40.8	Very low	40	Very low	66 Å²	66	114 Å²	114	68%	0.68	80%	0.799	S	S	*	*			trans	157.7	121.7	171.9	0	0	0	0	0	110.7
26	V	40.7	Very low	40.1	Very low	130 Å²	130	116.3 Å²	116.3	79%	0.788	80%	0.799	S	S	*	*			cis	78.1	122	25.9	-171.5	0	0	0	0	112.2
27	V	40.2	Very low	40	Very low	140 Å²	140	118.6 Å²	118.6	85%	0.848	80%	0.797	S	S	*	*			cis	-131.5	178.2	9.7	-107.3	0	0	0	0	110.4
28	G	40.1	Very low	40.4	Very low	61 Å²	61	119.3 Å²	119.3	63%	0.629	79%	0.786	S	S	*	*			cis	139.3	157.6	-3.3	0	0	0	0	0	114.8
29	V	41.1	Very low	40.4	Very low	141 Å²	141	121.6 Å²	121.6	86%	0.855	78%	0.778	S	S	*	*			trans	75	135.3	174.1	-166	0	0	0	0	116.9	F31	V29-F31 HydrophobicContact CG1-CD2 4.17Å; V29-F31 HydrophobicContact CG1-CE2 4.21Å
30	G	39.6	Very low	40.6	Very low	63 Å²	63	121.4 Å²	121.4	65%	0.649	77%	0.767	S	S	*	*			cis	161.3	169.2	-11.5	0	0	0	0	0	115.5
31	F	38.2	Very low	40.7	Very low	165 Å²	165	130.1 Å²	130.1	72%	0.724	78%	0.778	S	S	*	*			trans	73.4	156.8	161.2	-62.1	-69.7	0	0	0	120	V29	V29-F31 HydrophobicContact CG1-CD2 4.17Å; V29-F31 HydrophobicContact CG1-CE2 4.21Å
32	Y	41.2	Very low	40.6	Very low	179 Å²	179	131.8 Å²	131.8	70%	0.702	78%	0.783	S	S	*	*			cis	-157.3	155.9	1.2	-124.5	-46.7	0	0	0	113.2
33	M	43.7	Very low	40.9	Very low	172 Å²	172	128.4 Å²	128.4	85%	0.847	77%	0.774	S	S	*	*			trans	66.8	150.3	163.2	-55.2	-59.8	-168.3	0	0	119.2
34	G	39.3	Very low	41.2	Very low	73 Å²	73	135.7 Å²	135.7	75%	0.753	78%	0.778	S	S	*	*			cis	-179.2	149.2	-7.2	0	0	0	0	0	112.7
35	G	38.1	Very low	41.1	Very low	78 Å²	78	137.3 Å²	137.3	80%	0.804	78%	0.776	S	S	*	*			trans	-89.3	-152.9	-175.7	0	0	0	0	0	115.7
36	P	42.6	Very low	41.3	Very low	129 Å²	129	138.9 Å²	138.9	84%	0.838	78%	0.783	S	S	*	*			cis	-141.3	-166.5	17.8	44.8	-25.4	0	0	0	116.9
37	T	38.3	Very low	41.5	Very low	131 Å²	131	137.1 Å²	137.1	80%	0.804	78%	0.782	S	S	*	*			trans	-129.7	-171.9	166.5	63.6	0	0	0	0	108.6
38	P	48.1	Very low	41.5	Very low	105 Å²	105	136.4 Å²	136.4	68%	0.682	78%	0.78	S	S	*	*			cis	-138.5	-160.6	-3.4	41.4	-20.3	0	0	0	115.5
39	N	39.4	Very low	41.6	Very low	131 Å²	131	140 Å²	140	70%	0.701	79%	0.79	S	S	*	*			trans	105.8	132.7	150.1	-90.9	46.5	0	0	0	124
40	D	40.2	Very low	41.5	Very low	128 Å²	128	137.6 Å²	137.6	68%	0.684	79%	0.785	S	S	*	*			trans	57.2	102.8	150.1	-61.3	-43.5	0	0	0	123.5
41	R	41.6	Very low	41.4	Very low	253 Å²	253	143.7 Å²	143.7	96%	0.955	79%	0.793	S	S	*	*				-169.1	152.3	101.7	-96.9	159.2	-170.4	-167.3	3	113.6
42	R	38.9	Very low	41.5	Very low	238 Å²	238	140.9 Å²	140.9	90%	0.898	79%	0.792	S	S	*	*			trans	-117.6	178	178.3	-94.5	-171.8	175.3	-152.7	2.1	109.3
43	P	47.2	Very low	41.1	Very low	104 Å²	104	142.4 Å²	142.4	68%	0.675	80%	0.802	S	S	*	*			cis	-134.7	172.3	-41.5	38.5	-23.9	0	0	0	112.3
44	Y	45.5	Very low	40.9	Very low	233 Å²	233	144.2 Å²	144.2	91%	0.914	80%	0.801	S	S	*	*			trans	-153.8	155.5	149	-119.9	-82.5	0	0	0	112
45	N	38.2	Very low	40.7	Very low	163 Å²	163	143.3 Å²	143.3	87%	0.872	79%	0.792	S	S	*	*			trans	-79.8	139.7	-172.2	-78.2	-30.1	0	0	0	114.1
46	A	44.2	Very low	40.3	Very low	100 Å²	100	143.3 Å²	143.3	83%	0.826	79%	0.792	S	S	*	*			trans	-139.3	145.1	153.6	0	0	0	0	0	109.3
47	A	45.8	Very low	40.2	Very low	92 Å²	92	148.1 Å²	148.1	76%	0.76	80%	0.795	S	S	*	*			trans	-44	140.8	-160.8	0	0	0	0	0	118
48	P	41.3	Very low	40.1	Very low	126 Å²	126	151.2 Å²	151.2	82%	0.818	79%	0.792	S	S	*	*			trans	-67.9	140.6	163.3	31.2	-33.6	0	0	0	110.3	A50	P48-A50 PolarHBondContact O-N 2.83Å
49	V	41	Very low	39.5	Very low	136 Å²	136	155 Å²	155	82%	0.824	80%	0.8	S	S	*	*			trans	-55.1	126.6	-178.7	177.8	0	0	0	0	111.2	K51	V49-K51 PolarHBondContact O-N 3.04Å; V49-K51 VanDerWaalsContact O-N 3.08Å
50	A	39.1	Very low	39.4	Very low	91 Å²	91	152 Å²	152	75%	0.752	78%	0.784	S	S	*	*			trans	-64.2	109.5	171.8	0	0	0	0	0	109.5	P48	P48-A50 PolarHBondContact O-N 2.83Å
51	K	37.4	Very low	39.1	Very low	191 Å²	191	152.4 Å²	152.4	83%	0.83	79%	0.786	S	S	*	*			trans	-58.7	126.7	175.5	-62.3	177.7	-178.3	178.8	0	108.9	V49 F53	V49-K51 PolarHBondContact O-N 3.04Å; V49-K51 VanDerWaalsContact O-N 3.08Å; K51-F53 PolarHBondContact O-N 2.79Å
52	P	40.3	Very low	38.8	Very low	106 Å²	106	148.8 Å²	148.8	69%	0.688	77%	0.774	S	S	*	*			trans	-60.6	136.4	170.1	26.3	-32.9	0	0	0	109	Y54	P52-Y54 PolarHBondContact O-N 3.11Å
53	F	33.2	Very low	38.8	Very low	211 Å²	211	145.7 Å²	145.7	93%	0.925	78%	0.775	S	S	*	*			trans	-77.3	58	-170.1	-163.1	-94.7	0	0	0	112.1	K51 G55	K51-F53 PolarHBondContact O-N 2.79Å; F53-G55 PolarHBondContact O-N 2.82Å
54	Y	39.8	Very low	38.4	Very low	210 Å²	210	151.8 Å²	151.8	82%	0.824	79%	0.785	S	S	*	*			trans	-80.1	103.5	169.6	-93.3	-85.4	0	0	0	109.4	P52 G56	P52-Y54 PolarHBondContact O-N 3.11Å; Y54-G56 PolarHBondContact O-N 3.45Å; Y54-G56 VanDerWaalsContact O-N 3.15Å
55	G	35.6	Very low	37.9	Very low	54 Å²	54	151.1 Å²	151.1	56%	0.557	78%	0.781	S	S	*	*			trans	-61.3	113.7	177.5	0	0	0	0	0	110.8	F53 Y57	F53-G55 PolarHBondContact O-N 2.82Å; G55-Y57 VanDerWaalsContact C-N 3.34Å; G55-Y57 PolarHBondContact O-N 3.08Å
56	G	29.3	Very low	38	Very low	78 Å²	78	148.2 Å²	148.2	80%	0.804	77%	0.773	S	S	*	*			trans	-68.9	86.8	178.2	0	0	0	0	0	111.7	Y54 R58	Y54-G56 PolarHBondContact O-N 3.45Å; Y54-G56 VanDerWaalsContact O-N 3.15Å; G56-R58 PolarHBondContact O-N 3.22Å
57	Y	40.2	Very low	37.8	Very low	229 Å²	229	151 Å²	151	90%	0.898	77%	0.774	S	S	*	*			trans	-70.7	84.8	163.8	-86.2	-77.7	0	0	0	109.7	G55	G55-Y57 VanDerWaalsContact C-N 3.34Å; G55-Y57 PolarHBondContact O-N 3.08Å
58	R	35.7	Very low	37.5	Very low	197 Å²	197	157.1 Å²	157.1	74%	0.743	78%	0.777	S	S	*	*			trans	-24.3	127.1	161.9	179.6	179.8	176.2	145.7	1.9	113	G56 D60	G56-R58 PolarHBondContact O-N 3.22Å; R58-D60 WeakPolarHBondContact CD-OD1 3.06Å; R58-D60 WeakPolarHBondContact CD-OD2 3.5Å; R58-D60 IonicContact CZ-OD1 2.73Å; R58-D60 VanDerWaalsContact NE-CG 3.32Å; R58-D60 IonicContact NE-OD1 2.71Å; R58-D60 PolarHBondContact NE-OD1 3.47Å; R58-D60 IonicContact NE-OD2 3.51Å; R58-D60 PolarHBondContact NE-OD2 2.75Å; R58-D60 IonicContact NH2-OD1 3.41Å; R58-D60 PolarHBondContact O-N 3.07Å
59	E	34.6	Very low	37.2	Very low	183 Å²	183	161.8 Å²	161.8	86%	0.855	78%	0.779	S	S	*	*			trans	-72.4	61.3	177.5	-166.3	177.5	-151.3	0	0	111.8	N61	E59-N61 PolarHBondContact O-N 3.2Å
60	D	37.5	Very low	37.1	Very low	69 Å²	69	163 Å²	163	37%	0.369	78%	0.781	S	S	.	*			trans	-73.8	124	-179.6	-86.4	-25.9	0	0	0	111.5	R58 Y62	R58-D60 WeakPolarHBondContact CD-OD1 3.06Å; R58-D60 WeakPolarHBondContact CD-OD2 3.5Å; R58-D60 IonicContact CZ-OD1 2.73Å; R58-D60 VanDerWaalsContact NE-CG 3.32Å; R58-D60 IonicContact NE-OD1 2.71Å; R58-D60 PolarHBondContact NE-OD1 3.47Å; R58-D60 IonicContact NE-OD2 3.51Å; R58-D60 PolarHBondContact NE-OD2 2.75Å; R58-D60 IonicContact NH2-OD1 3.41Å; R58-D60 PolarHBondContact O-N 3.07Å; D60-Y62 VanDerWaalsContact C-N 3.33Å; D60-Y62 HydrophobicContact CB-CD2 3.76Å; D60-Y62 HydrophobicContact CB-CE2 3.26Å; D60-Y62 WeakPolarHBondContact O-CD2 3.26Å; D60-Y62 PolarHBondContact O-N 2.86Å
61	N	35.1	Very low	37.1	Very low	136 Å²	136	165.7 Å²	165.7	73%	0.727	78%	0.782	S	S	*	*			trans	-70.6	75.6	-176.1	-90.7	-102.3	0	0	0	113	E59	E59-N61 PolarHBondContact O-N 3.2Å
62	Y	35.8	Very low	37.2	Very low	178 Å²	178	166 Å²	166	70%	0.698	78%	0.784	S	S	*	*			trans	-88.3	-10	178.4	-70.8	-62.2	0	0	0	115.4	D60 R64	D60-Y62 VanDerWaalsContact C-N 3.33Å; D60-Y62 HydrophobicContact CB-CD2 3.76Å; D60-Y62 HydrophobicContact CB-CE2 3.26Å; D60-Y62 WeakPolarHBondContact O-CD2 3.26Å; D60-Y62 PolarHBondContact O-N 2.86Å; Y62-R64 VanDerWaalsContact C-N 3.32Å; Y62-R64 PolarHBondContact O-N 3.33Å; Y62-R64 VanDerWaalsContact O-N 3.15Å
63	N	37.4	Very low	37.2	Very low	172 Å²	172	173 Å²	173	92%	0.92	80%	0.797	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	51.6	174.6	-87.2	-36.2	0	0	0	113.9
64	R	39.5	Very low	37.3	Very low	232 Å²	232	166.3 Å²	166.3	88%	0.875	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-156.7	16.6	170.1	-118.8	176.8	-161.2	-167.2	6.7	116.2	Y62	Y62-R64 VanDerWaalsContact C-N 3.32Å; Y62-R64 PolarHBondContact O-N 3.33Å; Y62-R64 VanDerWaalsContact O-N 3.15Å
65	R	35.2	Very low	37	Very low	220 Å²	220	159.9 Å²	159.9	83%	0.83	79%	0.785	S	S	*	*	S	Bend	trans	-136.8	6.6	-169.6	-80	-171	172.2	-177.3	-1.5	118.1
66	S	39	Very low	37.4	Very low	101 Å²	101	167.6 Å²	167.6	71%	0.706	80%	0.803	S	S	*	*	S	Bend	trans	-82.7	-34.8	175.7	53	0	0	0	0	114.4	R68	S66-R68 PolarHBondContact O-N 2.64Å
67	D	40.4	Very low	38	Very low	159 Å²	159	176 Å²	176	85%	0.85	81%	0.81	S	S	*	*	S	Bend	trans	-82.9	43.2	-175.2	-68.6	-34.4	0	0	0	114.3
68	R	39.1	Very low	37.8	Very low	220 Å²	220	169 Å²	169	83%	0.83	81%	0.807	S	S	*	*	S	Bend	trans	-148.3	39.3	178.8	-71.8	-163.3	175.7	-169.2	-1.7	114.3	S66	S66-R68 PolarHBondContact O-N 2.64Å
69	R	35.6	Very low	38.1	Very low	224 Å²	224	168.7 Å²	168.7	85%	0.845	82%	0.815	S	S	*	*	S	Bend	trans	-142.7	22.3	-176.9	-130.9	178.9	-162.9	-173.4	3.9	119.4
70	D	39.2	Very low	38.6	Very low	163 Å²	163	165.3 Å²	165.3	87%	0.872	81%	0.809	S	S	*	*			trans	-121.2	8.1	171.8	-86.1	-57.5	0	0	0	115.3	F72	D70-F72 PolarHBondContact O-N 3.22Å
71	D	39.3	Very low	38.8	Very low	146 Å²	146	172.3 Å²	172.3	78%	0.781	84%	0.836	S	S	*	*			trans	-75.2	17.4	177.2	-69.9	-57.2	0	0	0	114.7	R73	D71-R73 PolarHBondContact O-N 2.86Å
72	F	39	Very low	39.2	Very low	198 Å²	198	169.4 Å²	169.4	87%	0.868	84%	0.838	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	31.6	-172.4	-96.5	-79.2	0	0	0	115.7	D70	D70-F72 PolarHBondContact O-N 3.22Å
73	R	40.8	Very low	39.4	Very low	253 Å²	253	172.2 Å²	172.2	96%	0.955	85%	0.847	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124	29.2	162.1	-91.7	-172.1	174.7	-166.1	-0.6	114.3	D71	D71-R73 PolarHBondContact O-N 2.86Å
74	G	34.9	Very low	39.9	Very low	71 Å²	71	169.1 Å²	169.1	73%	0.732	84%	0.839	S	S	*	*			trans	-98.6	96.6	175.4	0	0	0	0	0	115.3
75	G	33.9	Very low	40.2	Very low	74 Å²	74	163.1 Å²	163.1	76%	0.763	83%	0.83	S	S	*	*			trans	67.5	98.4	149.4	0	0	0	0	0	120.5
76	K	44.5	Very low	40.6	Very low	216 Å²	216	159.6 Å²	159.6	94%	0.939	82%	0.823	S	S	*	*			trans	-105.4	122	146.6	-91.3	-170.3	174.9	-179.2	0	111
77	R	40.3	Very low	40.7	Very low	255 Å²	255	163.2 Å²	163.2	96%	0.962	83%	0.826	S	S	*	*			trans	-56.2	127	-171.1	-60.9	165.8	176.6	171.6	-4.4	112.7
78	G	36.6	Very low	40.7	Very low	81 Å²	81	164.5 Å²	164.5	84%	0.835	82%	0.819	S	S	*	*			trans	-89.8	-157.6	-178.9	0	0	0	0	0	116.8
79	Q	43.2	Very low	40.7	Very low	192 Å²	192	163.1 Å²	163.1	90%	0.897	82%	0.815	S	S	*	*			trans	-152.1	143.7	161	-157.7	174.2	16.4	0	0	109.7
80	P	45.1	Very low	41.2	Very low	112 Å²	112	161.5 Å²	161.5	73%	0.727	82%	0.817	S	S	*	*			trans	-116.1	157.3	-173.7	39.7	-32.5	0	0	0	115.5
81	K	41.6	Very low	41.4	Very low	215 Å²	215	159.7 Å²	159.7	94%	0.935	81%	0.807	S	S	*	*			trans	-179.1	126.7	142.8	-106.4	163.6	-176.5	179.1	0	116.5
82	G	42.5	Very low	42	Very low	75 Å²	75	158.9 Å²	158.9	77%	0.773	81%	0.808	S	S	*	*			trans	76.4	150.6	151.1	0	0	0	0	0	118.2
83	R	40	Very low	42.6	Very low	237 Å²	237	154.9 Å²	154.9	89%	0.894	80%	0.802	S	S	*	*			cis	-146.9	128.1	-9.6	-92.8	173.5	163.3	169.1	-7.5	105.7
84	S	47.9	Very low	42.7	Very low	107 Å²	107	149 Å²	149	75%	0.748	80%	0.796	S	S	*	*				70.5	146.6	78.4	-53.8	0	0	0	0	115.3
85	P	46.9	Very low	43.3	Very low	106 Å²	106	151.2 Å²	151.2	69%	0.688	80%	0.8	S	S	*	*			cis	-147.6	172.4	-32.3	41.3	-23.2	0	0	0	117.2
86	E	43.4	Very low	43.6	Very low	146 Å²	146	156.3 Å²	156.3	68%	0.682	80%	0.804	S	S	*	*			trans	53	127.3	144.3	-77.1	-180	78.9	0	0	125.3
87	K	41.4	Very low	43.5	Very low	178 Å²	178	156.9 Å²	156.9	77%	0.774	80%	0.801	S	S	*	*				167.1	152.8	109.9	-88.2	167.2	-175.5	175.6	0	110.9
88	R	39.6	Very low	43.4	Very low	185 Å²	185	152.9 Å²	152.9	70%	0.698	79%	0.79	S	S	*	*			cis	-161.7	149.5	-26.7	-109.2	-177.7	-165.5	-175.6	1.8	108.9
89	Y	40	Very low	43.5	Very low	192 Å²	192	155.2 Å²	155.2	75%	0.753	78%	0.784	S	S	*	*			trans	7.1	135.7	162.6	-64.7	-98	0	0	0	122.2
90	H	45.5	Very low	43.5	Very low	190 Å²	190	153.6 Å²	153.6	88%	0.88	78%	0.776	S	S	*	*				-144.8	131.2	127.2	-144	-64.1	0	0	0	109.9
91	D	42	Very low	43.4	Very low	124 Å²	124	158.6 Å²	158.6	66%	0.663	78%	0.78	S	S	*	*			trans	-85	145	-173.5	-67	-80	0	0	0	113.6
92	T	52.8	Low	43.4	Very low	130 Å²	130	152.7 Å²	152.7	80%	0.798	77%	0.772	S	S	*	*			trans	-155.6	128.7	161.7	-55.7	0	0	0	0	108.6
93	P	51.7	Low	43.1	Very low	114 Å²	114	159.8 Å²	159.8	74%	0.74	78%	0.781	S	S	*	*			trans	-73.7	148.6	-170.5	28.6	-35.4	0	0	0	113.4	S95	P93-S95 PolarHBondContact O-N 3.39Å; P93-S95 VanDerWaalsContact O-N 3.16Å
94	P	43.9	Very low	43.1	Very low	128 Å²	128	151.4 Å²	151.4	83%	0.831	77%	0.769	S	S	*	*			trans	-73.2	107.7	-178.3	29.2	-34.3	0	0	0	111.8
95	S	45.7	Very low	42.8	Very low	118 Å²	118	156.1 Å²	156.1	83%	0.825	78%	0.776	S	S	*	*			trans	-64	138.4	173.4	-172.8	0	0	0	0	111.7	P93 R97	P93-S95 PolarHBondContact O-N 3.39Å; P93-S95 VanDerWaalsContact O-N 3.16Å; S95-R97 PolarHBondContact O-N 3.49Å; S95-R97 VanDerWaalsContact O-N 3.15Å
96	Q	40.5	Very low	42.4	Very low	181 Å²	181	162.8 Å²	162.8	85%	0.846	79%	0.787	S	S	*	*			trans	-69.2	107.6	-166.8	-62.9	177.1	4	0	0	112.6	K98	Q96-K98 PolarHBondContact O-N 2.84Å
97	R	42.5	Very low	42.1	Very low	229 Å²	229	164.6 Å²	164.6	86%	0.864	80%	0.796	S	S	*	*			trans	-75.9	117	162.8	-73.4	-171.4	172.4	-168.1	-2.4	109.4	S95 D99	S95-R97 PolarHBondContact O-N 3.49Å; S95-R97 VanDerWaalsContact O-N 3.15Å; R97-D99 VanDerWaalsContact C-N 3.34Å; R97-D99 PolarHBondContact O-N 3.32Å
98	K	38.6	Very low	41.9	Very low	171 Å²	171	160.6 Å²	160.6	74%	0.743	79%	0.79	S	S	*	*			trans	-70.9	83.8	174.7	-87.1	180	168.7	174.4	0	111.1	Q96 H100	Q96-K98 PolarHBondContact O-N 2.84Å; K98-H100 PolarHBondContact O-N 3.08Å
99	D	39.3	Very low	42.3	Very low	130 Å²	130	157.4 Å²	157.4	70%	0.695	80%	0.796	S	S	*	*			trans	-73.2	68.7	170.2	-86.9	-50.8	0	0	0	111.9	R97 R101	R97-D99 VanDerWaalsContact C-N 3.34Å; R97-D99 PolarHBondContact O-N 3.32Å; D99-R101 PolarHBondContact O-N 2.77Å
100	H	42.3	Very low	42.5	Very low	158 Å²	158	156.7 Å²	156.7	73%	0.731	80%	0.798	S	S	*	*			trans	-75.9	46.2	167.9	-69.7	-49.1	0	0	0	112.2	K98 A102	K98-H100 PolarHBondContact O-N 3.08Å; H100-A102 VanDerWaalsContact C-N 3.27Å; H100-A102 PolarHBondContact O-N 2.75Å
101	R	42.7	Very low	43.1	Very low	216 Å²	216	151 Å²	151	82%	0.815	78%	0.779	S	S	*	*			trans	-79.1	79.9	164.6	-74.5	-172.2	175.1	-170	0.2	109.1	D99 F103	D99-R101 PolarHBondContact O-N 2.77Å; R101-F103 PolarHBondContact O-N 3.27Å
102	A	42.6	Very low	44.7	Very low	92 Å²	92	155 Å²	155	76%	0.76	78%	0.784	S	S	*	*			trans	-56.2	134.2	171.9	0	0	0	0	0	110.4	H100 G104	H100-A102 VanDerWaalsContact C-N 3.27Å; H100-A102 PolarHBondContact O-N 2.75Å; A102-G104 PolarHBondContact O-N 3.35Å
103	F	36.3	Very low	46.5	Very low	223 Å²	223	150.8 Å²	150.8	98%	0.978	75%	0.754	S	S	*	*			trans	-71.4	63.2	174.8	-95	-104.1	0	0	0	111.6	R101	R101-F103 PolarHBondContact O-N 3.27Å
104	G	39.1	Very low	48.3	Very low	61 Å²	61	150.5 Å²	150.5	63%	0.629	74%	0.743	S	S	*	*			trans	-83	123.7	164.6	0	0	0	0	0	109.5	A102 R106	A102-G104 PolarHBondContact O-N 3.35Å; G104-R106 PolarHBondContact O-N 2.86Å
105	K	42.9	Very low	50.6	Low	207 Å²	207	145.8 Å²	145.8	90%	0.9	71%	0.712	S	S	*	*			trans	-57.3	112.5	170	-69.1	-180	179.7	178.3	0	108.5	Q107	K105-Q107 PolarHBondContact O-N 3.44Å
106	R	36.9	Very low	52.8	Low	246 Å²	246	144.2 Å²	144.2	93%	0.928	69%	0.69	S	S	*	*			trans	-62.3	110.9	163.5	-76.2	-174.4	171.6	-164.3	-4.5	107.1	G104 S108	G104-R106 PolarHBondContact O-N 2.86Å; R106-S108 PolarHBondContact O-N 2.86Å
107	Q	38.6	Very low	55.3	Low	183 Å²	183	138.3 Å²	138.3	86%	0.855	66%	0.664	S	S	*	*			trans	-60.3	126.1	162.6	-73.8	176.7	-84.8	0	0	107	K105 S109	K105-Q107 PolarHBondContact O-N 3.44Å; Q107-S109 PolarHBondContact O-N 3.35Å
108	S	37.3	Very low	57.5	Low	94 Å²	94	128.2 Å²	128.2	66%	0.657	63%	0.628	S	S	*	*			trans	-64.3	117.1	173.3	-167.6	0	0	0	0	107.7	R106 F110	R106-S108 PolarHBondContact O-N 2.86Å; S108-F110 PolarHBondContact O-N 3.23Å; S108-F110 WeakPolarHBondContact OG-CD2 3.39Å
109	S	46.9	Very low	59.7	Low	119 Å²	119	126.3 Å²	126.3	83%	0.832	62%	0.62	S	S	*	*			trans	-81	19.9	-166.8	58.3	0	0	0	0	114.2	Q107 S111	Q107-S109 PolarHBondContact O-N 3.35Å; S109-S111 PolarHBondContact O-N 2.82Å
110	F	44	Very low	62	Low	177 Å²	177	120.8 Å²	120.8	78%	0.776	59%	0.594	S	S	*	*			trans	-83.3	104.1	168.6	-61.1	-69.9	0	0	0	108.6	S108 R112	S108-F110 PolarHBondContact O-N 3.23Å; S108-F110 WeakPolarHBondContact OG-CD2 3.39Å; F110-R112 PolarHBondContact O-N 2.75Å
111	S	59.1	Low	64.4	Low	69 Å²	69	117.6 Å²	117.6	48%	0.483	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-49.8	132.6	158.4	-81.7	0	0	0	0	108.3	S109 Y113 S632	S109-S111 PolarHBondContact O-N 2.82Å; S111-Y113 PolarHBondContact O-N 2.92Å; S111-S632 VanDerWaalsContact CB-O 3.28Å; S111-S632 WeakPolarHBondContact CB-O 3.49Å; S111-S632 PolarHBondContact OG-O 3.29Å
112	R	75.1	Confident	66.8	Low	208 Å²	208	107.3 Å²	107.3	79%	0.785	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-64.5	127.9	167.2	-67.4	-173.3	-62.2	-174.3	1.9	107	F110 E114 S632	F110-R112 PolarHBondContact O-N 2.75Å; R112-E114 PolarHBondContact O-N 3.3Å; R112-S632 WeakPolarHBondContact O-CB 3.47Å
113	Y	90	Very high	68.8	Low	42 Å²	42	105.3 Å²	105.3	17%	0.165	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-56.3	119.2	175.5	176.1	-87.5	0	0	0	109.9	S111 V115 A634 Y636 R638 D641	S111-Y113 PolarHBondContact O-N 2.92Å; Y113-V115 HydrophobicContact CE1-CB 4.21Å; Y113-V115 HydrophobicContact CE1-CG2 3.9Å; Y113-V115 HydrophobicContact CE2-CG2 3.8Å; Y113-V115 VanDerWaalsContact CZ-CG2 3.44Å; Y113-A634 HydrophobicContact CD2-CB 4.29Å; Y113-Y636 HydrophobicContact CD2-CD2 4.11Å; Y113-Y636 AromaticContact CD2-CE2 3.38Å; Y113-Y636 HydrophobicContact CD2-CE2 3.38Å; Y113-Y636 AromaticContact CD2-CZ 3.71Å; Y113-Y636 AromaticContact CE2-CD2 3.87Å; Y113-Y636 HydrophobicContact CE2-CD2 3.87Å; Y113-Y636 AromaticContact CE2-CE2 3.53Å; Y113-Y636 HydrophobicContact CE2-CE2 3.53Å; Y113-Y636 HydrophobicContact CG-CE2 4.45Å; Y113-R638 HydrophobicContact CE1-CG 4.19Å; Y113-R638 HydrophobicContact CE2-CG 4Å; Y113-R638 WeakPolarHBondContact OH-CG 3.33Å; Y113-R638 PolarHBondContact OH-N 2.94Å; Y113-D641 VanDerWaalsContact CE1-OD2 3.23Å; Y113-D641 WeakPolarHBondContact CE1-OD2 3.27Å; Y113-D641 VanDerWaalsContact CZ-OD2 3.3Å; Y113-D641 PolarHBondContact OH-OD2 3.13Å
114	E	91	Very high	71.4	Confident	108 Å²	108	96.5 Å²	96.5	51%	0.505	48%	0.484	S	S	.	.			trans	-143.3	109.1	-175	-163.2	171.8	154.1	0	0	107.8	R112 M631 S632	R112-E114 PolarHBondContact O-N 3.3Å; E114-M631 HydrophobicContact CG-CB 4.48Å; E114-M631 WeakPolarHBondContact O-CB 3.38Å; E114-M631 PolarHBondContact O-N 3Å; E114-M631 VanDerWaalsContact O-N 3.16Å; E114-S632 PolarHBondContact N-OG 3.48Å; E114-S632 PolarHBondContact O-N 3.41Å; E114-S632 VanDerWaalsContact O-N 3.1Å; E114-S632 PolarHBondContact O-OG 2.58Å
115	V	92	Very high	73.9	Confident	29 Å²	29	96.7 Å²	96.7	18%	0.176	48%	0.476	C	S	.	.			trans	-122.5	126.7	-178.8	168.5	0	0	0	0	109.1	Y113 I117 F629 I637 I645	Y113-V115 HydrophobicContact CE1-CB 4.21Å; Y113-V115 HydrophobicContact CE1-CG2 3.9Å; Y113-V115 HydrophobicContact CE2-CG2 3.8Å; Y113-V115 VanDerWaalsContact CZ-CG2 3.44Å; V115-I117 HydrophobicContact CG1-CG1 4.22Å; V115-I117 PolarHBondContact O-N 2.78Å; V115-F629 WeakPolarHBondContact CA-O 3.42Å; V115-F629 HydrophobicContact CG1-CB 4.31Å; V115-I637 HydrophobicContact CG1-CG2 4.38Å; V115-I637 HydrophobicContact CG2-CG1 4.43Å; V115-I637 HydrophobicContact CG2-CG2 4.41Å; V115-I645 HydrophobicContact CG1-CD1 4.04Å
116	K	90.7	Very high	76.3	Confident	86 Å²	86	89.3 Å²	89.3	37%	0.374	45%	0.45	S	S	.	.			trans	-88.8	103.6	178.6	-174.5	-176.1	177.6	-170.4	0	109	H549 F629 M631	K116-H549 PolarHBondContact NZ-NE2 2.79Å; K116-F629 PolarHBondContact N-O 3.46Å; K116-M631 HydrophobicContact CB-CG 3.81Å; K116-M631 HydrophobicContact CB-SD 4.28Å; K116-M631 HydrophobicContact CD-SD 4.5Å
117	I	92.7	Very high	79	Confident	56 Å²	56	77.6 Å²	77.6	29%	0.287	41%	0.406	S	S	.	.			trans	-90.8	123.6	172.2	-50.8	178.9	0	0	0	108.4	V115 D641 E644 I645 L648	V115-I117 HydrophobicContact CG1-CG1 4.22Å; V115-I117 PolarHBondContact O-N 2.78Å; I117-D641 HydrophobicContact CD1-CB 3.88Å; I117-E644 HydrophobicContact CD1-CB 4.42Å; I117-E644 HydrophobicContact CG2-CB 4.4Å; I117-I645 HydrophobicContact CG1-CD1 4.46Å; I117-I645 HydrophobicContact CG1-CG1 4.25Å; I117-I645 HydrophobicContact CG2-CG1 4.15Å; I117-L648 HydrophobicContact CG2-CD1 4.38Å
118	P	90.5	Very high	81.7	Confident	17 Å²	17	71 Å²	71	11%	0.11	38%	0.38	C	S	.	.			trans	-66.2	156.8	175.5	-21.5	34.8	0	0	0	112.6	F122 F629 L648	P118-F122 HydrophobicContact CB-CE1 4.09Å; P118-F122 HydrophobicContact CB-CZ 4.47Å; P118-F122 HydrophobicContact CG-CE1 3.84Å; P118-F122 HydrophobicContact CG-CZ 3.95Å; P118-F629 HydrophobicContact CG-CE1 4.49Å; P118-L648 HydrophobicContact CB-CD1 3.79Å; P118-L648 HydrophobicContact CG-CD1 4.08Å; P118-L648 WeakPolarHBondContact O-CD1 3.48Å
119	K	84.8	Confident	84.4	Confident	131 Å²	131	68.5 Å²	68.5	57%	0.57	36%	0.359	S	S	*	.	S	Bend	trans	-94	-7.2	-169.2	-66.5	177.6	-177.8	169.7	0	115
120	G	87.5	Confident	86.6	Confident	15 Å²	15	67 Å²	67	16%	0.155	35%	0.346	C	S	.	.	S	Bend	trans	-138.4	173.7	-175.2	0	0	0	0	0	112.9
121	L	92.8	Very high	88.9	Confident	90 Å²	90	61.8 Å²	61.8	47%	0.471	33%	0.326	S	S	.	.			trans	-70.6	139.1	167.3	-61.4	178.3	0	0	0	109.2	V124 L648	L121-V124 HydrophobicContact CB-CG2 4.04Å; L121-V124 WeakPolarHBondContact O-CG2 3.33Å; L121-L648 WeakPolarHBondContact CA-O 3.46Å
122	F	91.7	Very high	90.5	Very high	1 Å²	1	58.5 Å²	58.5	0%	0.004	30%	0.303	C	S	.	.	S	Bend	trans	-70.3	-37.5	-179.9	-60.8	-63.2	0	0	0	113.4	P118 V124 W152 E550 Q553 R554 A557 L648 L649	P118-F122 HydrophobicContact CB-CE1 4.09Å; P118-F122 HydrophobicContact CB-CZ 4.47Å; P118-F122 HydrophobicContact CG-CE1 3.84Å; P118-F122 HydrophobicContact CG-CZ 3.95Å; F122-V124 VanDerWaalsContact C-N 3.33Å; F122-V124 PolarHBondContact O-N 2.66Å; F122-V124 VanDerWaalsContact O-N 3.08Å; F122-W152 WeakPolarHBondContact O-CH2 3.43Å; F122-E550 HydrophobicContact CD1-CB 4.29Å; F122-E550 WeakPolarHBondContact CD1-O 3.24Å; F122-Q553 HydrophobicContact CD1-CB 4.39Å; F122-Q553 HydrophobicContact CE1-CB 3.53Å; F122-Q553 HydrophobicContact CZ-CB 3.86Å; F122-R554 HydrophobicContact CB-CB 3.68Å; F122-R554 HydrophobicContact CB-CG 3.75Å; F122-R554 HydrophobicContact CD1-CB 4.19Å; F122-R554 HydrophobicContact CD2-CB 3.89Å; F122-R554 HydrophobicContact CD2-CG 4.07Å; F122-R554 HydrophobicContact CG-CB 3.68Å; F122-R554 HydrophobicContact CG-CG 4.08Å; F122-A557 HydrophobicContact CE2-CB 4.01Å; F122-L648 HydrophobicContact CD2-CB 3.84Å; F122-L648 WeakPolarHBondContact CD2-O 3.36Å; F122-L648 HydrophobicContact CE2-CB 3.59Å; F122-L648 HydrophobicContact CE2-CD1 4.48Å; F122-L648 HydrophobicContact CZ-CB 4.15Å; F122-L648 HydrophobicContact CZ-CD1 4.24Å; F122-L648 PolarHBondContact N-O 2.77Å; F122-L649 HydrophobicContact CD2-CD2 4.19Å; F122-L649 HydrophobicContact CE2-CD2 4.44Å
123	N	85.4	Confident	91.3	Very high	49 Å²	49	56 Å²	56	26%	0.262	29%	0.294	S	S	.	.			trans	-89.4	61.2	-170.8	-67.9	-55.3	0	0	0	112	V153 M158 R554 L649	N123-V153 HydrophobicContact CB-CG1 4.24Å; N123-M158 PolarHBondContact ND2-SD 2.83Å; N123-R554 WeakPolarHBondContact OD1-CD 3Å; N123-R554 PolarHBondContact OD1-NH1 3.34Å; N123-L649 PolarHBondContact ND2-O 2.86Å
124	V	90.5	Very high	91.4	Very high	39 Å²	39	60.7 Å²	60.7	24%	0.236	32%	0.317	C	S	.	.			trans	-112.1	105.7	-178.8	179.1	0	0	0	0	110.9	L121 F122 S126 S150	L121-V124 HydrophobicContact CB-CG2 4.04Å; L121-V124 WeakPolarHBondContact O-CG2 3.33Å; F122-V124 VanDerWaalsContact C-N 3.33Å; F122-V124 PolarHBondContact O-N 2.66Å; F122-V124 VanDerWaalsContact O-N 3.08Å; V124-S126 VanDerWaalsContact CG1-O 3.24Å; V124-S126 WeakPolarHBondContact CG1-O 3.27Å; V124-S150 VanDerWaalsContact O-CB 3.23Å; V124-S150 WeakPolarHBondContact O-CB 3.34Å; V124-S150 PolarHBondContact O-OG 3.33Å
125	S	90.8	Very high	91.3	Very high	65 Å²	65	56.8 Å²	56.8	46%	0.455	30%	0.298	S	S	.	.	S	Bend	trans	-80.8	-19.2	-170.4	53.4	0	0	0	0	116	T149 S150	S125-T149 CarbonylContact O-C 3.55Å; S125-T149 WeakPolarHBondContact O-CA 3.36Å; S125-S150 PolarHBondContact O-N 2.88Å
126	S	94.1	Very high	91.3	Very high	52 Å²	52	55.9 Å²	55.9	36%	0.364	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	145	168.6	177.6	0	0	0	0	110.4	V124 E147 C148	V124-S126 VanDerWaalsContact CG1-O 3.24Å; V124-S126 WeakPolarHBondContact CG1-O 3.27Å; S126-E147 WeakPolarHBondContact OG-CG 3.39Å; S126-E147 PolarHBondContact OG-OE1 2.79Å; S126-C148 CarbonylContact C-O 3.45Å; S126-C148 WeakPolarHBondContact CA-O 3.23Å
127	S	94.5	Very high	91.2	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	115.4	-170.4	-53.1	0	0	0	0	110.3	R135 C148	S127-R135 PolarHBondContact OG-NH1 2.82Å; S127-R135 VanDerWaalsContact OG-NH1 3.11Å; S127-R135 PolarHBondContact OG-NH2 2.82Å; S127-C148 PolarHBondContact N-O 3.41Å; S127-C148 PolarHBondContact O-N 2.81Å
128	S	94.6	Very high	91	Very high	44 Å²	44	59.8 Å²	59.8	31%	0.308	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	166.5	174.4	72.2	0	0	0	0	111.9	P130 D131 L132	S128-P130 WeakPolarHBondContact OG-CD 3.11Å; S128-D131 WeakPolarHBondContact CB-OD2 3.4Å; S128-D131 PolarHBondContact N-OD2 3.38Å; S128-D131 WeakPolarHBondContact O-CB 3.22Å; S128-D131 PolarHBondContact O-N 3.47Å; S128-D131 PolarHBondContact OG-OD2 2.8Å; S128-L132 PolarHBondContact O-N 3.15Å
129	L	93.3	Very high	91	Very high	42 Å²	42	59.7 Å²	59.7	22%	0.22	31%	0.314	C	S	.	.	H	α-helix	trans	-52	-44.1	176.2	173.6	155.2	0	0	0	113.7	D131 L132 R133 I141 F145	L129-D131 PolarHBondContact O-N 3.33Å; L129-L132 PolarHBondContact O-N 2.79Å; L129-R133 WeakPolarHBondContact O-CG 3.23Å; L129-R133 PolarHBondContact O-N 3.38Å; L129-I141 HydrophobicContact CD1-CG2 4.35Å; L129-F145 HydrophobicContact CB-CD1 4.36Å; L129-F145 HydrophobicContact CB-CE1 4.38Å
130	P	93.3	Very high	91.2	Very high	86 Å²	86	55.9 Å²	55.9	56%	0.558	30%	0.3	S	S	*	.	H	α-helix	trans	-56.9	-40.9	170.2	-29.3	35.9	0	0	0	114.7	S128 R133 H134	S128-P130 WeakPolarHBondContact OG-CD 3.11Å; P130-R133 PolarHBondContact O-N 2.69Å; P130-H134 PolarHBondContact O-N 3.47Å; P130-H134 VanDerWaalsContact O-N 3.1Å
131	D	92.8	Very high	91.5	Very high	69 Å²	69	56.1 Å²	56.1	37%	0.369	30%	0.297	S	S	.	.	H	α-helix	trans	-68.8	-40.9	-178.8	-55	-58.2	0	0	0	111.8	S128 L129 H134 R135	S128-D131 WeakPolarHBondContact CB-OD2 3.4Å; S128-D131 PolarHBondContact N-OD2 3.38Å; S128-D131 WeakPolarHBondContact O-CB 3.22Å; S128-D131 PolarHBondContact O-N 3.47Å; S128-D131 PolarHBondContact OG-OD2 2.8Å; L129-D131 PolarHBondContact O-N 3.33Å; D131-H134 PolarHBondContact O-N 3.23Å; D131-R135 PolarHBondContact O-N 2.76Å
132	L	93	Very high	91.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.6	-42.8	176	-65.9	-168.2	0	0	0	111.4	S128 L129 H134 R135 Y136 I141 F145 L543	S128-L132 PolarHBondContact O-N 3.15Å; L129-L132 PolarHBondContact O-N 2.79Å; L132-H134 PolarHBondContact O-N 2.77Å; L132-R135 PolarHBondContact O-N 3.01Å; L132-Y136 HydrophobicContact CD2-CD2 4.1Å; L132-Y136 HydrophobicContact CD2-CE2 3.83Å; L132-Y136 WeakPolarHBondContact O-CA 3.08Å; L132-Y136 PolarHBondContact O-N 3.38Å; L132-I141 HydrophobicContact CB-CD1 3.67Å; L132-F145 HydrophobicContact CD1-CD1 4.45Å; L132-F145 HydrophobicContact CD1-CE1 3.48Å; L132-F145 VanDerWaalsContact CD1-CE1 3.48Å; L132-F145 HydrophobicContact CD1-CE2 4.46Å; L132-F145 HydrophobicContact CD1-CZ 3.48Å; L132-F145 VanDerWaalsContact CD1-CZ 3.48Å; L132-F145 HydrophobicContact CG-CE1 4.42Å; L132-L543 HydrophobicContact CD1-CD1 3.97Å; L132-L543 HydrophobicContact CD1-CD2 3.74Å; L132-L543 HydrophobicContact CD2-CD1 3.78Å
133	R	91.6	Very high	91.3	Very high	156 Å²	156	56.3 Å²	56.3	59%	0.589	32%	0.318	S	S	*	.	H	α-helix	trans	-62	-28.7	174.4	-72.6	-175.5	176.4	173.2	1.2	112.9	L129 P130 I141	L129-R133 WeakPolarHBondContact O-CG 3.23Å; L129-R133 PolarHBondContact O-N 3.38Å; P130-R133 PolarHBondContact O-N 2.69Å; R133-I141 HydrophobicContact CG-CD1 3.67Å
134	H	91.2	Very high	91.6	Very high	139 Å²	139	55.7 Å²	55.7	64%	0.644	31%	0.314	S	S	*	.	H	α-helix	trans	-78.7	-46.8	175.8	-171.9	68.5	0	0	0	112.7	P130 D131 L132	P130-H134 PolarHBondContact O-N 3.47Å; P130-H134 VanDerWaalsContact O-N 3.1Å; D131-H134 PolarHBondContact O-N 3.23Å; L132-H134 PolarHBondContact O-N 2.77Å
135	R	90.6	Very high	91.9	Very high	26 Å²	26	54 Å²	54	10%	0.098	30%	0.304	C	S	.	.	H	α-helix	trans	-67.9	-44.3	179.4	-76.8	-178.2	-106.6	168.2	-1.9	112.3	S127 D131 L132 P137	S127-R135 PolarHBondContact OG-NH1 2.82Å; S127-R135 VanDerWaalsContact OG-NH1 3.11Å; S127-R135 PolarHBondContact OG-NH2 2.82Å; D131-R135 PolarHBondContact O-N 2.76Å; L132-R135 PolarHBondContact O-N 3.01Å; R135-P137 WeakPolarHBondContact O-CD 3.47Å
136	Y	91.3	Very high	92	Very high	11 Å²	11	55.8 Å²	55.8	4%	0.043	30%	0.302	C	S	.	.			trans	-123.5	72.5	-173.4	-40.8	-56.5	0	0	0	111.7	L132 H138 L139 L543 E546 E550	L132-Y136 HydrophobicContact CD2-CD2 4.1Å; L132-Y136 HydrophobicContact CD2-CE2 3.83Å; L132-Y136 WeakPolarHBondContact O-CA 3.08Å; L132-Y136 PolarHBondContact O-N 3.38Å; Y136-H138 PolarHBondContact O-N 2.93Å; Y136-L139 HydrophobicContact CD2-CD2 3.87Å; Y136-L139 HydrophobicContact CG-CD2 4.39Å; Y136-L139 WeakPolarHBondContact O-CB 3.4Å; Y136-L139 PolarHBondContact O-N 3.09Å; Y136-L543 HydrophobicContact CD2-CD1 4.17Å; Y136-L543 HydrophobicContact CE2-CD1 3.79Å; Y136-E546 HydrophobicContact CD1-CB 4.06Å; Y136-E546 VanDerWaalsContact CD1-CD 3.41Å; Y136-E546 HydrophobicContact CD1-CG 3.57Å; Y136-E546 HydrophobicContact CD2-CB 4.46Å; Y136-E546 HydrophobicContact CD2-CG 4.18Å; Y136-E546 HydrophobicContact CE1-CB 3.56Å; Y136-E546 HydrophobicContact CE1-CG 3.63Å; Y136-E546 HydrophobicContact CE2-CB 3.97Å; Y136-E546 HydrophobicContact CE2-CG 4.2Å; Y136-E546 HydrophobicContact CG-CB 4.49Å; Y136-E546 HydrophobicContact CG-CG 3.87Å; Y136-E546 VanDerWaalsContact CZ-CB 3.49Å; Y136-E550 PolarHBondContact OH-OE1 3.23Å; Y136-E550 PolarHBondContact OH-OE2 3.47Å; Y136-E550 VanDerWaalsContact OH-OE2 3.05Å
137	P	88.8	Confident	92.2	Very high	71 Å²	71	55.6 Å²	55.6	46%	0.461	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-4	-174.1	-24.3	35.7	0	0	0	116.6	R135	R135-P137 WeakPolarHBondContact O-CD 3.47Å
138	H	87.8	Confident	92.3	Very high	153 Å²	153	55.6 Å²	55.6	71%	0.708	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.3	-2.6	178.1	-55	-54.3	0	0	0	112.8	Y136 N140	Y136-H138 PolarHBondContact O-N 2.93Å; H138-N140 PolarHBondContact O-N 2.89Å
139	L	90.8	Very high	92.4	Very high	14 Å²	14	54.5 Å²	54.5	7%	0.073	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-72.2	123	173.6	178.6	64.4	0	0	0	109.1	Y136 I141 F539 L543	Y136-L139 HydrophobicContact CD2-CD2 3.87Å; Y136-L139 HydrophobicContact CG-CD2 4.39Å; Y136-L139 WeakPolarHBondContact O-CB 3.4Å; Y136-L139 PolarHBondContact O-N 3.09Å; L139-I141 HydrophobicContact CD2-CG1 4.34Å; L139-I141 HydrophobicContact CG-CG1 4.22Å; L139-I141 PolarHBondContact O-N 3.39Å; L139-F539 HydrophobicContact CD1-CD2 4.14Å; L139-F539 HydrophobicContact CD2-CD2 4.32Å; L139-F539 HydrophobicContact CD2-CE2 4.06Å; L139-F539 HydrophobicContact CG-CD2 4.18Å; L139-F539 HydrophobicContact CG-CE2 4.36Å; L139-L543 HydrophobicContact CD2-CB 4.26Å; L139-L543 HydrophobicContact CD2-CD1 3.91Å
140	N	89.7	Confident	92.5	Very high	52 Å²	52	52.7 Å²	52.7	28%	0.278	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-77.2	117.6	171.4	-166.7	57.7	0	0	0	109.3	H138 Q534 F539	H138-N140 PolarHBondContact O-N 2.89Å; N140-Q534 VanDerWaalsContact ND2-CD 3.27Å; N140-Q534 PolarHBondContact ND2-NE2 3.25Å; N140-Q534 PolarHBondContact ND2-OE1 3.34Å; N140-Q534 PolarHBondContact OD1-NE2 2.99Å; N140-Q534 VanDerWaalsContact OD1-NE2 3.14Å; N140-Q534 PolarHBondContact OD1-OE1 3.07Å; N140-F539 WeakPolarHBondContact O-CB 3.37Å; N140-F539 WeakPolarHBondContact O-CD2 3.5Å; N140-F539 WeakPolarHBondContact O-CG 3.39Å
141	I	92.2	Very high	92.5	Very high	20 Å²	20	50.1 Å²	50.1	10%	0.103	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-103.5	129.5	-174.8	-58.4	175.1	0	0	0	109.1	L129 L132 R133 L139 F145 F539	L129-I141 HydrophobicContact CD1-CG2 4.35Å; L132-I141 HydrophobicContact CB-CD1 3.67Å; R133-I141 HydrophobicContact CG-CD1 3.67Å; L139-I141 HydrophobicContact CD2-CG1 4.34Å; L139-I141 HydrophobicContact CG-CG1 4.22Å; L139-I141 PolarHBondContact O-N 3.39Å; I141-F145 HydrophobicContact CG2-CB 4.15Å; I141-F145 HydrophobicContact CG2-CD1 3.58Å; I141-F145 HydrophobicContact CG2-CE1 4.37Å; I141-F145 HydrophobicContact CG2-CG 4.09Å; I141-F539 HydrophobicContact CB-CD2 4.49Å; I141-F539 HydrophobicContact CB-CE2 4.12Å; I141-F539 HydrophobicContact CG1-CD2 4.46Å; I141-F539 HydrophobicContact CG1-CE2 3.97Å; I141-F539 HydrophobicContact CG2-CE2 3.97Å; I141-F539 HydrophobicContact CG2-CZ 3.9Å
142	S	91.2	Very high	92.5	Very high	21 Å²	21	46.9 Å²	46.9	15%	0.147	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-57.6	148.5	177.4	-173.7	0	0	0	0	112.2	D144 F145 E536	S142-D144 PolarHBondContact O-N 3.22Å; S142-F145 WeakPolarHBondContact O-CB 3.36Å; S142-F145 PolarHBondContact O-N 3.01Å; S142-E536 WeakPolarHBondContact CB-OE2 3.25Å; S142-E536 PolarHBondContact OG-OE2 2.84Å
143	G	89.9	Confident	92.5	Very high	74 Å²	74	48.1 Å²	48.1	76%	0.763	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-36.9	-175.8	0	0	0	0	0	114.1	F145	G143-F145 VanDerWaalsContact C-N 3.34Å
144	D	92.5	Very high	92.3	Very high	35 Å²	35	45.3 Å²	45.3	19%	0.187	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-6.5	-176.1	-61.4	-12.5	0	0	0	113.2	S142 Y300 Y301 R302	S142-D144 PolarHBondContact O-N 3.22Å; D144-Y300 HydrophobicContact CB-CD1 4.12Å; D144-Y300 CarbonylContact O-C 3.57Å; D144-Y300 VanDerWaalsContact O-CA 3.29Å; D144-Y300 WeakPolarHBondContact O-CA 2.85Å; D144-Y301 PolarHBondContact O-N 3.44Å; D144-R302 WeakPolarHBondContact OD2-CD 3.29Å; D144-R302 IonicContact OD2-CZ 2.94Å; D144-R302 IonicContact OD2-NE 3.82Å; D144-R302 IonicContact OD2-NH1 2.7Å; D144-R302 PolarHBondContact OD2-NH1 2.89Å
145	F	95.3	Very high	92.2	Very high	5 Å²	5	38.8 Å²	38.8	2%	0.022	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	130.4	-177	169.5	-88.7	0	0	0	111.5	L129 L132 I141 S142 G143 E147 C148 L298 Y300 F539	L129-F145 HydrophobicContact CB-CD1 4.36Å; L129-F145 HydrophobicContact CB-CE1 4.38Å; L132-F145 HydrophobicContact CD1-CD1 4.45Å; L132-F145 HydrophobicContact CD1-CE1 3.48Å; L132-F145 VanDerWaalsContact CD1-CE1 3.48Å; L132-F145 HydrophobicContact CD1-CE2 4.46Å; L132-F145 HydrophobicContact CD1-CZ 3.48Å; L132-F145 VanDerWaalsContact CD1-CZ 3.48Å; L132-F145 HydrophobicContact CG-CE1 4.42Å; I141-F145 HydrophobicContact CG2-CB 4.15Å; I141-F145 HydrophobicContact CG2-CD1 3.58Å; I141-F145 HydrophobicContact CG2-CE1 4.37Å; I141-F145 HydrophobicContact CG2-CG 4.09Å; S142-F145 WeakPolarHBondContact O-CB 3.36Å; S142-F145 PolarHBondContact O-N 3.01Å; G143-F145 VanDerWaalsContact C-N 3.34Å; F145-E147 VanDerWaalsContact CE2-C 3.4Å; F145-E147 WeakPolarHBondContact CE2-O 3.34Å; F145-C148 HydrophobicContact CE2-CB 3.8Å; F145-C148 HydrophobicContact CZ-CB 3.67Å; F145-L298 HydrophobicContact CD2-CB 4.44Å; F145-L298 HydrophobicContact CE2-CB 4.32Å; F145-Y300 HydrophobicContact CB-CD1 4.06Å; F145-Y300 HydrophobicContact CB-CE1 3.91Å; F145-Y300 HydrophobicContact CD2-CE1 4.5Å; F145-F539 HydrophobicContact CB-CE1 3.99Å; F145-F539 HydrophobicContact CB-CZ 4.26Å; F145-F539 HydrophobicContact CD1-CZ 4.17Å; F145-F539 AromaticContact CD2-CE1 3.79Å; F145-F539 HydrophobicContact CD2-CE1 3.79Å; F145-F539 AromaticContact CD2-CZ 3.72Å; F145-F539 HydrophobicContact CD2-CZ 3.72Å; F145-F539 HydrophobicContact CE2-CZ 4.12Å; F145-F539 AromaticContact CG-CE1 3.9Å; F145-F539 HydrophobicContact CG-CE1 3.9Å; F145-F539 AromaticContact CG-CZ 3.75Å; F145-F539 HydrophobicContact CG-CZ 3.75Å
146	Y	94.7	Very high	92.3	Very high	102 Å²	102	37.8 Å²	37.8	40%	0.4	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	-35.3	178.1	73.6	-93.9	0	0	0	115.2	K299	Y146-K299 HydrophobicContact CD1-CB 4.28Å; Y146-K299 VanDerWaalsContact CD1-O 3.27Å; Y146-K299 WeakPolarHBondContact CD1-O 3.39Å; Y146-K299 HydrophobicContact CE1-CB 3.6Å; Y146-K299 HydrophobicContact CE2-CB 4.03Å; Y146-K299 HydrophobicContact CE2-CD 4.41Å; Y146-K299 VanDerWaalsContact CZ-CB 3.46Å; Y146-K299 PolarHBondContact N-O 3.49Å; Y146-K299 VanDerWaalsContact N-O 3.09Å
147	E	96.6	Very high	92.3	Very high	47 Å²	47	38.1 Å²	38.1	22%	0.22	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	141.2	-178.1	-167.4	-165.6	170.4	0	0	112	S126 F145 T149 K299	S126-E147 WeakPolarHBondContact OG-CG 3.39Å; S126-E147 PolarHBondContact OG-OE1 2.79Å; F145-E147 VanDerWaalsContact CE2-C 3.4Å; F145-E147 WeakPolarHBondContact CE2-O 3.34Å; E147-T149 PolarHBondContact OE1-OG1 3.13Å; E147-K299 HydrophobicContact CB-CB 4.4Å; E147-K299 HydrophobicContact CB-CD 4.31Å; E147-K299 PolarHBondContact O-N 3.04Å; E147-K299 IonicContact OE1-NZ 3.84Å; E147-K299 PolarHBondContact OE1-NZ 3.42Å; E147-K299 WeakPolarHBondContact OE2-CD 3.3Å; E147-K299 WeakPolarHBondContact OE2-CE 3.24Å; E147-K299 IonicContact OE2-NZ 3.93Å; E147-K299 PolarHBondContact OE2-NZ 3.07Å
148	C	97.4	Very high	92.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	133.4	164	-179.6	0	0	0	0	111	S126 S127 F145 M296 E297 L543 Q547	S126-C148 CarbonylContact C-O 3.45Å; S126-C148 WeakPolarHBondContact CA-O 3.23Å; S127-C148 PolarHBondContact N-O 3.41Å; S127-C148 PolarHBondContact O-N 2.81Å; F145-C148 HydrophobicContact CE2-CB 3.8Å; F145-C148 HydrophobicContact CZ-CB 3.67Å; C148-M296 WeakPolarHBondContact SG-CE 3.44Å; C148-E297 CarbonylContact C-O 3.55Å; C148-E297 VanDerWaalsContact CA-O 3.22Å; C148-E297 WeakPolarHBondContact CA-O 3.26Å; C148-E297 PolarHBondContact SG-O 2.75Å; C148-L543 HydrophobicContact CB-CD2 4.05Å; C148-Q547 PolarHBondContact SG-NE2 2.89Å
149	T	96.2	Very high	92.3	Very high	22 Å²	22	29.6 Å²	29.6	14%	0.135	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	121.3	177.4	-52.3	0	0	0	0	110.1	S125 E147 L151 M296 E297 K299	S125-T149 CarbonylContact O-C 3.55Å; S125-T149 WeakPolarHBondContact O-CA 3.36Å; E147-T149 PolarHBondContact OE1-OG1 3.13Å; T149-L151 HydrophobicContact CG2-CD2 3.86Å; T149-L151 HydrophobicContact CG2-CG 4.17Å; T149-L151 PolarHBondContact O-N 3.37Å; T149-M296 CarbonylContact O-C 3.55Å; T149-M296 VanDerWaalsContact O-CA 3.24Å; T149-M296 WeakPolarHBondContact O-CA 3.47Å; T149-E297 PolarHBondContact N-O 2.84Å; T149-E297 PolarHBondContact O-N 2.93Å; T149-K299 WeakPolarHBondContact OG1-CE 3.39Å; T149-K299 PolarHBondContact OG1-NZ 3.37Å
150	S	95	Very high	92.2	Very high	3 Å²	3	32 Å²	32	2%	0.021	18%	0.178	C	C	.	.			trans	-93.8	70.1	-171	-37.1	0	0	0	0	111.8	V124 S125 W152 V153	V124-S150 VanDerWaalsContact O-CB 3.23Å; V124-S150 WeakPolarHBondContact O-CB 3.34Å; V124-S150 PolarHBondContact O-OG 3.33Å; S125-S150 PolarHBondContact O-N 2.88Å; S150-W152 PolarHBondContact O-N 2.76Å; S150-V153 WeakPolarHBondContact O-CG2 3.31Å; S150-V153 PolarHBondContact O-N 3.5Å
151	L	93.9	Very high	92.2	Very high	33 Å²	33	32 Å²	32	17%	0.173	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-17.6	-172.8	-65.4	176.8	0	0	0	114.8	T149 V153 E154 S155 R294 F295 E297	T149-L151 HydrophobicContact CG2-CD2 3.86Å; T149-L151 HydrophobicContact CG2-CG 4.17Å; T149-L151 PolarHBondContact O-N 3.37Å; L151-V153 PolarHBondContact O-N 3.05Å; L151-E154 PolarHBondContact O-N 3.13Å; L151-E154 VanDerWaalsContact O-N 3.16Å; L151-S155 PolarHBondContact O-N 2.88Å; L151-S155 PolarHBondContact O-OG 3.39Å; L151-S155 VanDerWaalsContact O-OG 3.12Å; L151-R294 WeakPolarHBondContact CB-O 3.47Å; L151-R294 HydrophobicContact CD1-CB 4.31Å; L151-R294 HydrophobicContact CD1-CG 3.69Å; L151-F295 CarbonylContact C-O 3.48Å; L151-F295 PolarHBondContact N-O 3.2Å; L151-E297 HydrophobicContact CD1-CG 3.66Å; L151-E297 HydrophobicContact CG-CG 4.4Å
152	W	93.7	Very high	92.2	Very high	1 Å²	1	32.6 Å²	32.6	0%	0.004	18%	0.182	C	C	.	.	H	α-helix	trans	-60.7	-25.9	172.9	64.9	-98.2	0	0	0	113.5	F122 S150 E154 S155 F156 F295 M551	F122-W152 WeakPolarHBondContact O-CH2 3.43Å; S150-W152 PolarHBondContact O-N 2.76Å; W152-E154 PolarHBondContact O-N 3.02Å; W152-S155 PolarHBondContact O-N 2.8Å; W152-F156 HydrophobicContact CB-CD2 4.27Å; W152-F156 PolarHBondContact O-N 3.26Å; W152-F295 HydrophobicContact CB-CD2 3.53Å; W152-F295 HydrophobicContact CB-CE2 3.41Å; W152-F295 VanDerWaalsContact CB-CE2 3.41Å; W152-F295 HydrophobicContact CB-CG 4.2Å; W152-F295 HydrophobicContact CB-CZ 4Å; W152-F295 AromaticContact CD1-CE1 3.75Å; W152-F295 AromaticContact CD1-CE2 3.89Å; W152-F295 AromaticContact CD1-CZ 3.53Å; W152-F295 HydrophobicContact CG-CD2 4.2Å; W152-F295 HydrophobicContact CG-CE1 4.38Å; W152-F295 AromaticContact CG-CE2 3.7Å; W152-F295 HydrophobicContact CG-CE2 3.7Å; W152-F295 AromaticContact CG-CZ 3.78Å; W152-F295 HydrophobicContact CG-CZ 3.78Å; W152-F295 PolarHBondContact N-O 2.87Å; W152-M551 HydrophobicContact CB-SD 4.3Å; W152-M551 HydrophobicContact CD2-CB 4.11Å; W152-M551 HydrophobicContact CD2-CG 4.33Å; W152-M551 HydrophobicContact CD2-SD 4.45Å; W152-M551 HydrophobicContact CE3-CB 3.65Å; W152-M551 HydrophobicContact CE3-CG 3.57Å; W152-M551 HydrophobicContact CE3-SD 4.06Å; W152-M551 HydrophobicContact CH2-CB 4.06Å; W152-M551 HydrophobicContact CZ2-CB 4.49Å; W152-M551 HydrophobicContact CZ3-CB 3.62Å; W152-M551 HydrophobicContact CZ3-CG 3.8Å
153	V	91.5	Very high	92.1	Very high	25 Å²	25	39.1 Å²	39.1	15%	0.152	21%	0.21	C	C	.	.	H	α-helix	trans	-62.6	-31.2	177.3	-178.6	0	0	0	0	111.2	N123 S150 L151	N123-V153 HydrophobicContact CB-CG1 4.24Å; S150-V153 WeakPolarHBondContact O-CG2 3.31Å; S150-V153 PolarHBondContact O-N 3.5Å; L151-V153 PolarHBondContact O-N 3.05Å
154	E	88.1	Confident	92.1	Very high	98 Å²	98	36.9 Å²	36.9	46%	0.458	18%	0.181	S	C	.	.	H	α-helix	trans	-93.4	-30.7	176.7	-62	178	177.2	0	0	112.1	L151 W152 F156 P723 A724	L151-E154 PolarHBondContact O-N 3.13Å; L151-E154 VanDerWaalsContact O-N 3.16Å; W152-E154 PolarHBondContact O-N 3.02Å; E154-F156 VanDerWaalsContact C-N 3.34Å; E154-P723 WeakPolarHBondContact O-CA 3.5Å; E154-A724 HydrophobicContact CB-CB 3.87Å; E154-A724 PolarHBondContact O-N 2.9Å
155	S	89.8	Confident	91.8	Very high	2 Å²	2	36 Å²	36	1%	0.014	18%	0.181	C	C	.	.	H	α-helix	trans	-68.8	-31.7	175.9	-58	0	0	0	0	113.2	L151 W152 P723 R725	L151-S155 PolarHBondContact O-N 2.88Å; L151-S155 PolarHBondContact O-OG 3.39Å; L151-S155 VanDerWaalsContact O-OG 3.12Å; W152-S155 PolarHBondContact O-N 2.8Å; S155-P723 WeakPolarHBondContact O-CB 3.26Å; S155-R725 WeakPolarHBondContact O-CG 3.5Å; S155-R725 PolarHBondContact O-NE 2.95Å
156	F	92	Very high	91.3	Very high	4 Å²	4	37.9 Å²	37.9	2%	0.018	19%	0.194	C	C	.	.	S	Bend	trans	-134.5	88.6	177.8	-45.8	-69.8	0	0	0	108.7	W152 E154 F162 V293 M551 R554	W152-F156 HydrophobicContact CB-CD2 4.27Å; W152-F156 PolarHBondContact O-N 3.26Å; E154-F156 VanDerWaalsContact C-N 3.34Å; F156-F162 HydrophobicContact CD1-CB 4.43Å; F156-F162 HydrophobicContact CD1-CD2 4.22Å; F156-F162 HydrophobicContact CD2-CD2 4.32Å; F156-F162 AromaticContact CE1-CD2 3.7Å; F156-F162 HydrophobicContact CE1-CD2 3.7Å; F156-F162 HydrophobicContact CE1-CE2 4.39Å; F156-F162 AromaticContact CE2-CD2 3.79Å; F156-F162 HydrophobicContact CE2-CD2 3.79Å; F156-F162 HydrophobicContact CE2-CE2 4.42Å; F156-F162 HydrophobicContact CG-CB 4.34Å; F156-F162 AromaticContact CZ-CD2 3.46Å; F156-F162 HydrophobicContact CZ-CD2 3.46Å; F156-F162 VanDerWaalsContact CZ-CD2 3.46Å; F156-F162 AromaticContact CZ-CE2 3.92Å; F156-F162 HydrophobicContact CZ-CE2 3.92Å; F156-V293 HydrophobicContact CE1-CG2 4.42Å; F156-V293 HydrophobicContact CE2-CG1 3.63Å; F156-V293 HydrophobicContact CZ-CB 4.28Å; F156-V293 HydrophobicContact CZ-CG1 3.62Å; F156-V293 HydrophobicContact CZ-CG2 3.71Å; F156-M551 HydrophobicContact CD2-SD 3.48Å; F156-M551 WeakPolarHBondContact CD2-SD 3.32Å; F156-M551 HydrophobicContact CE2-SD 3.93Å; F156-M551 HydrophobicContact CG-SD 4.31Å; F156-R554 PolarHBondContact O-NH1 3.5Å; F156-R554 PolarHBondContact O-NH2 2.84Å
157	P	90.7	Very high	91	Very high	18 Å²	18	34.1 Å²	34.1	12%	0.117	19%	0.187	C	C	.	.			trans	-68.7	161.6	169.7	30.5	-35.1	0	0	0	110.5	H159 E160	P157-H159 WeakPolarHBondContact CB-CE1 3.49Å; P157-H159 VanDerWaalsContact CG-CE1 3.5Å; P157-H159 WeakPolarHBondContact CG-CE1 3.19Å; P157-H159 PolarHBondContact O-N 2.98Å; P157-H159 VanDerWaalsContact O-N 3.07Å; P157-E160 HydrophobicContact CG-CB 4Å; P157-E160 CarbonylContact O-C 3.55Å; P157-E160 PolarHBondContact O-N 3.49Å
158	M	90.2	Very high	90.8	Very high	23 Å²	23	32.2 Å²	32.2	11%	0.113	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-23.2	-178.6	-67.9	-179.6	-64.6	0	0	114.1	N123 R554 F558 L649 L651 A708	N123-M158 PolarHBondContact ND2-SD 2.83Å; M158-R554 HydrophobicContact CG-CG 4.08Å; M158-R554 HydrophobicContact SD-CG 4.21Å; M158-F558 HydrophobicContact CB-CD1 4.06Å; M158-F558 HydrophobicContact CB-CD2 4.31Å; M158-F558 HydrophobicContact CB-CE1 4.3Å; M158-F558 HydrophobicContact CB-CG 4.07Å; M158-F558 WeakPolarHBondContact O-CD1 3.16Å; M158-F558 WeakPolarHBondContact O-CE1 3.26Å; M158-F558 HydrophobicContact SD-CD2 4.34Å; M158-L649 HydrophobicContact SD-CB 4.39Å; M158-L649 HydrophobicContact SD-CD2 3.98Å; M158-L651 HydrophobicContact CE-CD2 3.78Å; M158-A708 HydrophobicContact CB-CB 4.02Å; M158-A708 HydrophobicContact CE-CB 4.43Å; M158-A708 VanDerWaalsContact CE-O 3.3Å; M158-A708 WeakPolarHBondContact CE-O 3.2Å
159	H	87.4	Confident	90.6	Very high	23 Å²	23	34.9 Å²	34.9	11%	0.106	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-4.3	174	67.6	-94.6	0	0	0	114.4	P157 T704 R705 A708 P720	P157-H159 WeakPolarHBondContact CB-CE1 3.49Å; P157-H159 VanDerWaalsContact CG-CE1 3.5Å; P157-H159 WeakPolarHBondContact CG-CE1 3.19Å; P157-H159 PolarHBondContact O-N 2.98Å; P157-H159 VanDerWaalsContact O-N 3.07Å; H159-T704 HydrophobicContact CB-CG2 4.22Å; H159-R705 HydrophobicContact CB-CB 4.13Å; H159-R705 PolarHBondContact NE2-NH2 3.3Å; H159-A708 HydrophobicContact CB-CB 4.08Å; H159-P720 WeakPolarHBondContact CE1-CB 3.47Å
160	E	88.3	Confident	90.6	Very high	64 Å²	64	34.4 Å²	34.4	30%	0.299	19%	0.188	S	C	.	.	S	Bend	trans	-143.2	71	173	-159.5	-172.9	125.5	0	0	109.9	P157 R725	P157-E160 HydrophobicContact CG-CB 4Å; P157-E160 CarbonylContact O-C 3.55Å; P157-E160 PolarHBondContact O-N 3.49Å; E160-R725 IonicContact OE1-CZ 2.78Å; E160-R725 IonicContact OE1-NE 3.79Å; E160-R725 IonicContact OE1-NH2 3.48Å; E160-R725 PolarHBondContact OE1-NH2 3.08Å
161	P	90.5	Very high	90.6	Very high	52 Å²	52	36.1 Å²	36.1	34%	0.338	20%	0.196	S	C	.	.			trans	-70.2	169.8	-170.9	29.3	-37	0	0	0	113.8	Q163 D555	P161-Q163 PolarHBondContact O-N 3.44Å; P161-D555 WeakPolarHBondContact CA-OD2 3.5Å; P161-D555 HydrophobicContact CB-CB 3.88Å; P161-D555 WeakPolarHBondContact CB-OD2 3.07Å
162	F	90.9	Very high	90.6	Very high	32 Å²	32	36.3 Å²	36.3	14%	0.14	20%	0.198	C	C	.	.			trans	-68.9	124.9	179.7	-176.3	-103.5	0	0	0	112.2	F156 L164 M204 F548 M551 L552 D555	F156-F162 HydrophobicContact CD1-CB 4.43Å; F156-F162 HydrophobicContact CD1-CD2 4.22Å; F156-F162 HydrophobicContact CD2-CD2 4.32Å; F156-F162 AromaticContact CE1-CD2 3.7Å; F156-F162 HydrophobicContact CE1-CD2 3.7Å; F156-F162 HydrophobicContact CE1-CE2 4.39Å; F156-F162 AromaticContact CE2-CD2 3.79Å; F156-F162 HydrophobicContact CE2-CD2 3.79Å; F156-F162 HydrophobicContact CE2-CE2 4.42Å; F156-F162 HydrophobicContact CG-CB 4.34Å; F156-F162 AromaticContact CZ-CD2 3.46Å; F156-F162 HydrophobicContact CZ-CD2 3.46Å; F156-F162 VanDerWaalsContact CZ-CD2 3.46Å; F156-F162 AromaticContact CZ-CE2 3.92Å; F156-F162 HydrophobicContact CZ-CE2 3.92Å; F162-L164 HydrophobicContact CD1-CD2 4.12Å; F162-L164 HydrophobicContact CD1-CG 4.23Å; F162-L164 HydrophobicContact CE1-CD2 3.86Å; F162-L164 HydrophobicContact CE1-CG 4.41Å; F162-L164 PolarHBondContact O-N 2.91Å; F162-M204 HydrophobicContact CE1-CE 3.84Å; F162-M204 HydrophobicContact CE1-SD 3.84Å; F162-M204 HydrophobicContact CZ-CE 3.76Å; F162-M204 HydrophobicContact CZ-SD 4.06Å; F162-F548 HydrophobicContact CD1-CZ 4.27Å; F162-F548 HydrophobicContact CE1-CE2 4.06Å; F162-F548 AromaticContact CE1-CZ 3.74Å; F162-F548 HydrophobicContact CE1-CZ 3.74Å; F162-F548 HydrophobicContact CZ-CE2 4.15Å; F162-F548 HydrophobicContact CZ-CZ 4.21Å; F162-M551 HydrophobicContact CB-CE 3.65Å; F162-M551 HydrophobicContact CB-SD 3.96Å; F162-M551 HydrophobicContact CD1-CE 3.87Å; F162-M551 HydrophobicContact CD2-CE 4Å; F162-M551 HydrophobicContact CG-CE 3.55Å; F162-M551 HydrophobicContact CG-SD 4.34Å; F162-L552 HydrophobicContact CD1-CD2 4.1Å; F162-D555 PolarHBondContact N-OD2 2.79Å
163	Q	88.7	Confident	90.6	Very high	158 Å²	158	36.4 Å²	36.4	74%	0.738	20%	0.199	S	C	*	.			trans	-85.1	99.4	-177.2	-64.3	-172.2	6.4	0	0	111.9	P161	P161-Q163 PolarHBondContact O-N 3.44Å
164	L	90.5	Very high	90.5	Very high	27 Å²	27	38.5 Å²	38.5	14%	0.141	21%	0.207	C	C	.	.			trans	-72.6	161.4	167.1	-71.3	173.1	0	0	0	111.9	F162 M204 L212 I235 L552 F624	F162-L164 HydrophobicContact CD1-CD2 4.12Å; F162-L164 HydrophobicContact CD1-CG 4.23Å; F162-L164 HydrophobicContact CE1-CD2 3.86Å; F162-L164 HydrophobicContact CE1-CG 4.41Å; F162-L164 PolarHBondContact O-N 2.91Å; L164-M204 HydrophobicContact CD2-SD 4.04Å; L164-L212 HydrophobicContact CB-CD2 4.29Å; L164-L212 HydrophobicContact CD1-CD2 4.34Å; L164-I235 HydrophobicContact CD1-CD1 4Å; L164-I235 HydrophobicContact CD2-CD1 3.71Å; L164-I235 HydrophobicContact CD2-CG1 4.23Å; L164-L552 HydrophobicContact CD1-CD1 4.46Å; L164-L552 HydrophobicContact CD1-CD2 3.79Å; L164-L552 HydrophobicContact CD2-CD2 4.29Å; L164-L552 HydrophobicContact CG-CD2 4.03Å; L164-F624 HydrophobicContact CD1-CE1 3.93Å; L164-F624 HydrophobicContact CD1-CZ 4.13Å
165	G	87.1	Confident	90.5	Very high	18 Å²	18	37.7 Å²	37.7	19%	0.186	20%	0.199	C	C	.	.			trans	101.7	16.9	172.5	0	0	0	0	0	115.8	G167 P207	G165-G167 PolarHBondContact O-N 3.43Å; G165-G167 VanDerWaalsContact O-N 3.07Å; G165-P207 WeakPolarHBondContact CA-O 3.4Å
166	S	83.7	Confident	90.2	Very high	44 Å²	44	40.8 Å²	40.8	31%	0.308	22%	0.216	S	C	.	.			trans	-56.5	-18.6	-178.7	52.3	0	0	0	0	115.6	T168	S166-T168 PolarHBondContact O-N 3.06Å; S166-T168 PolarHBondContact OG-OG1 3.49Å
167	G	88.4	Confident	90.1	Very high	23 Å²	23	40.9 Å²	40.9	24%	0.237	22%	0.217	C	C	.	.			trans	73.2	9.3	-176.6	0	0	0	0	0	114.4	G165 C206	G165-G167 PolarHBondContact O-N 3.43Å; G165-G167 VanDerWaalsContact O-N 3.07Å; G167-C206 CarbonylContact C-O 3.59Å; G167-C206 WeakPolarHBondContact CA-O 3.31Å; G167-C206 PolarHBondContact N-O 3.17Å
168	T	92.5	Very high	89.9	Confident	7 Å²	7	44 Å²	44	4%	0.043	23%	0.233	C	C	.	.			trans	-71.2	134.6	-179.3	44.3	0	0	0	0	112	S166 M204 A205 C206 A336 I339	S166-T168 PolarHBondContact O-N 3.06Å; S166-T168 PolarHBondContact OG-OG1 3.49Å; T168-M204 PolarHBondContact OG1-O 3.39Å; T168-A205 CarbonylContact O-C 3.58Å; T168-A205 WeakPolarHBondContact O-CA 3.34Å; T168-A205 WeakPolarHBondContact O-CB 3.31Å; T168-C206 PolarHBondContact N-O 2.87Å; T168-C206 PolarHBondContact O-N 2.8Å; T168-A336 HydrophobicContact CG2-CB 4.21Å; T168-I339 HydrophobicContact CG2-CD1 3.97Å; T168-I339 HydrophobicContact CG2-CG1 4.34Å
169	D	94.3	Very high	89.8	Confident	56 Å²	56	44.2 Å²	44.2	30%	0.299	24%	0.235	S	C	.	.			trans	-145.8	158	168.1	-155.1	-7	0	0	0	110.5	A502 I503 R520	D169-A502 HydrophobicContact CB-CB 4.42Å; D169-A502 WeakPolarHBondContact O-CA 3.36Å; D169-I503 PolarHBondContact O-N 3.21Å; D169-R520 VanDerWaalsContact OD1-CD 3.25Å; D169-R520 WeakPolarHBondContact OD1-CD 3.42Å; D169-R520 IonicContact OD1-CZ 2.69Å; D169-R520 IonicContact OD1-NE 3.74Å; D169-R520 IonicContact OD1-NH1 3.61Å; D169-R520 PolarHBondContact OD1-NH1 3.42Å; D169-R520 IonicContact OD2-NH1 3.71Å; D169-R520 PolarHBondContact OD2-NH1 3.34Å
170	Y	94.8	Very high	89.7	Confident	12 Å²	12	46.3 Å²	46.3	5%	0.047	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	126.9	-175.8	-54.2	-79.1	0	0	0	111.2	L203 M204 A205 L238 I503 I505	Y170-L203 HydrophobicContact CD1-CD1 4.44Å; Y170-L203 HydrophobicContact CE1-CB 4.34Å; Y170-L203 HydrophobicContact CE1-CD1 3.67Å; Y170-L203 HydrophobicContact CE2-CB 4.12Å; Y170-M204 WeakPolarHBondContact CE2-O 3.45Å; Y170-M204 PolarHBondContact OH-O 3.23Å; Y170-A205 HydrophobicContact CD2-CB 3.77Å; Y170-A205 HydrophobicContact CE2-CB 3.71Å; Y170-L238 HydrophobicContact CD2-CB 4.39Å; Y170-I503 CarbonylContact C-O 3.58Å; Y170-I503 VanDerWaalsContact CA-O 3.27Å; Y170-I503 WeakPolarHBondContact CA-O 3.25Å; Y170-I503 HydrophobicContact CD1-CB 3.66Å; Y170-I503 HydrophobicContact CD1-CD1 4.29Å; Y170-I503 HydrophobicContact CD1-CG2 3.91Å; Y170-I503 HydrophobicContact CE1-CB 3.91Å; Y170-I503 HydrophobicContact CE1-CD1 3.64Å; Y170-I503 HydrophobicContact CE1-CG1 4.36Å; Y170-I503 HydrophobicContact CE1-CG2 4.08Å; Y170-I505 HydrophobicContact CD1-CD1 4.34Å; Y170-I505 HydrophobicContact CD1-CG1 4.21Å
171	H	94.9	Very high	89.4	Confident	39 Å²	39	48.4 Å²	48.4	18%	0.181	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	102.3	166.7	-172	82.4	0	0	0	108.9	F173 W345 R496 L497 A502 I503 V504 I505	H171-F173 AromaticContact CD2-CZ 3.95Å; H171-F173 AromaticContact NE2-CD1 3.82Å; H171-F173 AromaticContact NE2-CE1 3.61Å; H171-F173 AromaticContact NE2-CZ 3.96Å; H171-W345 HydrophobicContact CB-CH2 4.1Å; H171-R496 PolarHBondContact CE1-O 3.47Å; H171-L497 HydrophobicContact CB-CD2 4.41Å; H171-L497 VanDerWaalsContact CD2-CD2 3.46Å; H171-L497 WeakPolarHBondContact CD2-CD2 3.27Å; H171-A502 HydrophobicContact CB-CB 4.11Å; H171-I503 PolarHBondContact N-O 2.8Å; H171-V504 WeakPolarHBondContact O-CA 3.36Å; H171-I505 PolarHBondContact O-N 3.34Å
172	V	94.2	Very high	89.1	Confident	37 Å²	37	51.6 Å²	51.6	22%	0.224	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	114.6	176.6	-169	0	0	0	0	109.3	L238 I505 P507 C518	V172-L238 HydrophobicContact CG2-CD1 3.51Å; V172-I505 HydrophobicContact CB-CB 4.42Å; V172-I505 HydrophobicContact CG1-CB 4.31Å; V172-I505 HydrophobicContact CG1-CG2 4.07Å; V172-I505 HydrophobicContact CG2-CB 4.13Å; V172-I505 HydrophobicContact CG2-CG1 4.45Å; V172-I505 HydrophobicContact CG2-CG2 4.39Å; V172-P507 HydrophobicContact CG1-CG 3.96Å; V172-C518 HydrophobicContact CG1-CB 3.81Å; V172-C518 WeakPolarHBondContact CG1-O 3.35Å
173	F	93.4	Very high	88.8	Confident	3 Å²	3	51.8 Å²	51.8	1%	0.013	29%	0.291	C	S	.	.			trans	-71	151.7	170	-80.6	-66.3	0	0	0	110.8	H171 V177 Y352 L494 L497 V504 I505 H506 P507	H171-F173 AromaticContact CD2-CZ 3.95Å; H171-F173 AromaticContact NE2-CD1 3.82Å; H171-F173 AromaticContact NE2-CE1 3.61Å; H171-F173 AromaticContact NE2-CZ 3.96Å; F173-V177 HydrophobicContact CB-CB 4.18Å; F173-V177 HydrophobicContact CB-CG1 4.3Å; F173-V177 HydrophobicContact CD1-CB 4.38Å; F173-V177 HydrophobicContact CD1-CG1 3.98Å; F173-V177 HydrophobicContact CD1-CG2 4.33Å; F173-V177 HydrophobicContact CE1-CG1 4.47Å; F173-V177 HydrophobicContact CG-CB 4.45Å; F173-V177 HydrophobicContact CG-CG1 4.09Å; F173-Y352 HydrophobicContact CE1-CD1 4.4Å; F173-Y352 HydrophobicContact CE2-CD1 4.17Å; F173-Y352 HydrophobicContact CE2-CD2 4.31Å; F173-Y352 AromaticContact CE2-CE1 3.71Å; F173-Y352 HydrophobicContact CE2-CE1 3.71Å; F173-Y352 AromaticContact CE2-CE2 3.87Å; F173-Y352 HydrophobicContact CE2-CE2 3.87Å; F173-Y352 HydrophobicContact CE2-CG 4.46Å; F173-Y352 AromaticContact CE2-CZ 3.56Å; F173-Y352 AromaticContact CZ-CD1 3.72Å; F173-Y352 HydrophobicContact CZ-CD1 3.72Å; F173-Y352 AromaticContact CZ-CD2 3.95Å; F173-Y352 HydrophobicContact CZ-CD2 3.95Å; F173-Y352 AromaticContact CZ-CE1 3.76Å; F173-Y352 HydrophobicContact CZ-CE1 3.76Å; F173-Y352 AromaticContact CZ-CE2 3.99Å; F173-Y352 HydrophobicContact CZ-CE2 3.99Å; F173-Y352 AromaticContact CZ-CG 3.83Å; F173-Y352 HydrophobicContact CZ-CG 3.83Å; F173-Y352 AromaticContact CZ-CZ 3.92Å; F173-L494 WeakPolarHBondContact CD1-O 3.42Å; F173-L497 HydrophobicContact CE2-CD2 4.42Å; F173-L497 HydrophobicContact CZ-CD2 3.92Å; F173-L497 HydrophobicContact CZ-CG 4.12Å; F173-V504 HydrophobicContact CD2-CG1 3.62Å; F173-V504 HydrophobicContact CE2-CG1 3.52Å; F173-I505 PolarHBondContact N-O 3.34Å; F173-H506 AromaticContact CD2-CD2 3.69Å; F173-H506 AromaticContact CD2-CE1 3.99Å; F173-H506 AromaticContact CD2-NE2 3.32Å; F173-H506 VanDerWaalsContact CD2-NE2 3.32Å; F173-H506 WeakPolarHBondContact CD2-NE2 3.5Å; F173-H506 AromaticContact CE2-NE2 3.75Å; F173-P507 WeakPolarHBondContact O-CD 3.48Å; F173-P507 WeakPolarHBondContact O-CG 3.4Å
174	H	90	Very high	88.5	Confident	69 Å²	69	48.4 Å²	48.4	32%	0.319	28%	0.279	S	S	.	.			trans	-67.3	141.1	170.1	-170.9	-97.6	0	0	0	109.5	D176 V177 L494	H174-D176 IonicContact CE1-OD1 3.64Å; H174-D176 PolarHBondContact CE1-OD1 2.85Å; H174-D176 IonicContact CE1-OD2 3.34Å; H174-D176 PolarHBondContact CE1-OD2 2.95Å; H174-D176 VanDerWaalsContact CE1-OD2 3.26Å; H174-D176 WeakPolarHBondContact ND1-CB 3.41Å; H174-D176 PolarHBondContact ND1-N 2.86Å; H174-D176 IonicContact ND1-OD1 2.73Å; H174-D176 PolarHBondContact ND1-OD1 3.27Å; H174-D176 IonicContact ND1-OD2 2.69Å; H174-D176 PolarHBondContact ND1-OD2 3.21Å; H174-D176 PolarHBondContact O-N 3.27Å; H174-V177 WeakPolarHBondContact O-CB 3.15Å; H174-V177 PolarHBondContact O-N 2.84Å; H174-L494 HydrophobicContact CB-CD2 3.66Å
175	R	87.1	Confident	88	Confident	80 Å²	80	48.5 Å²	48.5	30%	0.302	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-9.3	179.1	67.1	173	-174.5	-81.2	-9.8	116.8	V177 P507 K509 F516 D517	R175-V177 VanDerWaalsContact C-N 3.31Å; R175-P507 HydrophobicContact CB-CB 4.38Å; R175-K509 HydrophobicContact CB-CB 4.32Å; R175-F516 WeakPolarHBondContact CD-O 3.4Å; R175-D517 IonicContact NH1-OD2 3.81Å; R175-D517 PolarHBondContact NH1-OD2 3.39Å; R175-D517 VanDerWaalsContact NH1-OD2 3.08Å
176	D	85.2	Confident	87.7	Confident	67 Å²	67	51 Å²	51	36%	0.358	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-13.8	172.3	-64.2	3.8	0	0	0	112.1	H174 R490	H174-D176 IonicContact CE1-OD1 3.64Å; H174-D176 PolarHBondContact CE1-OD1 2.85Å; H174-D176 IonicContact CE1-OD2 3.34Å; H174-D176 PolarHBondContact CE1-OD2 2.95Å; H174-D176 VanDerWaalsContact CE1-OD2 3.26Å; H174-D176 WeakPolarHBondContact ND1-CB 3.41Å; H174-D176 PolarHBondContact ND1-N 2.86Å; H174-D176 IonicContact ND1-OD1 2.73Å; H174-D176 PolarHBondContact ND1-OD1 3.27Å; H174-D176 IonicContact ND1-OD2 2.69Å; H174-D176 PolarHBondContact ND1-OD2 3.21Å; H174-D176 PolarHBondContact O-N 3.27Å; D176-R490 IonicContact OD2-CZ 3.5Å; D176-R490 IonicContact OD2-NH2 3.97Å; D176-R490 PolarHBondContact OD2-NH2 3.24Å
177	V	89.4	Confident	87.8	Confident	7 Å²	7	50.6 Å²	50.6	4%	0.042	29%	0.294	C	S	.	.	S	Bend	trans	-93.3	113.6	-179.3	175	0	0	0	0	109.1	F173 H174 R175 L494 Y495	F173-V177 HydrophobicContact CB-CB 4.18Å; F173-V177 HydrophobicContact CB-CG1 4.3Å; F173-V177 HydrophobicContact CD1-CB 4.38Å; F173-V177 HydrophobicContact CD1-CG1 3.98Å; F173-V177 HydrophobicContact CD1-CG2 4.33Å; F173-V177 HydrophobicContact CE1-CG1 4.47Å; F173-V177 HydrophobicContact CG-CB 4.45Å; F173-V177 HydrophobicContact CG-CG1 4.09Å; H174-V177 WeakPolarHBondContact O-CB 3.15Å; H174-V177 PolarHBondContact O-N 2.84Å; R175-V177 VanDerWaalsContact C-N 3.31Å; V177-L494 HydrophobicContact CG2-CB 3.85Å; V177-Y495 HydrophobicContact CG1-CD1 4.43Å; V177-Y495 HydrophobicContact CG1-CE1 3.72Å; V177-Y495 HydrophobicContact CG2-CE2 4.15Å
178	D	85.9	Confident	87.6	Confident	84 Å²	84	50.3 Å²	50.3	45%	0.449	29%	0.287	S	S	.	.			trans	-70.3	138.4	176.7	-79.8	-55.8	0	0	0	112.5	K509	D178-K509 VanDerWaalsContact OD1-CE 3.22Å; D178-K509 WeakPolarHBondContact OD1-CE 3.38Å; D178-K509 IonicContact OD1-NZ 3.14Å; D178-K509 PolarHBondContact OD1-NZ 3.07Å; D178-K509 IonicContact OD2-NZ 3.46Å; D178-K509 PolarHBondContact OD2-NZ 2.94Å
179	P	88.4	Confident	87.2	Confident	26 Å²	26	52.7 Å²	52.7	17%	0.169	30%	0.3	C	S	.	.			trans	-72.4	165	179	32.8	-39.7	0	0	0	112.8	T181 L183 H506	P179-T181 WeakPolarHBondContact CB-O 3.15Å; P179-T181 WeakPolarHBondContact CG-O 3.16Å; P179-T181 PolarHBondContact O-N 2.85Å; P179-L183 HydrophobicContact CG-CD1 3.7Å; P179-L183 HydrophobicContact CG-CG 4.19Å; P179-H506 HydrophobicContact CB-CB 4.12Å
180	P	84.5	Confident	86.9	Confident	67 Å²	67	50.5 Å²	50.5	44%	0.435	29%	0.289	S	S	.	.	S	Bend	trans	-59.4	-28.1	173	-23	32.8	0	0	0	114.5	Y351 Y352	P180-Y351 WeakPolarHBondContact CA-OH 3.47Å; P180-Y351 HydrophobicContact CB-CE1 4.23Å; P180-Y351 WeakPolarHBondContact CB-OH 3.39Å; P180-Y351 HydrophobicContact CG-CE1 3.83Å; P180-Y352 WeakPolarHBondContact CD-OH 3.37Å; P180-Y352 VanDerWaalsContact CG-OH 3.3Å; P180-Y352 WeakPolarHBondContact CG-OH 3.32Å
181	T	83.6	Confident	86.5	Confident	109 Å²	109	56.6 Å²	56.6	67%	0.669	33%	0.33	S	S	*	.	S	Bend	trans	-131.6	128.5	180	-52.9	0	0	0	0	108.1	P179	P179-T181 WeakPolarHBondContact CB-O 3.15Å; P179-T181 WeakPolarHBondContact CG-O 3.16Å; P179-T181 PolarHBondContact O-N 2.85Å
182	P	83.2	Confident	86.3	Confident	119 Å²	119	57 Å²	57	77%	0.773	33%	0.333	S	S	*	.			trans	-53	140.8	177.4	-27.9	35.7	0	0	0	113	D184	P182-D184 PolarHBondContact O-N 3.45Å
183	L	84.2	Confident	86.2	Confident	35 Å²	35	57 Å²	57	18%	0.183	34%	0.336	C	S	.	.			trans	-78.8	120.3	179.4	-62.9	119.7	0	0	0	110.5	P179 S185 G283 N508	P179-L183 HydrophobicContact CG-CD1 3.7Å; P179-L183 HydrophobicContact CG-CG 4.19Å; L183-S185 PolarHBondContact O-N 2.86Å; L183-S185 VanDerWaalsContact O-N 3.07Å; L183-S185 PolarHBondContact O-OG 3.23Å; L183-G283 VanDerWaalsContact CD2-CA 3.49Å; L183-G283 VanDerWaalsContact CD2-N 3.29Å; L183-N508 HydrophobicContact CD1-CB 4.42Å; L183-N508 HydrophobicContact CD2-CB 4.07Å
184	D	82.9	Confident	86.2	Confident	88 Å²	88	59.2 Å²	59.2	47%	0.471	35%	0.349	S	S	.	.			trans	-68.8	105.4	170.2	-178.2	6.1	0	0	0	110.2	P182 A186 L187	P182-D184 PolarHBondContact O-N 3.45Å; D184-A186 VanDerWaalsContact OD1-CB 3.26Å; D184-A186 WeakPolarHBondContact OD1-CB 3.43Å; D184-A186 PolarHBondContact OD1-N 3.03Å; D184-L187 HydrophobicContact CB-CD1 4.1Å; D184-L187 HydrophobicContact CB-CG 4.03Å; D184-L187 WeakPolarHBondContact O-CG 3.3Å
185	S	79.7	Confident	86.3	Confident	29 Å²	29	57.5 Å²	57.5	20%	0.203	34%	0.34	C	S	.	.	S	Bend	trans	-85	-12.8	-179.9	-55.5	0	0	0	0	112.4	L183 L187 L188 N508	L183-S185 PolarHBondContact O-N 2.86Å; L183-S185 VanDerWaalsContact O-N 3.07Å; L183-S185 PolarHBondContact O-OG 3.23Å; S185-L187 PolarHBondContact O-N 3.17Å; S185-L188 WeakPolarHBondContact O-CB 3.37Å; S185-L188 PolarHBondContact O-N 3.19Å; S185-N508 PolarHBondContact OG-ND2 2.79Å
186	A	82.1	Confident	86.7	Confident	69 Å²	69	55.1 Å²	55.1	57%	0.57	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-25.1	174.1	0	0	0	0	0	111.9	D184 L188 N189	D184-A186 VanDerWaalsContact OD1-CB 3.26Å; D184-A186 WeakPolarHBondContact OD1-CB 3.43Å; D184-A186 PolarHBondContact OD1-N 3.03Å; A186-L188 PolarHBondContact O-N 3.32Å; A186-L188 VanDerWaalsContact O-N 3.14Å; A186-N189 PolarHBondContact O-N 2.97Å
187	L	84.2	Confident	87.2	Confident	37 Å²	37	53.4 Å²	53.4	19%	0.194	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-25.7	173.5	-59	-179.6	0	0	0	113.8	D184 S185 R276 K279	D184-L187 HydrophobicContact CB-CD1 4.1Å; D184-L187 HydrophobicContact CB-CG 4.03Å; D184-L187 WeakPolarHBondContact O-CG 3.3Å; S185-L187 PolarHBondContact O-N 3.17Å; L187-R276 HydrophobicContact CB-CG 4.08Å; L187-R276 HydrophobicContact CD2-CG 4.34Å; L187-R276 WeakPolarHBondContact O-CG 3.28Å; L187-R276 PolarHBondContact O-NH1 3.42Å; L187-K279 HydrophobicContact CD1-CB 4.34Å; L187-K279 HydrophobicContact CD1-CD 4.17Å; L187-K279 HydrophobicContact CD1-CG 4.09Å
188	L	84.4	Confident	87.5	Confident	16 Å²	16	53.5 Å²	53.5	8%	0.084	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-34.7	-177.2	-62.1	179.9	0	0	0	113.2	S185 A186 P190 L281 A511	S185-L188 WeakPolarHBondContact O-CB 3.37Å; S185-L188 PolarHBondContact O-N 3.19Å; A186-L188 PolarHBondContact O-N 3.32Å; A186-L188 VanDerWaalsContact O-N 3.14Å; L188-P190 VanDerWaalsContact O-CD 3.23Å; L188-P190 WeakPolarHBondContact O-CD 3.34Å; L188-L281 HydrophobicContact CD1-CD2 4.1Å; L188-L281 HydrophobicContact CD2-CD2 3.9Å; L188-L281 HydrophobicContact CD2-CG 3.84Å; L188-A511 HydrophobicContact CD1-CB 3.63Å
189	N	84.1	Confident	88	Confident	57 Å²	57	49.5 Å²	49.5	31%	0.305	30%	0.303	S	S	.	.			trans	-120.5	57.5	-167.5	-57.9	-56.6	0	0	0	112.4	A186 T312 E313	A186-N189 PolarHBondContact O-N 2.97Å; N189-T312 WeakPolarHBondContact OD1-CA 3.2Å; N189-E313 PolarHBondContact ND2-OE1 2.78Å
190	P	88.2	Confident	88.4	Confident	11 Å²	11	48.5 Å²	48.5	7%	0.071	30%	0.296	C	S	.	.			trans	-68.5	145.8	176.7	31.2	-34.2	0	0	0	110.7	L188 D192 A193 L258	L188-P190 VanDerWaalsContact O-CD 3.23Å; L188-P190 WeakPolarHBondContact O-CD 3.34Å; P190-D192 PolarHBondContact O-N 3.42Å; P190-A193 HydrophobicContact CG-CB 4.11Å; P190-A193 WeakPolarHBondContact O-CB 3.48Å; P190-A193 PolarHBondContact O-N 2.82Å; P190-L258 HydrophobicContact CB-CD1 3.83Å
191	P	86.6	Confident	89	Confident	140 Å²	140	45.3 Å²	45.3	91%	0.909	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-13.9	-173.9	29.8	-36.6	0	0	0	113.8
192	D	91.9	Very high	89.7	Confident	48 Å²	48	40.1 Å²	40.1	26%	0.257	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	22.5	179	69.7	-21.8	0	0	0	112.9	P190 D194 S255 P256 S257	P190-D192 PolarHBondContact O-N 3.42Å; D192-D194 PolarHBondContact O-N 3.43Å; D192-S255 VanDerWaalsContact CG-OG 3.32Å; D192-S255 WeakPolarHBondContact OD1-CB 3.39Å; D192-S255 PolarHBondContact OD1-OG 3.38Å; D192-S255 PolarHBondContact OD2-OG 2.9Å; D192-P256 VanDerWaalsContact O-CD 3.25Å; D192-P256 WeakPolarHBondContact O-CD 3.21Å; D192-P256 WeakPolarHBondContact OD2-CD 3.32Å; D192-S257 VanDerWaalsContact CG-OG 3.25Å; D192-S257 PolarHBondContact OD1-OG 3.2Å; D192-S257 WeakPolarHBondContact OD2-CB 3.43Å; D192-S257 PolarHBondContact OD2-N 2.87Å; D192-S257 PolarHBondContact OD2-OG 3.43Å
193	A	91.1	Very high	90.3	Very high	35 Å²	35	34.4 Å²	34.4	29%	0.289	21%	0.207	S	C	.	.			trans	-57.7	109.6	179.6	0	0	0	0	0	112.4	P190 P253 W254	P190-A193 HydrophobicContact CG-CB 4.11Å; P190-A193 WeakPolarHBondContact O-CB 3.48Å; P190-A193 PolarHBondContact O-N 2.82Å; A193-P253 HydrophobicContact CB-CB 4.49Å; A193-P253 HydrophobicContact CB-CG 4.12Å; A193-W254 WeakPolarHBondContact CA-O 3.43Å
194	D	92.6	Very high	90.8	Very high	50 Å²	50	33.5 Å²	33.5	27%	0.267	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	133.4	173.8	-173.2	11.6	0	0	0	110.8	D192 S196 Y197 P253 W254	D192-D194 PolarHBondContact O-N 3.43Å; D194-S196 WeakPolarHBondContact OD1-CB 3.38Å; D194-S196 PolarHBondContact OD1-N 3.4Å; D194-S196 PolarHBondContact OD1-OG 3.23Å; D194-S196 VanDerWaalsContact OD2-CB 3.28Å; D194-S196 WeakPolarHBondContact OD2-CB 3.45Å; D194-S196 PolarHBondContact OD2-OG 2.97Å; D194-Y197 VanDerWaalsContact O-O 3.13Å; D194-P253 VanDerWaalsContact O-CB 3.32Å; D194-P253 WeakPolarHBondContact O-CB 3.36Å; D194-W254 HydrophobicContact CB-CE3 3.9Å; D194-W254 HydrophobicContact CB-CZ3 4.22Å; D194-W254 PolarHBondContact N-O 2.96Å; D194-W254 PolarHBondContact O-N 3.15Å; D194-W254 VanDerWaalsContact O-N 3.16Å; D194-W254 WeakPolarHBondContact OD2-CZ3 3.19Å
195	Y	93.7	Very high	91.4	Very high	33 Å²	33	29.5 Å²	29.5	13%	0.129	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-3	179.4	-72.6	-103.9	0	0	0	112.7	Y197 P253 F311 R318 E326	Y195-Y197 PolarHBondContact O-N 3.11Å; Y195-P253 HydrophobicContact CD1-CB 4.13Å; Y195-P253 HydrophobicContact CD2-CB 4.13Å; Y195-P253 HydrophobicContact CE1-CB 4.21Å; Y195-P253 HydrophobicContact CE1-CG 4.2Å; Y195-P253 HydrophobicContact CE2-CB 4.18Å; Y195-P253 HydrophobicContact CE2-CG 4.16Å; Y195-P253 HydrophobicContact CG-CB 4.12Å; Y195-F311 HydrophobicContact CE1-CD2 4.19Å; Y195-F311 PolarHBondContact OH-N 2.89Å; Y195-F311 VanDerWaalsContact OH-N 3.12Å; Y195-R318 VanDerWaalsContact CG-CZ 3.43Å; Y195-E326 WeakPolarHBondContact O-CB 3.44Å; Y195-E326 WeakPolarHBondContact O-CG 3.49Å
196	S	94.2	Very high	92.1	Very high	30 Å²	30	28.1 Å²	28.1	21%	0.21	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53	-34.4	171.2	71.1	0	0	0	0	112.2	D194 E326 V327	D194-S196 WeakPolarHBondContact OD1-CB 3.38Å; D194-S196 PolarHBondContact OD1-N 3.4Å; D194-S196 PolarHBondContact OD1-OG 3.23Å; D194-S196 VanDerWaalsContact OD2-CB 3.28Å; D194-S196 WeakPolarHBondContact OD2-CB 3.45Å; D194-S196 PolarHBondContact OD2-OG 2.97Å; S196-E326 WeakPolarHBondContact O-CA 3.49Å; S196-V327 PolarHBondContact O-N 3.42Å
197	Y	95.9	Very high	92.6	Very high	32 Å²	32	26.4 Å²	26.4	13%	0.125	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	140.4	166.8	-73.1	-95	0	0	0	111.1	D194 Y195 W254 P263 Q264 L270 V327	D194-Y197 VanDerWaalsContact O-O 3.13Å; Y195-Y197 PolarHBondContact O-N 3.11Å; Y197-W254 WeakPolarHBondContact O-CB 3.19Å; Y197-W254 PolarHBondContact O-N 3.06Å; Y197-W254 VanDerWaalsContact O-N 3.09Å; Y197-P263 HydrophobicContact CD1-CB 4.21Å; Y197-P263 HydrophobicContact CD2-CB 3.8Å; Y197-P263 HydrophobicContact CD2-CG 3.35Å; Y197-P263 HydrophobicContact CE2-CB 4.37Å; Y197-P263 HydrophobicContact CE2-CG 3.74Å; Y197-P263 HydrophobicContact CG-CB 3.71Å; Y197-P263 HydrophobicContact CG-CG 3.84Å; Y197-Q264 HydrophobicContact CE2-CB 4.47Å; Y197-Q264 WeakPolarHBondContact OH-CB 3.47Å; Y197-Q264 VanDerWaalsContact OH-CD 3.31Å; Y197-Q264 WeakPolarHBondContact OH-CG 3.49Å; Y197-Q264 PolarHBondContact OH-OE1 2.91Å; Y197-L270 HydrophobicContact CD1-CD1 3.93Å; Y197-V327 CarbonylContact C-O 3.56Å; Y197-V327 WeakPolarHBondContact CA-O 3.34Å; Y197-V327 HydrophobicContact CD1-CB 3.75Å; Y197-V327 HydrophobicContact CD1-CG1 4.19Å; Y197-V327 HydrophobicContact CD1-CG2 4.38Å; Y197-V327 HydrophobicContact CE1-CB 3.76Å; Y197-V327 HydrophobicContact CE1-CG1 4.05Å; Y197-V327 HydrophobicContact CE1-CG2 3.96Å; Y197-V327 HydrophobicContact CG-CB 4.45Å
198	S	95.6	Very high	92.9	Very high	8 Å²	8	30.7 Å²	30.7	6%	0.056	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	146.8	167.1	66	0	0	0	0	110.8	G252 V327 V329	S198-G252 WeakPolarHBondContact CA-O 3.25Å; S198-G252 VanDerWaalsContact CB-O 3.3Å; S198-G252 WeakPolarHBondContact CB-O 3.42Å; S198-V327 PolarHBondContact N-O 3.03Å; S198-V329 PolarHBondContact O-N 3.25Å
199	A	96.6	Very high	93.1	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	134.6	-179.7	0	0	0	0	0	110.2	G251 G252 L270 T273 A274 V329 F331	A199-G251 VanDerWaalsContact O-CA 3.31Å; A199-G251 WeakPolarHBondContact O-CA 3.32Å; A199-G252 PolarHBondContact N-O 3.42Å; A199-G252 PolarHBondContact O-N 2.76Å; A199-L270 HydrophobicContact CB-CB 4.39Å; A199-L270 VanDerWaalsContact CB-O 3.31Å; A199-L270 WeakPolarHBondContact CB-O 3.47Å; A199-T273 HydrophobicContact CB-CG2 3.8Å; A199-A274 HydrophobicContact CB-CB 3.99Å; A199-V329 WeakPolarHBondContact CA-O 3.23Å; A199-F331 HydrophobicContact CB-CD2 4.37Å; A199-F331 HydrophobicContact CB-CE2 4.16Å
200	R	96.9	Very high	93.3	Very high	5 Å²	5	31 Å²	31	2%	0.019	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	151.4	177.7	-55.4	-58.3	179.4	74.3	25.1	110.8	A249 L250 V328 V329 F330 F331 E540	R200-A249 HydrophobicContact CB-CB 3.91Å; R200-A249 HydrophobicContact CG-CB 4.23Å; R200-L250 CarbonylContact C-O 3.59Å; R200-L250 WeakPolarHBondContact CA-O 3.44Å; R200-V328 HydrophobicContact CG-CG1 3.62Å; R200-V329 PolarHBondContact N-O 3.25Å; R200-F330 HydrophobicContact CB-CD1 4.23Å; R200-F330 HydrophobicContact CB-CD2 4.15Å; R200-F330 HydrophobicContact CB-CE1 4.24Å; R200-F330 HydrophobicContact CB-CE2 4.14Å; R200-F330 HydrophobicContact CB-CG 4.19Å; R200-F330 HydrophobicContact CB-CZ 4.19Å; R200-F330 HydrophobicContact CG-CD2 4.4Å; R200-F330 HydrophobicContact CG-CE2 4.09Å; R200-F330 HydrophobicContact CG-CZ 4.35Å; R200-F331 PolarHBondContact O-N 2.93Å; R200-E540 IonicContact CZ-OE1 2.99Å; R200-E540 IonicContact CZ-OE2 3.33Å; R200-E540 IonicContact NH1-OE1 3.65Å; R200-E540 IonicContact NH1-OE2 2.8Å; R200-E540 PolarHBondContact NH1-OE2 2.94Å; R200-E540 VanDerWaalsContact NH2-CD 3.33Å; R200-E540 IonicContact NH2-OE1 3.83Å; R200-E540 PolarHBondContact NH2-OE1 2.94Å; R200-E540 IonicContact NH2-OE2 3.52Å; R200-E540 PolarHBondContact NH2-OE2 2.78Å; R200-E540 VanDerWaalsContact NH2-OE2 3.15Å
201	V	97.5	Very high	93.4	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	127.2	-175.1	-178.5	0	0	0	0	109.2	L203 L250 A274 F278 L286 F331 P333	V201-L203 HydrophobicContact CG1-CD2 4.35Å; V201-L203 HydrophobicContact CG1-CG 4.16Å; V201-L250 PolarHBondContact N-O 2.78Å; V201-A274 HydrophobicContact CG2-CB 3.66Å; V201-F278 HydrophobicContact CB-CD2 3.65Å; V201-F278 HydrophobicContact CB-CE2 4.02Å; V201-F278 HydrophobicContact CG1-CD2 3.76Å; V201-F278 HydrophobicContact CG1-CE2 3.76Å; V201-F278 HydrophobicContact CG2-CB 4.46Å; V201-F278 HydrophobicContact CG2-CD2 4.01Å; V201-L286 HydrophobicContact CG1-CD1 4.02Å; V201-F331 WeakPolarHBondContact CA-O 3.43Å; V201-P333 HydrophobicContact CG1-CG 3.87Å
202	M	97.1	Very high	93.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.153	C	C	.	.			trans	-117.7	89	174.4	-68.5	-63.1	-76	0	0	109.5	M204 F237 V239 A249 F330 F331 L526 V541 F544	M202-M204 PolarHBondContact O-N 2.86Å; M202-F237 HydrophobicContact CB-CD1 3.95Å; M202-F237 HydrophobicContact CB-CE1 4.25Å; M202-F237 HydrophobicContact CE-CB 3.88Å; M202-F237 HydrophobicContact CE-CD1 4.19Å; M202-F237 HydrophobicContact CE-CG 3.99Å; M202-V239 HydrophobicContact CE-CG1 3.92Å; M202-V239 HydrophobicContact SD-CG1 4.29Å; M202-A249 HydrophobicContact SD-CB 3.79Å; M202-F330 HydrophobicContact CG-CD1 3.65Å; M202-F330 HydrophobicContact CG-CE1 3.68Å; M202-F330 HydrophobicContact SD-CE1 4.2Å; M202-F331 PolarHBondContact N-O 2.87Å; M202-L526 HydrophobicContact CE-CD1 4.29Å; M202-V541 HydrophobicContact CE-CG1 4.27Å; M202-F544 HydrophobicContact CB-CD1 4.45Å; M202-F544 HydrophobicContact CB-CE1 3.72Å; M202-F544 HydrophobicContact CB-CE2 3.85Å; M202-F544 HydrophobicContact CB-CZ 3.38Å; M202-F544 HydrophobicContact CE-CD1 3.56Å; M202-F544 HydrophobicContact CE-CE1 3.61Å; M202-F544 HydrophobicContact CE-CG 4.41Å; M202-F544 HydrophobicContact CE-CZ 4.48Å; M202-F544 HydrophobicContact CG-CD1 3.95Å; M202-F544 HydrophobicContact CG-CD2 4.06Å; M202-F544 HydrophobicContact CG-CE1 3.73Å; M202-F544 HydrophobicContact CG-CE2 3.83Å; M202-F544 HydrophobicContact CG-CG 4.12Å; M202-F544 HydrophobicContact CG-CZ 3.67Å
203	L	96.4	Very high	93.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	115.5	176.5	-78.6	-170.2	0	0	0	110.9	Y170 V201 F237 L238 F278 L284 L286 P333 A335	Y170-L203 HydrophobicContact CD1-CD1 4.44Å; Y170-L203 HydrophobicContact CE1-CB 4.34Å; Y170-L203 HydrophobicContact CE1-CD1 3.67Å; Y170-L203 HydrophobicContact CE2-CB 4.12Å; V201-L203 HydrophobicContact CG1-CD2 4.35Å; V201-L203 HydrophobicContact CG1-CG 4.16Å; L203-F237 WeakPolarHBondContact O-CA 3.32Å; L203-L238 HydrophobicContact CB-CB 4.12Å; L203-L238 HydrophobicContact CD1-CD2 4.26Å; L203-L238 PolarHBondContact O-N 3.4Å; L203-F278 HydrophobicContact CD1-CE1 4.07Å; L203-F278 HydrophobicContact CD1-CE2 4.17Å; L203-F278 HydrophobicContact CD1-CZ 3.41Å; L203-F278 VanDerWaalsContact CD1-CZ 3.41Å; L203-F278 HydrophobicContact CG-CE2 4.21Å; L203-F278 HydrophobicContact CG-CZ 3.94Å; L203-L284 HydrophobicContact CD1-CD2 4.31Å; L203-L286 HydrophobicContact CD1-CD2 4.49Å; L203-P333 HydrophobicContact CD2-CG 3.69Å; L203-A335 HydrophobicContact CD2-CB 3.95Å
204	M	95.4	Very high	93.4	Very high	16 Å²	16	31 Å²	31	8%	0.079	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	134.6	175.6	-174.6	-177.8	64.5	0	0	111.6	F162 L164 T168 Y170 M202 C206 I235 H236 F237 F548	F162-M204 HydrophobicContact CE1-CE 3.84Å; F162-M204 HydrophobicContact CE1-SD 3.84Å; F162-M204 HydrophobicContact CZ-CE 3.76Å; F162-M204 HydrophobicContact CZ-SD 4.06Å; L164-M204 HydrophobicContact CD2-SD 4.04Å; T168-M204 PolarHBondContact OG1-O 3.39Å; Y170-M204 WeakPolarHBondContact CE2-O 3.45Å; Y170-M204 PolarHBondContact OH-O 3.23Å; M202-M204 PolarHBondContact O-N 2.86Å; M204-C206 HydrophobicContact CE-CB 3.9Å; M204-C206 HydrophobicContact CG-CB 4.23Å; M204-C206 HydrophobicContact SD-CB 4.08Å; M204-I235 HydrophobicContact CG-CG2 4.08Å; M204-I235 HydrophobicContact SD-CG2 4.09Å; M204-H236 WeakPolarHBondContact CA-O 3.17Å; M204-F237 HydrophobicContact CB-CD1 4.24Å; M204-F237 HydrophobicContact CB-CE1 3.83Å; M204-F237 HydrophobicContact CB-CZ 4.46Å; M204-F237 HydrophobicContact CG-CE1 4.28Å; M204-F237 HydrophobicContact CG-CZ 4.44Å; M204-F548 HydrophobicContact SD-CZ 3.85Å
205	A	94.9	Very high	93.3	Very high	3 Å²	3	32 Å²	32	3%	0.025	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.7	160.5	0	0	0	0	0	109.2	T168 Y170 H236	T168-A205 CarbonylContact O-C 3.58Å; T168-A205 WeakPolarHBondContact O-CA 3.34Å; T168-A205 WeakPolarHBondContact O-CB 3.31Å; Y170-A205 HydrophobicContact CD2-CB 3.77Å; Y170-A205 HydrophobicContact CE2-CB 3.71Å; A205-H236 HydrophobicContact CB-CB 4.16Å; A205-H236 PolarHBondContact N-O 2.91Å; A205-H236 PolarHBondContact O-N 3.01Å
206	C	94.2	Very high	93.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.159	C	C	.	.			trans	-145	122.2	-175.8	-168.5	0	0	0	0	109.4	G167 T168 M204	G167-C206 CarbonylContact C-O 3.59Å; G167-C206 WeakPolarHBondContact CA-O 3.31Å; G167-C206 PolarHBondContact N-O 3.17Å; T168-C206 PolarHBondContact N-O 2.87Å; T168-C206 PolarHBondContact O-N 2.8Å; M204-C206 HydrophobicContact CE-CB 3.9Å; M204-C206 HydrophobicContact CG-CB 4.23Å; M204-C206 HydrophobicContact SD-CB 4.08Å
207	P	92.2	Very high	92.9	Very high	34 Å²	34	29 Å²	29	22%	0.221	15%	0.149	C	C	.	.			trans	-55.3	156	173.4	-24.4	34	0	0	0	112.1	G165 E211 S234	G165-P207 WeakPolarHBondContact CA-O 3.4Å; P207-E211 HydrophobicContact CB-CB 4.04Å; P207-S234 WeakPolarHBondContact CD-O 3.38Å
208	Q	90.8	Very high	92.6	Very high	127 Å²	127	32.7 Å²	32.7	59%	0.593	16%	0.162	S	C	*	.			trans	-55.1	146.7	173.6	-69.2	-177.8	-5.1	0	0	111	G210 E211 L212	Q208-G210 PolarHBondContact O-N 3.28Å; Q208-E211 WeakPolarHBondContact O-CA 3.44Å; Q208-E211 WeakPolarHBondContact O-CB 3.22Å; Q208-E211 PolarHBondContact O-N 2.96Å; Q208-L212 PolarHBondContact O-N 3.05Å
209	L	90	Very high	92.2	Very high	44 Å²	44	34.2 Å²	34.2	23%	0.23	17%	0.169	C	C	.	.	H	α-helix	trans	-52.6	-38.2	-170	-165.4	64.5	0	0	0	113.9	L212 Y213	L209-L212 HydrophobicContact CD1-CD2 4.41Å; L209-L212 PolarHBondContact O-N 3.3Å; L209-Y213 HydrophobicContact CD1-CD1 4.37Å; L209-Y213 HydrophobicContact CD1-CE1 3.62Å; L209-Y213 HydrophobicContact CD1-CE2 4.29Å; L209-Y213 HydrophobicContact CD2-CE2 4.12Å; L209-Y213 HydrophobicContact CG-CD2 4.39Å; L209-Y213 HydrophobicContact CG-CE1 4.04Å; L209-Y213 HydrophobicContact CG-CE2 3.8Å; L209-Y213 VanDerWaalsContact O-CG 3.3Å; L209-Y213 PolarHBondContact O-N 2.96Å
210	G	87.3	Confident	91.6	Very high	35 Å²	35	36.1 Å²	36.1	36%	0.361	19%	0.185	S	C	.	.	H	α-helix	trans	-67.8	-37.6	174.7	0	0	0	0	0	114.6	Q208 K214	Q208-G210 PolarHBondContact O-N 3.28Å; G210-K214 WeakPolarHBondContact O-CB 3.39Å; G210-K214 PolarHBondContact O-N 3.41Å
211	E	89.6	Confident	90.6	Very high	73 Å²	73	39.1 Å²	39.1	34%	0.341	20%	0.201	S	C	.	.	H	α-helix	trans	-69.1	-41.1	171.8	-64.9	-162.8	134.3	0	0	111	P207 Q208 K214 N215 K500	P207-E211 HydrophobicContact CB-CB 4.04Å; Q208-E211 WeakPolarHBondContact O-CA 3.44Å; Q208-E211 WeakPolarHBondContact O-CB 3.22Å; Q208-E211 PolarHBondContact O-N 2.96Å; E211-K214 PolarHBondContact O-N 2.89Å; E211-N215 VanDerWaalsContact O-CB 3.3Å; E211-N215 WeakPolarHBondContact O-CB 3.31Å; E211-N215 PolarHBondContact O-N 3.14Å; E211-N215 PolarHBondContact O-ND2 2.88Å; E211-K500 IonicContact OE1-NZ 3.64Å; E211-K500 PolarHBondContact OE1-NZ 3.26Å; E211-K500 IonicContact OE2-NZ 2.87Å; E211-K500 PolarHBondContact OE2-NZ 3.36Å
212	L	91.6	Very high	89.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-57.8	-53.2	176.8	-179.7	61.6	0	0	0	111	L164 Q208 L209 K214 N215 T216 S234 F624	L164-L212 HydrophobicContact CB-CD2 4.29Å; L164-L212 HydrophobicContact CD1-CD2 4.34Å; Q208-L212 PolarHBondContact O-N 3.05Å; L209-L212 HydrophobicContact CD1-CD2 4.41Å; L209-L212 PolarHBondContact O-N 3.3Å; L212-K214 PolarHBondContact O-N 3.04Å; L212-N215 PolarHBondContact O-N 3.16Å; L212-T216 HydrophobicContact CD1-CG2 4Å; L212-T216 WeakPolarHBondContact O-CG2 3.33Å; L212-T216 PolarHBondContact O-N 2.86Å; L212-T216 PolarHBondContact O-OG1 2.86Å; L212-S234 VanDerWaalsContact CD1-CB 3.42Å; L212-F624 HydrophobicContact CD1-CE2 4.36Å; L212-F624 HydrophobicContact CD1-CZ 4.45Å; L212-F624 HydrophobicContact CD2-CE1 4.34Å; L212-F624 HydrophobicContact CD2-CE2 4.27Å; L212-F624 HydrophobicContact CD2-CZ 3.78Å; L212-F624 HydrophobicContact CG-CE2 4.08Å; L212-F624 HydrophobicContact CG-CZ 4.1Å
213	Y	91.7	Very high	88	Confident	19 Å²	19	46.9 Å²	46.9	8%	0.075	26%	0.258	C	S	.	.	H	α-helix	trans	-62.4	-40.4	177.1	-65.4	-13.5	0	0	0	112.4	L209 N215 T216 C217 P620 A621 F624 M693	L209-Y213 HydrophobicContact CD1-CD1 4.37Å; L209-Y213 HydrophobicContact CD1-CE1 3.62Å; L209-Y213 HydrophobicContact CD1-CE2 4.29Å; L209-Y213 HydrophobicContact CD2-CE2 4.12Å; L209-Y213 HydrophobicContact CG-CD2 4.39Å; L209-Y213 HydrophobicContact CG-CE1 4.04Å; L209-Y213 HydrophobicContact CG-CE2 3.8Å; L209-Y213 VanDerWaalsContact O-CG 3.3Å; L209-Y213 PolarHBondContact O-N 2.96Å; Y213-N215 VanDerWaalsContact C-N 3.25Å; Y213-N215 PolarHBondContact O-N 3.23Å; Y213-T216 PolarHBondContact O-N 2.92Å; Y213-C217 WeakPolarHBondContact O-CB 3.11Å; Y213-C217 PolarHBondContact O-N 3.16Å; Y213-P620 HydrophobicContact CD2-CB 3.64Å; Y213-P620 HydrophobicContact CD2-CG 3.93Å; Y213-P620 HydrophobicContact CE2-CB 3.98Å; Y213-P620 HydrophobicContact CE2-CG 3.93Å; Y213-P620 HydrophobicContact CG-CB 4.37Å; Y213-A621 WeakPolarHBondContact OH-CA 3.45Å; Y213-A621 WeakPolarHBondContact OH-CB 3.16Å; Y213-F624 HydrophobicContact CD1-CB 3.83Å; Y213-F624 HydrophobicContact CD1-CD1 4.29Å; Y213-F624 HydrophobicContact CD1-CD2 4.05Å; Y213-F624 AromaticContact CD1-CG 3.81Å; Y213-F624 HydrophobicContact CD1-CG 3.81Å; Y213-F624 HydrophobicContact CE1-CB 3.67Å; Y213-F624 AromaticContact CE1-CD1 3.7Å; Y213-F624 HydrophobicContact CE1-CD1 3.7Å; Y213-F624 HydrophobicContact CE1-CD2 4.29Å; Y213-F624 HydrophobicContact CE1-CE1 4.37Å; Y213-F624 AromaticContact CE1-CG 3.64Å; Y213-F624 HydrophobicContact CE1-CG 3.64Å; Y213-M693 HydrophobicContact CD2-CE 3.8Å; Y213-M693 HydrophobicContact CD2-SD 4.29Å; Y213-M693 HydrophobicContact CE2-CE 4.25Å; Y213-M693 HydrophobicContact CE2-SD 4.16Å
214	K	87.9	Confident	86.3	Confident	142 Å²	142	53.3 Å²	53.3	62%	0.617	29%	0.292	S	S	*	.	H	α-helix	trans	-63.6	-30.6	175.9	-176.3	176.1	-179.8	178.2	0	112.6	G210 E211 L212 K228	G210-K214 WeakPolarHBondContact O-CB 3.39Å; G210-K214 PolarHBondContact O-N 3.41Å; E211-K214 PolarHBondContact O-N 2.89Å; L212-K214 PolarHBondContact O-N 3.04Å; K214-K228 WeakPolarHBondContact O-CD 3.35Å; K214-K228 PolarHBondContact O-NZ 3.06Å
215	N	89	Confident	84.6	Confident	71 Å²	71	53.9 Å²	53.9	38%	0.38	30%	0.302	S	S	.	.	H	α-helix	trans	-84.3	-27.5	178.9	-68.8	-20.1	0	0	0	113.1	E211 L212 Y213 K228 V229	E211-N215 VanDerWaalsContact O-CB 3.3Å; E211-N215 WeakPolarHBondContact O-CB 3.31Å; E211-N215 PolarHBondContact O-N 3.14Å; E211-N215 PolarHBondContact O-ND2 2.88Å; L212-N215 PolarHBondContact O-N 3.16Å; Y213-N215 VanDerWaalsContact C-N 3.25Å; Y213-N215 PolarHBondContact O-N 3.23Å; N215-K228 CarbonylContact O-C 3.12Å; N215-K228 WeakPolarHBondContact O-CA 3.12Å; N215-K228 WeakPolarHBondContact O-CB 3.45Å; N215-V229 HydrophobicContact CB-CG2 4.38Å; N215-V229 PolarHBondContact O-N 2.92Å
216	T	90.8	Very high	83.2	Confident	0 Å²	0	57 Å²	57	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-106.7	-40.9	-171.2	59.4	0	0	0	0	114.4	L212 Y213 V229 P231 F624 R633	L212-T216 HydrophobicContact CD1-CG2 4Å; L212-T216 WeakPolarHBondContact O-CG2 3.33Å; L212-T216 PolarHBondContact O-N 2.86Å; L212-T216 PolarHBondContact O-OG1 2.86Å; Y213-T216 PolarHBondContact O-N 2.92Å; T216-V229 WeakPolarHBondContact CA-O 3.34Å; T216-P231 HydrophobicContact CG2-CG 4.47Å; T216-F624 HydrophobicContact CG2-CE2 4.16Å; T216-F624 VanDerWaalsContact OG1-CD2 3.3Å; T216-F624 WeakPolarHBondContact OG1-CD2 3.46Å; T216-R633 PolarHBondContact O-NH2 2.99Å
217	C	90.3	Very high	82.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	37%	0.366	C	S	.	.			trans	-89.2	150.6	-177.1	-59.3	0	0	0	0	111.8	Y213 M219 K228 L623 F624	Y213-C217 WeakPolarHBondContact O-CB 3.11Å; Y213-C217 PolarHBondContact O-N 3.16Å; C217-M219 HydrophobicContact CB-CE 3.81Å; C217-M219 HydrophobicContact CB-SD 3.98Å; C217-K228 WeakPolarHBondContact O-CD 3.34Å; C217-K228 WeakPolarHBondContact O-CE 3.33Å; C217-K228 PolarHBondContact O-NZ 2.94Å; C217-L623 HydrophobicContact CB-CD2 3.84Å; C217-L623 HydrophobicContact CB-CG 4.07Å; C217-F624 WeakPolarHBondContact SG-CA 3.43Å
218	R	88.1	Confident	82	Confident	110 Å²	110	60.4 Å²	60.4	42%	0.415	36%	0.362	S	S	.	.			trans	-95.9	104	162.5	-72.8	178.4	172.3	145.2	-2.5	107.5	G225 K228 R633 H675	R218-G225 PolarHBondContact NE-O 3.16Å; R218-K228 HydrophobicContact CG-CG 4.12Å; R218-R633 PolarHBondContact NH1-O 2.87Å; R218-H675 PolarHBondContact O-CE1 3.06Å
219	M	87.2	Confident	81.9	Confident	40 Å²	40	57.1 Å²	57.1	20%	0.197	35%	0.35	C	S	.	.			trans	-73.4	154.7	176.2	-55.3	-52	-173.9	0	0	110.2	C217 D221 D222 T617 P620 L623	C217-M219 HydrophobicContact CB-CE 3.81Å; C217-M219 HydrophobicContact CB-SD 3.98Å; M219-D221 PolarHBondContact O-N 3.24Å; M219-D222 HydrophobicContact CB-CB 4.46Å; M219-D222 WeakPolarHBondContact CB-OD2 3.5Å; M219-D222 PolarHBondContact N-OD2 2.81Å; M219-D222 WeakPolarHBondContact O-CB 3.28Å; M219-D222 PolarHBondContact O-N 2.94Å; M219-D222 VanDerWaalsContact O-N 3.09Å; M219-T617 HydrophobicContact SD-CG2 3.82Å; M219-P620 HydrophobicContact CE-CB 3.69Å; M219-P620 HydrophobicContact SD-CB 4.37Å; M219-L623 HydrophobicContact SD-CD2 3.74Å
220	A	85	Confident	81.9	Confident	40 Å²	40	56.1 Å²	56.1	33%	0.331	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-31.7	176.1	0	0	0	0	0	112.5	R615 T617	A220-R615 HydrophobicContact CB-CG 4.19Å; A220-R615 WeakPolarHBondContact CB-O 3.5Å; A220-T617 PolarHBondContact N-OG1 3.4Å
221	D	76	Confident	82.1	Confident	68 Å²	68	54.6 Å²	54.6	36%	0.364	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-10.1	176.3	-52.9	-83.7	0	0	0	114.5	M219 A223 R616	M219-D221 PolarHBondContact O-N 3.24Å; D221-A223 PolarHBondContact O-N 3.31Å; D221-R616 WeakPolarHBondContact OD1-CD 3.47Å; D221-R616 WeakPolarHBondContact OD1-CG 3.47Å; D221-R616 IonicContact OD1-NE 3.18Å; D221-R616 PolarHBondContact OD1-NE 3.47Å; D221-R616 WeakPolarHBondContact OD2-CA 3.43Å; D221-R616 WeakPolarHBondContact OD2-CB 3.15Å
222	D	76.3	Confident	82.3	Confident	54 Å²	54	51.7 Å²	51.7	29%	0.289	32%	0.315	S	S	.	.			trans	-72.2	88.9	-179.6	-83.3	-49.3	0	0	0	110.7	M219 N224 K228	M219-D222 HydrophobicContact CB-CB 4.46Å; M219-D222 WeakPolarHBondContact CB-OD2 3.5Å; M219-D222 PolarHBondContact N-OD2 2.81Å; M219-D222 WeakPolarHBondContact O-CB 3.28Å; M219-D222 PolarHBondContact O-N 2.94Å; M219-D222 VanDerWaalsContact O-N 3.09Å; D222-N224 PolarHBondContact O-N 2.81Å; D222-K228 IonicContact OD1-NZ 2.65Å; D222-K228 WeakPolarHBondContact OD2-CE 3.41Å; D222-K228 IonicContact OD2-NZ 3.27Å; D222-K228 PolarHBondContact OD2-NZ 3.03Å
223	A	63.5	Low	82.4	Confident	109 Å²	109	55.8 Å²	55.8	90%	0.901	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-7.9	175.1	0	0	0	0	0	114.8	D221	D221-A223 PolarHBondContact O-N 3.31Å
224	N	60.5	Low	82.5	Confident	134 Å²	134	55.3 Å²	55.3	72%	0.717	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.9	71.3	-178.8	-152.3	7.2	0	0	0	111.8	D222 A226	D222-N224 PolarHBondContact O-N 2.81Å; N224-A226 PolarHBondContact O-N 3.39Å
225	G	60.8	Low	82.8	Confident	28 Å²	28	48.5 Å²	48.5	29%	0.289	30%	0.303	S	S	.	.			trans	-67.9	28.1	-176.3	0	0	0	0	0	117.5	R218	R218-G225 PolarHBondContact NE-O 3.16Å
226	A	63.6	Low	83.2	Confident	69 Å²	69	46.7 Å²	46.7	57%	0.57	29%	0.292	S	S	*	.			trans	-94.5	160.3	176.3	0	0	0	0	0	111.8	N224 K228	N224-A226 PolarHBondContact O-N 3.39Å; A226-K228 VanDerWaalsContact C-N 3.27Å; A226-K228 PolarHBondContact O-N 3.02Å
227	G	75.6	Confident	83.5	Confident	78 Å²	78	46.7 Å²	46.7	80%	0.804	29%	0.292	S	S	*	.	S	Bend	trans	77.8	-8.1	172.5	0	0	0	0	0	117.2
228	K	86.1	Confident	83.8	Confident	28 Å²	28	46.7 Å²	46.7	12%	0.122	29%	0.292	C	S	.	.			trans	-58.7	139.7	177.9	-51.8	-67.2	-176.3	149.4	0	111.8	K214 N215 C217 R218 D222 A226 R633	K214-K228 WeakPolarHBondContact O-CD 3.35Å; K214-K228 PolarHBondContact O-NZ 3.06Å; N215-K228 CarbonylContact O-C 3.12Å; N215-K228 WeakPolarHBondContact O-CA 3.12Å; N215-K228 WeakPolarHBondContact O-CB 3.45Å; C217-K228 WeakPolarHBondContact O-CD 3.34Å; C217-K228 WeakPolarHBondContact O-CE 3.33Å; C217-K228 PolarHBondContact O-NZ 2.94Å; R218-K228 HydrophobicContact CG-CG 4.12Å; D222-K228 IonicContact OD1-NZ 2.65Å; D222-K228 WeakPolarHBondContact OD2-CE 3.41Å; D222-K228 IonicContact OD2-NZ 3.27Å; D222-K228 PolarHBondContact OD2-NZ 3.03Å; A226-K228 VanDerWaalsContact C-N 3.27Å; A226-K228 PolarHBondContact O-N 3.02Å; K228-R633 PolarHBondContact O-NH1 3.03Å; K228-R633 PolarHBondContact O-NH2 3.21Å
229	V	88.7	Confident	84.1	Confident	57 Å²	57	41.4 Å²	41.4	35%	0.345	27%	0.272	S	S	.	.			trans	-112.4	157.4	-177.8	-65	0	0	0	0	112.3	N215 T216 K233 S234 R633	N215-V229 HydrophobicContact CB-CG2 4.38Å; N215-V229 PolarHBondContact O-N 2.92Å; T216-V229 WeakPolarHBondContact CA-O 3.34Å; V229-K233 HydrophobicContact CB-CB 4.24Å; V229-S234 WeakPolarHBondContact CG2-OG 3.37Å; V229-R633 PolarHBondContact O-NH2 3.16Å
230	L	89.6	Confident	84.4	Confident	24 Å²	24	39.5 Å²	39.5	13%	0.126	26%	0.263	C	S	.	.			trans	-66.5	155.1	176.7	-68.1	173.2	0	0	0	110.9	D232 K233 M631	L230-D232 VanDerWaalsContact C-N 3.32Å; L230-D232 WeakPolarHBondContact CB-OD1 3.42Å; L230-D232 PolarHBondContact O-N 3.24Å; L230-K233 PolarHBondContact O-N 3.22Å; L230-K233 VanDerWaalsContact O-N 3.08Å; L230-M631 HydrophobicContact CD1-CE 3.68Å; L230-M631 HydrophobicContact CD1-SD 4.28Å
231	P	92.3	Very high	84.6	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.019	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-55.9	-43	-177.6	-27.8	36.4	0	0	0	114	T216 K233 S234 I235 F624 T627 Y628	T216-P231 HydrophobicContact CG2-CG 4.47Å; P231-K233 PolarHBondContact O-N 2.94Å; P231-S234 WeakPolarHBondContact O-CB 3.39Å; P231-S234 PolarHBondContact O-N 3.01Å; P231-I235 PolarHBondContact O-N 2.92Å; P231-F624 HydrophobicContact CB-CE2 3.75Å; P231-F624 HydrophobicContact CB-CZ 3.96Å; P231-F624 HydrophobicContact CG-CD2 4.41Å; P231-F624 HydrophobicContact CG-CE2 3.78Å; P231-F624 HydrophobicContact CG-CZ 4.37Å; P231-T627 WeakPolarHBondContact CG-OG1 3.46Å; P231-Y628 HydrophobicContact CB-CD1 4.41Å; P231-Y628 HydrophobicContact CB-CE1 3.78Å; P231-Y628 HydrophobicContact CB-CE2 3.95Å; P231-Y628 HydrophobicContact CG-CD1 4.46Å; P231-Y628 HydrophobicContact CG-CD2 4.2Å; P231-Y628 HydrophobicContact CG-CE1 4.28Å; P231-Y628 HydrophobicContact CG-CE2 4.01Å; P231-Y628 HydrophobicContact CG-CG 4.42Å
232	D	93.4	Very high	84.9	Confident	12 Å²	12	37.8 Å²	37.8	6%	0.064	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-61.4	-21.2	176.6	54.8	13.7	0	0	0	114.7	L230 L523 F524 H549	L230-D232 VanDerWaalsContact C-N 3.32Å; L230-D232 WeakPolarHBondContact CB-OD1 3.42Å; L230-D232 PolarHBondContact O-N 3.24Å; D232-L523 HydrophobicContact CB-CB 4.34Å; D232-L523 HydrophobicContact CB-CD2 4.29Å; D232-L523 HydrophobicContact CB-CG 4.27Å; D232-L523 WeakPolarHBondContact O-CB 3.5Å; D232-L523 PolarHBondContact O-N 3.41Å; D232-F524 HydrophobicContact CB-CB 4.04Å; D232-F524 PolarHBondContact O-N 3.15Å; D232-H549 IonicContact OD2-CE1 3.28Å
233	K	94	Very high	84.9	Confident	85 Å²	85	37.3 Å²	37.3	37%	0.37	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-84.5	-11.9	172.7	-65.6	-174.2	-178.9	-167	0	113.4	V229 L230 P231 H236 F524	V229-K233 HydrophobicContact CB-CB 4.24Å; L230-K233 PolarHBondContact O-N 3.22Å; L230-K233 VanDerWaalsContact O-N 3.08Å; P231-K233 PolarHBondContact O-N 2.94Å; K233-H236 PolarHBondContact O-CE1 2.98Å; K233-F524 HydrophobicContact CD-CD1 4.43Å; K233-F524 HydrophobicContact CD-CD2 4.29Å; K233-F524 HydrophobicContact CD-CG 4.16Å; K233-F524 VanDerWaalsContact CE-CE1 3.48Å; K233-F524 VanDerWaalsContact CE-CZ 3.45Å; K233-F524 HydrophobicContact CG-CB 3.55Å; K233-F524 HydrophobicContact CG-CD1 4.27Å; K233-F524 HydrophobicContact CG-CD2 4.03Å; K233-F524 HydrophobicContact CG-CG 3.68Å; K233-F524 VanDerWaalsContact NZ-CZ 3.32Å
234	S	93.5	Very high	85.3	Confident	9 Å²	9	40 Å²	40	6%	0.063	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-33.4	177.9	-54.9	0	0	0	0	111.9	P207 L212 V229 P231 H236	P207-S234 WeakPolarHBondContact CD-O 3.38Å; L212-S234 VanDerWaalsContact CD1-CB 3.42Å; V229-S234 WeakPolarHBondContact CG2-OG 3.37Å; P231-S234 WeakPolarHBondContact O-CB 3.39Å; P231-S234 PolarHBondContact O-N 3.01Å; S234-H236 PolarHBondContact O-ND1 3.38Å
235	I	95.5	Very high	85.9	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	23%	0.231	C	C	.	.			trans	-81.8	134.5	175.6	-56.5	168.6	0	0	0	109.3	L164 M204 P231 F237 S522 L523 F548 L552	L164-I235 HydrophobicContact CD1-CD1 4Å; L164-I235 HydrophobicContact CD2-CD1 3.71Å; L164-I235 HydrophobicContact CD2-CG1 4.23Å; M204-I235 HydrophobicContact CG-CG2 4.08Å; M204-I235 HydrophobicContact SD-CG2 4.09Å; P231-I235 PolarHBondContact O-N 2.92Å; I235-F237 HydrophobicContact CG2-CE2 4.27Å; I235-S522 WeakPolarHBondContact O-CA 3.32Å; I235-L523 HydrophobicContact CB-CB 4.44Å; I235-L523 PolarHBondContact O-N 3.42Å; I235-F548 HydrophobicContact CG2-CE1 4.14Å; I235-L552 HydrophobicContact CD1-CD1 3.53Å
236	H	96.3	Very high	86.9	Confident	32 Å²	32	38.2 Å²	38.2	15%	0.148	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	159.6	179.6	-63	68.6	0	0	0	111.3	M204 A205 K233 S234 R520 V521	M204-H236 WeakPolarHBondContact CA-O 3.17Å; A205-H236 HydrophobicContact CB-CB 4.16Å; A205-H236 PolarHBondContact N-O 2.91Å; A205-H236 PolarHBondContact O-N 3.01Å; K233-H236 PolarHBondContact O-CE1 2.98Å; S234-H236 PolarHBondContact O-ND1 3.38Å; H236-R520 HydrophobicContact CB-CG 3.93Å; H236-R520 PolarHBondContact CD2-NE 2.93Å; H236-R520 PolarHBondContact NE2-NH2 3.44Å; H236-R520 VanDerWaalsContact NE2-NH2 3.16Å; H236-V521 CarbonylContact C-O 3.49Å; H236-V521 WeakPolarHBondContact CA-O 3.32Å; H236-V521 WeakPolarHBondContact CB-O 3.34Å
237	F	97	Very high	88.1	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	148.2	170.5	-69.8	-83.7	0	0	0	111.1	M202 L203 M204 I235 R520 V521 L523 L526 F544 F548	M202-F237 HydrophobicContact CB-CD1 3.95Å; M202-F237 HydrophobicContact CB-CE1 4.25Å; M202-F237 HydrophobicContact CE-CB 3.88Å; M202-F237 HydrophobicContact CE-CD1 4.19Å; M202-F237 HydrophobicContact CE-CG 3.99Å; L203-F237 WeakPolarHBondContact O-CA 3.32Å; M204-F237 HydrophobicContact CB-CD1 4.24Å; M204-F237 HydrophobicContact CB-CE1 3.83Å; M204-F237 HydrophobicContact CB-CZ 4.46Å; M204-F237 HydrophobicContact CG-CE1 4.28Å; M204-F237 HydrophobicContact CG-CZ 4.44Å; I235-F237 HydrophobicContact CG2-CE2 4.27Å; F237-R520 WeakPolarHBondContact O-CA 3.45Å; F237-V521 PolarHBondContact N-O 3.26Å; F237-V521 PolarHBondContact O-N 2.95Å; F237-L523 HydrophobicContact CE2-CD1 4.33Å; F237-L526 HydrophobicContact CB-CD1 4.15Å; F237-L526 HydrophobicContact CD2-CD1 4.05Å; F237-L526 HydrophobicContact CG-CD1 4.46Å; F237-F544 HydrophobicContact CD1-CE1 4.08Å; F237-F544 HydrophobicContact CD1-CZ 4.42Å; F237-F544 HydrophobicContact CD2-CE1 4.44Å; F237-F544 AromaticContact CE1-CE1 3.7Å; F237-F544 HydrophobicContact CE1-CE1 3.7Å; F237-F544 AromaticContact CE1-CZ 3.8Å; F237-F544 HydrophobicContact CE1-CZ 3.8Å; F237-F544 HydrophobicContact CE2-CE1 4.1Å; F237-F544 HydrophobicContact CG-CE1 4.43Å; F237-F544 AromaticContact CZ-CE1 3.71Å; F237-F544 HydrophobicContact CZ-CE1 3.71Å; F237-F544 HydrophobicContact CZ-CZ 4.04Å; F237-F548 AromaticContact CE2-CD1 3.92Å; F237-F548 HydrophobicContact CE2-CD1 3.92Å; F237-F548 HydrophobicContact CE2-CE1 4.02Å; F237-F548 HydrophobicContact CE2-CG 4.36Å; F237-F548 AromaticContact CZ-CD1 3.7Å; F237-F548 HydrophobicContact CZ-CD1 3.7Å; F237-F548 AromaticContact CZ-CD2 3.95Å; F237-F548 HydrophobicContact CZ-CD2 3.95Å; F237-F548 AromaticContact CZ-CE1 3.62Å; F237-F548 HydrophobicContact CZ-CE1 3.62Å; F237-F548 AromaticContact CZ-CE2 3.9Å; F237-F548 HydrophobicContact CZ-CE2 3.9Å; F237-F548 AromaticContact CZ-CG 3.86Å; F237-F548 HydrophobicContact CZ-CG 3.86Å; F237-F548 AromaticContact CZ-CZ 3.74Å; F237-F548 HydrophobicContact CZ-CZ 3.74Å
238	L	96.5	Very high	88.9	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	118	165.4	-172.6	73.2	0	0	0	108.9	Y170 V172 L203 L250 F278 I505 C518	Y170-L238 HydrophobicContact CD2-CB 4.39Å; V172-L238 HydrophobicContact CG2-CD1 3.51Å; L203-L238 HydrophobicContact CB-CB 4.12Å; L203-L238 HydrophobicContact CD1-CD2 4.26Å; L203-L238 PolarHBondContact O-N 3.4Å; L238-L250 HydrophobicContact CD2-CD1 3.76Å; L238-L250 HydrophobicContact CG-CD1 3.85Å; L238-F278 HydrophobicContact CD2-CZ 4.05Å; L238-I505 HydrophobicContact CD1-CG1 4.42Å; L238-I505 HydrophobicContact CD2-CD1 3.75Å; L238-I505 HydrophobicContact CD2-CG1 3.84Å; L238-I505 HydrophobicContact CD2-CG2 4.28Å; L238-C518 HydrophobicContact CD1-CB 4.18Å
239	V	95.4	Very high	89.3	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	151.3	175.3	-66	0	0	0	0	110.1	M202 T247 C518 H519 V521 V541	M202-V239 HydrophobicContact CE-CG1 3.92Å; M202-V239 HydrophobicContact SD-CG1 4.29Å; V239-T247 HydrophobicContact CG2-CG2 3.94Å; V239-C518 CarbonylContact O-C 3.52Å; V239-C518 WeakPolarHBondContact O-CA 3.5Å; V239-H519 HydrophobicContact CG2-CB 4.31Å; V239-H519 WeakPolarHBondContact CG2-O 3.25Å; V239-H519 PolarHBondContact N-O 3.41Å; V239-H519 PolarHBondContact O-N 3.16Å; V239-V521 HydrophobicContact CG2-CB 4.21Å; V239-V521 HydrophobicContact CG2-CG2 3.59Å; V239-V541 HydrophobicContact CG1-CG1 4.36Å
240	G	93	Very high	89.6	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	168.6	167.8	0	0	0	0	0	111.2	M248 D517	G240-M248 VanDerWaalsContact C-CG 3.48Å; G240-M248 PolarHBondContact N-O 2.88Å; G240-M248 WeakPolarHBondContact O-CG 3.43Å; G240-M248 PolarHBondContact O-N 2.79Å; G240-D517 WeakPolarHBondContact CA-O 3.18Å
241	G	89	Confident	89.8	Confident	3 Å²	3	27.4 Å²	27.4	3%	0.031	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.4	-173.7	173.2	0	0	0	0	0	113	E246 D517	G241-E246 WeakPolarHBondContact CA-O 3.42Å; G241-D517 PolarHBondContact N-O 3.44Å; G241-D517 PolarHBondContact O-N 2.85Å
242	R	82.2	Confident	89.9	Confident	69 Å²	69	27.3 Å²	27.3	26%	0.26	14%	0.141	S	C	.	.	S	Bend	trans	-108.5	-20.8	164.8	-71	164.1	159.5	-172.6	-4.8	112.4	E246 E316 R515	R242-E246 WeakPolarHBondContact CD-OE2 3.4Å; R242-E316 VanDerWaalsContact CZ-CD 3.49Å; R242-E316 IonicContact CZ-OE1 2.81Å; R242-E316 IonicContact CZ-OE2 3.89Å; R242-E316 IonicContact NH1-OE1 3.15Å; R242-E316 PolarHBondContact NH1-OE1 3.4Å; R242-E316 IonicContact NH1-OE2 3.26Å; R242-E316 PolarHBondContact NH1-OE2 3.45Å; R242-E316 IonicContact NH2-OE1 2.67Å; R242-E316 PolarHBondContact NH2-OE1 2.92Å; R242-E316 IonicContact NH2-OE2 3.34Å; R242-R515 HydrophobicContact CG-CB 4.17Å
243	A	76.4	Confident	90	Very high	44 Å²	44	26.9 Å²	26.9	36%	0.364	14%	0.139	S	C	.	.	S	Bend	trans	-154.9	166	176.6	0	0	0	0	0	108.8	S245 E246 H519	A243-S245 PolarHBondContact O-N 3.43Å; A243-S245 VanDerWaalsContact O-N 3.11Å; A243-E246 PolarHBondContact O-N 2.94Å; A243-E246 VanDerWaalsContact O-N 3.12Å; A243-H519 VanDerWaalsContact C-NE2 3.34Å
244	K	72.3	Confident	90.1	Very high	166 Å²	166	23.9 Å²	23.9	72%	0.722	13%	0.125	S	C	*	.	S	Bend	trans	-66.9	-11.9	-175.8	-67	-177.9	179.3	-176.1	0	115.6	H519	K244-H519 WeakPolarHBondContact CG-NE2 3.21Å; K244-H519 PolarHBondContact N-NE2 3.22Å
245	S	73.4	Confident	90.2	Very high	79 Å²	79	23.4 Å²	23.4	55%	0.552	12%	0.122	S	C	*	.	S	Bend	trans	-90.1	-36	171.5	49.3	0	0	0	0	112.9	A243 T247	A243-S245 PolarHBondContact O-N 3.43Å; A243-S245 VanDerWaalsContact O-N 3.11Å; S245-T247 PolarHBondContact O-N 2.74Å; S245-T247 VanDerWaalsContact O-N 3.08Å
246	E	80.7	Confident	90.1	Very high	45 Å²	45	25.6 Å²	25.6	21%	0.21	14%	0.136	C	C	.	.	S	Bend	trans	-86	78.8	179.7	-170.4	177.9	-177.6	0	0	110	G241 R242 A243 K535	G241-E246 WeakPolarHBondContact CA-O 3.42Å; R242-E246 WeakPolarHBondContact CD-OE2 3.4Å; A243-E246 PolarHBondContact O-N 2.94Å; A243-E246 VanDerWaalsContact O-N 3.12Å; E246-K535 HydrophobicContact CG-CD 4.36Å; E246-K535 WeakPolarHBondContact OE1-CD 3.43Å; E246-K535 IonicContact OE1-NZ 3.21Å; E246-K535 PolarHBondContact OE1-NZ 3.43Å; E246-K535 IonicContact OE2-NZ 2.7Å
247	T	89.1	Confident	90	Very high	18 Å²	18	28 Å²	28	11%	0.11	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	121.9	-176.4	61.7	0	0	0	0	112.3	V239 S245 V521 L526 N538	V239-T247 HydrophobicContact CG2-CG2 3.94Å; S245-T247 PolarHBondContact O-N 2.74Å; S245-T247 VanDerWaalsContact O-N 3.08Å; T247-V521 HydrophobicContact CG2-CG2 4.39Å; T247-L526 HydrophobicContact CG2-CD2 4.4Å; T247-N538 PolarHBondContact O-OD1 2.76Å
248	M	92.3	Very high	89.8	Confident	10 Å²	10	32.5 Å²	32.5	5%	0.049	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	144.8	177.4	59.7	164.5	-72.9	0	0	112.1	G240 F311 K512 F516 H537	G240-M248 VanDerWaalsContact C-CG 3.48Å; G240-M248 PolarHBondContact N-O 2.88Å; G240-M248 WeakPolarHBondContact O-CG 3.43Å; G240-M248 PolarHBondContact O-N 2.79Å; M248-F311 HydrophobicContact CE-CE1 3.65Å; M248-F311 HydrophobicContact CE-CZ 4.21Å; M248-K512 HydrophobicContact SD-CD 4.14Å; M248-F516 HydrophobicContact SD-CE2 4.45Å; M248-H537 HydrophobicContact CB-CB 3.76Å
249	A	95.1	Very high	89.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.181	C	C	.	.			trans	-69.6	135.8	172.9	0	0	0	0	0	110.2	R200 M202 F330 V541	R200-A249 HydrophobicContact CB-CB 3.91Å; R200-A249 HydrophobicContact CG-CB 4.23Å; M202-A249 HydrophobicContact SD-CB 3.79Å; A249-F330 HydrophobicContact CB-CE1 3.54Å; A249-F330 HydrophobicContact CB-CZ 3.62Å; A249-V541 HydrophobicContact CB-CG2 3.96Å
250	L	95	Very high	89.6	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	132.5	-176.6	-65.9	170.3	0	0	0	110.3	R200 V201 L238 F278 L281 T282 F516	R200-L250 CarbonylContact C-O 3.59Å; R200-L250 WeakPolarHBondContact CA-O 3.44Å; V201-L250 PolarHBondContact N-O 2.78Å; L238-L250 HydrophobicContact CD2-CD1 3.76Å; L238-L250 HydrophobicContact CG-CD1 3.85Å; L250-F278 HydrophobicContact CB-CD2 3.67Å; L250-F278 HydrophobicContact CB-CE2 3.73Å; L250-F278 HydrophobicContact CD1-CD2 4.17Å; L250-F278 HydrophobicContact CD1-CE2 3.41Å; L250-F278 VanDerWaalsContact CD1-CE2 3.41Å; L250-F278 HydrophobicContact CD1-CZ 3.96Å; L250-F278 HydrophobicContact CG-CE2 4.2Å; L250-L281 HydrophobicContact CB-CD1 4.49Å; L250-L281 HydrophobicContact CD2-CD1 4Å; L250-T282 HydrophobicContact CD1-CG2 4.04Å; L250-T282 HydrophobicContact CD2-CG2 4.4Å; L250-F516 HydrophobicContact CD2-CE2 4.25Å; L250-F516 HydrophobicContact CD2-CZ 3.6Å
251	G	94.4	Very high	89.6	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.4	-157.6	-177.6	0	0	0	0	0	112.7	A199 T277 F311	A199-G251 VanDerWaalsContact O-CA 3.31Å; A199-G251 WeakPolarHBondContact O-CA 3.32Å; G251-T277 VanDerWaalsContact CA-OG1 3.32Å; G251-T277 WeakPolarHBondContact CA-OG1 3.42Å; G251-F311 VanDerWaalsContact O-CD1 3.31Å; G251-F311 WeakPolarHBondContact O-CD1 3.32Å; G251-F311 WeakPolarHBondContact O-CE1 3.24Å
252	G	94	Very high	89.7	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.1	-173.3	-178.1	0	0	0	0	0	114.8	S198 A199 T277	S198-G252 WeakPolarHBondContact CA-O 3.25Å; S198-G252 VanDerWaalsContact CB-O 3.3Å; S198-G252 WeakPolarHBondContact CB-O 3.42Å; A199-G252 PolarHBondContact N-O 3.42Å; A199-G252 PolarHBondContact O-N 2.76Å; G252-T277 PolarHBondContact N-OG1 3.49Å
253	P	95.1	Very high	90.1	Very high	3 Å²	3	39.1 Å²	39.1	2%	0.019	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	154.6	179.9	29.4	-35.7	0	0	0	112.8	A193 D194 Y195 T273 R276 F311	A193-P253 HydrophobicContact CB-CB 4.49Å; A193-P253 HydrophobicContact CB-CG 4.12Å; D194-P253 VanDerWaalsContact O-CB 3.32Å; D194-P253 WeakPolarHBondContact O-CB 3.36Å; Y195-P253 HydrophobicContact CD1-CB 4.13Å; Y195-P253 HydrophobicContact CD2-CB 4.13Å; Y195-P253 HydrophobicContact CE1-CB 4.21Å; Y195-P253 HydrophobicContact CE1-CG 4.2Å; Y195-P253 HydrophobicContact CE2-CB 4.18Å; Y195-P253 HydrophobicContact CE2-CG 4.16Å; Y195-P253 HydrophobicContact CG-CB 4.12Å; P253-T273 WeakPolarHBondContact O-CG2 3.21Å; P253-R276 PolarHBondContact O-NH2 2.94Å; P253-F311 HydrophobicContact CG-CB 4.38Å
254	W	96	Very high	90.6	Very high	21 Å²	21	43.9 Å²	43.9	8%	0.08	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	149.3	175.8	166.2	53.4	0	0	0	112	A193 D194 Y197 P256 G260 P263 T269 L270 T273	A193-W254 WeakPolarHBondContact CA-O 3.43Å; D194-W254 HydrophobicContact CB-CE3 3.9Å; D194-W254 HydrophobicContact CB-CZ3 4.22Å; D194-W254 PolarHBondContact N-O 2.96Å; D194-W254 PolarHBondContact O-N 3.15Å; D194-W254 VanDerWaalsContact O-N 3.16Å; D194-W254 WeakPolarHBondContact OD2-CZ3 3.19Å; Y197-W254 WeakPolarHBondContact O-CB 3.19Å; Y197-W254 PolarHBondContact O-N 3.06Å; Y197-W254 VanDerWaalsContact O-N 3.09Å; W254-P256 HydrophobicContact CD2-CG 4.48Å; W254-P256 HydrophobicContact CH2-CB 4.35Å; W254-P256 HydrophobicContact CH2-CG 3.77Å; W254-P256 HydrophobicContact CZ2-CB 3.9Å; W254-P256 HydrophobicContact CZ2-CG 3.67Å; W254-P256 HydrophobicContact CZ3-CG 4.21Å; W254-G260 VanDerWaalsContact CZ2-O 3.29Å; W254-G260 WeakPolarHBondContact CZ2-O 3.47Å; W254-G260 PolarHBondContact NE1-O 2.92Å; W254-P263 HydrophobicContact CD2-CB 4.11Å; W254-P263 HydrophobicContact CD2-CG 4.03Å; W254-P263 HydrophobicContact CE3-CB 4.38Å; W254-P263 HydrophobicContact CE3-CG 3.87Å; W254-P263 HydrophobicContact CG-CB 4.43Å; W254-P263 HydrophobicContact CH2-CG 3.94Å; W254-P263 HydrophobicContact CZ2-CG 4.1Å; W254-P263 HydrophobicContact CZ3-CG 3.83Å; W254-T269 VanDerWaalsContact NE1-CG2 3.25Å; W254-L270 HydrophobicContact CB-CD2 4.43Å; W254-T273 HydrophobicContact CB-CG2 4.27Å
255	S	95	Very high	91.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	24%	0.239	C	C	.	.			trans	-126	114	171.9	164.5	0	0	0	0	109.3	D192 S257 L258 D259	D192-S255 VanDerWaalsContact CG-OG 3.32Å; D192-S255 WeakPolarHBondContact OD1-CB 3.39Å; D192-S255 PolarHBondContact OD1-OG 3.38Å; D192-S255 PolarHBondContact OD2-OG 2.9Å; S255-S257 VanDerWaalsContact C-N 3.26Å; S255-S257 PolarHBondContact O-N 3.06Å; S255-S257 PolarHBondContact OG-OG 3.28Å; S255-L258 PolarHBondContact O-N 3.25Å; S255-L258 WeakPolarHBondContact OG-CG 3.33Å; S255-L258 PolarHBondContact OG-N 3.21Å; S255-D259 PolarHBondContact N-OD2 3.05Å; S255-D259 VanDerWaalsContact O-CB 3.31Å; S255-D259 WeakPolarHBondContact O-CB 3.42Å; S255-D259 PolarHBondContact O-N 3.36Å
256	P	94.4	Very high	91.9	Very high	46 Å²	46	38.3 Å²	38.3	30%	0.299	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-38	177.6	-26.2	32.5	0	0	0	113.9	D192 W254 G260	D192-P256 VanDerWaalsContact O-CD 3.25Å; D192-P256 WeakPolarHBondContact O-CD 3.21Å; D192-P256 WeakPolarHBondContact OD2-CD 3.32Å; W254-P256 HydrophobicContact CD2-CG 4.48Å; W254-P256 HydrophobicContact CH2-CB 4.35Å; W254-P256 HydrophobicContact CH2-CG 3.77Å; W254-P256 HydrophobicContact CZ2-CB 3.9Å; W254-P256 HydrophobicContact CZ2-CG 3.67Å; W254-P256 HydrophobicContact CZ3-CG 4.21Å; P256-G260 CarbonylContact O-C 3.4Å; P256-G260 VanDerWaalsContact O-C 3.28Å; P256-G260 VanDerWaalsContact O-CA 3.26Å; P256-G260 WeakPolarHBondContact O-CA 3.44Å; P256-G260 PolarHBondContact O-N 2.88Å
257	S	94	Very high	92.2	Very high	83 Å²	83	38.3 Å²	38.3	58%	0.58	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-37.8	-177.7	62.1	0	0	0	0	114.1	D192 S255	D192-S257 VanDerWaalsContact CG-OG 3.25Å; D192-S257 PolarHBondContact OD1-OG 3.2Å; D192-S257 WeakPolarHBondContact OD2-CB 3.43Å; D192-S257 PolarHBondContact OD2-N 2.87Å; D192-S257 PolarHBondContact OD2-OG 3.43Å; S255-S257 VanDerWaalsContact C-N 3.26Å; S255-S257 PolarHBondContact O-N 3.06Å; S255-S257 PolarHBondContact OG-OG 3.28Å
258	L	93	Very high	92.3	Very high	94 Å²	94	40.8 Å²	40.8	49%	0.492	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-39.4	-177.6	-59.6	-178.5	0	0	0	112.7	P190 S255	P190-L258 HydrophobicContact CB-CD1 3.83Å; S255-L258 PolarHBondContact O-N 3.25Å; S255-L258 WeakPolarHBondContact OG-CG 3.33Å; S255-L258 PolarHBondContact OG-N 3.21Å
259	D	94.4	Very high	92.4	Very high	3 Å²	3	40.5 Å²	40.5	2%	0.016	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-35.1	-173.3	-50.4	-46.2	0	0	0	111.6	S255 T269 K272 T273 R276	S255-D259 PolarHBondContact N-OD2 3.05Å; S255-D259 VanDerWaalsContact O-CB 3.31Å; S255-D259 WeakPolarHBondContact O-CB 3.42Å; S255-D259 PolarHBondContact O-N 3.36Å; D259-T269 HydrophobicContact CB-CG2 4.2Å; D259-K272 HydrophobicContact CB-CB 4.06Å; D259-K272 WeakPolarHBondContact O-CD 3.4Å; D259-K272 PolarHBondContact O-NZ 3.42Å; D259-T273 WeakPolarHBondContact OD1-CA 3.23Å; D259-T273 PolarHBondContact OD1-N 3.37Å; D259-T273 PolarHBondContact OD2-OG1 3.46Å; D259-T273 VanDerWaalsContact OD2-OG1 3.07Å; D259-R276 IonicContact OD1-CZ 2.7Å; D259-R276 IonicContact OD1-NE 2.61Å; D259-R276 PolarHBondContact OD1-NE 3Å; D259-R276 IonicContact OD1-NH2 3.08Å; D259-R276 IonicContact OD2-CZ 2.82Å; D259-R276 IonicContact OD2-NE 3.87Å; D259-R276 PolarHBondContact OD2-NE 3.43Å; D259-R276 IonicContact OD2-NH2 3.71Å; D259-R276 PolarHBondContact OD2-NH2 3.06Å
260	G	93.1	Very high	92.3	Very high	13 Å²	13	40.5 Å²	40.5	13%	0.134	24%	0.244	C	C	.	.			trans	122.8	166.9	-178.7	0	0	0	0	0	112.7	W254 P256 D262 T269	W254-G260 VanDerWaalsContact CZ2-O 3.29Å; W254-G260 WeakPolarHBondContact CZ2-O 3.47Å; W254-G260 PolarHBondContact NE1-O 2.92Å; P256-G260 CarbonylContact O-C 3.4Å; P256-G260 VanDerWaalsContact O-C 3.28Å; P256-G260 VanDerWaalsContact O-CA 3.26Å; P256-G260 WeakPolarHBondContact O-CA 3.44Å; P256-G260 PolarHBondContact O-N 2.88Å; G260-D262 PolarHBondContact O-N 2.92Å; G260-T269 WeakPolarHBondContact O-CG2 3.41Å
261	P	92.4	Very high	92.3	Very high	116 Å²	116	40.5 Å²	40.5	75%	0.753	24%	0.244	S	C	*	.	S	Bend	trans	-85.4	-9.3	-161	32.9	-38.3	0	0	0	116.5
262	D	90.5	Very high	92.4	Very high	67 Å²	67	45 Å²	45	36%	0.358	26%	0.264	S	S	.	.			trans	-127.8	98.2	-174.1	172.9	24.1	0	0	0	111.5	G260 Q264 G265 N266 T269	G260-D262 PolarHBondContact O-N 2.92Å; D262-Q264 PolarHBondContact OD1-N 3.22Å; D262-G265 PolarHBondContact OD1-N 2.85Å; D262-G265 WeakPolarHBondContact OD2-CA 3.36Å; D262-G265 PolarHBondContact OD2-N 2.97Å; D262-N266 HydrophobicContact CB-CB 4.45Å; D262-N266 PolarHBondContact OD2-N 2.76Å; D262-T269 WeakPolarHBondContact O-CB 3.42Å; D262-T269 PolarHBondContact O-OG1 2.91Å
263	P	91	Very high	92.5	Very high	11 Å²	11	45 Å²	45	7%	0.071	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-14.4	177.2	33.3	-35.4	0	0	0	113.6	Y197 W254 T269 L270	Y197-P263 HydrophobicContact CD1-CB 4.21Å; Y197-P263 HydrophobicContact CD2-CB 3.8Å; Y197-P263 HydrophobicContact CD2-CG 3.35Å; Y197-P263 HydrophobicContact CE2-CB 4.37Å; Y197-P263 HydrophobicContact CE2-CG 3.74Å; Y197-P263 HydrophobicContact CG-CB 3.71Å; Y197-P263 HydrophobicContact CG-CG 3.84Å; W254-P263 HydrophobicContact CD2-CB 4.11Å; W254-P263 HydrophobicContact CD2-CG 4.03Å; W254-P263 HydrophobicContact CE3-CB 4.38Å; W254-P263 HydrophobicContact CE3-CG 3.87Å; W254-P263 HydrophobicContact CG-CB 4.43Å; W254-P263 HydrophobicContact CH2-CG 3.94Å; W254-P263 HydrophobicContact CZ2-CG 4.1Å; W254-P263 HydrophobicContact CZ3-CG 3.83Å; P263-T269 HydrophobicContact CB-CG2 4.32Å; P263-L270 HydrophobicContact CB-CD1 4.44Å; P263-L270 HydrophobicContact CB-CD2 3.67Å; P263-L270 HydrophobicContact CB-CG 4.02Å; P263-L270 WeakPolarHBondContact O-CD1 3.44Å
264	Q	88	Confident	92.5	Very high	144 Å²	144	44.8 Å²	44.8	67%	0.673	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-48.9	-171.3	-172.4	172.5	-5.2	0	0	112.3	Y197 D262	Y197-Q264 HydrophobicContact CE2-CB 4.47Å; Y197-Q264 WeakPolarHBondContact OH-CB 3.47Å; Y197-Q264 VanDerWaalsContact OH-CD 3.31Å; Y197-Q264 WeakPolarHBondContact OH-CG 3.49Å; Y197-Q264 PolarHBondContact OH-OE1 2.91Å; D262-Q264 PolarHBondContact OD1-N 3.22Å
265	G	83.4	Confident	92.5	Very high	58 Å²	58	45.1 Å²	45.1	60%	0.598	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-35.9	179	0	0	0	0	0	113.3	D262 P267	D262-G265 PolarHBondContact OD1-N 2.85Å; D262-G265 WeakPolarHBondContact OD2-CA 3.36Å; D262-G265 PolarHBondContact OD2-N 2.97Å; G265-P267 WeakPolarHBondContact O-CD 3.21Å
266	N	88	Confident	92.5	Very high	71 Å²	71	46 Å²	46	38%	0.38	27%	0.268	S	S	.	.			trans	-103.8	106.8	-177.8	-172.7	0.4	0	0	0	112.8	D262 M268 T269	D262-N266 HydrophobicContact CB-CB 4.45Å; D262-N266 PolarHBondContact OD2-N 2.76Å; N266-M268 PolarHBondContact O-N 3.1Å; N266-M268 VanDerWaalsContact O-N 3.15Å; N266-M268 WeakPolarHBondContact OD1-CB 3.29Å; N266-M268 PolarHBondContact OD1-N 2.94Å; N266-M268 VanDerWaalsContact OD1-N 3.07Å; N266-T269 WeakPolarHBondContact O-CB 3.48Å; N266-T269 PolarHBondContact O-N 2.75Å; N266-T269 PolarHBondContact O-OG1 2.86Å
267	P	87.4	Confident	92.5	Very high	45 Å²	45	43.9 Å²	43.9	29%	0.292	26%	0.255	S	S	.	.	H	α-helix	trans	-62.9	-23.7	179.3	25.2	-33.7	0	0	0	113.7	G265 T269 L270 I271 I726	G265-P267 WeakPolarHBondContact O-CD 3.21Å; P267-T269 PolarHBondContact O-N 3.47Å; P267-L270 PolarHBondContact O-N 2.68Å; P267-I271 WeakPolarHBondContact O-CG1 3.44Å; P267-I271 PolarHBondContact O-N 3.27Å; P267-I271 VanDerWaalsContact O-N 3.11Å; P267-I726 HydrophobicContact CB-CD1 3.86Å; P267-I726 HydrophobicContact CB-CG1 4.48Å; P267-I726 HydrophobicContact CB-CG2 4.44Å; P267-I726 HydrophobicContact CG-CG2 4.47Å
268	M	90.9	Very high	92.5	Very high	70 Å²	70	39.9 Å²	39.9	35%	0.345	23%	0.227	S	C	.	.	H	α-helix	trans	-62.3	-29	177.5	-73.7	-60.5	-60.9	0	0	113.1	N266 I271 K272 L728	N266-M268 PolarHBondContact O-N 3.1Å; N266-M268 VanDerWaalsContact O-N 3.15Å; N266-M268 WeakPolarHBondContact OD1-CB 3.29Å; N266-M268 PolarHBondContact OD1-N 2.94Å; N266-M268 VanDerWaalsContact OD1-N 3.07Å; M268-I271 PolarHBondContact O-N 3.02Å; M268-I271 HydrophobicContact SD-CD1 4.48Å; M268-K272 WeakPolarHBondContact O-CB 3.43Å; M268-K272 WeakPolarHBondContact O-CG 3.43Å; M268-K272 PolarHBondContact O-N 2.91Å; M268-L728 HydrophobicContact CE-CD1 4.34Å; M268-L728 HydrophobicContact SD-CD1 4.01Å; M268-L728 HydrophobicContact SD-CD2 3.37Å; M268-L728 WeakPolarHBondContact SD-CD2 3.32Å; M268-L728 HydrophobicContact SD-CG 4.31Å
269	T	94.1	Very high	92.6	Very high	3 Å²	3	39.2 Å²	39.2	2%	0.018	22%	0.22	C	C	.	.	H	α-helix	trans	-64.4	-46.9	179.8	-52.7	0	0	0	0	110.8	W254 D259 G260 D262 P263 N266 P267 K272 T273	W254-T269 VanDerWaalsContact NE1-CG2 3.25Å; D259-T269 HydrophobicContact CB-CG2 4.2Å; G260-T269 WeakPolarHBondContact O-CG2 3.41Å; D262-T269 WeakPolarHBondContact O-CB 3.42Å; D262-T269 PolarHBondContact O-OG1 2.91Å; P263-T269 HydrophobicContact CB-CG2 4.32Å; N266-T269 WeakPolarHBondContact O-CB 3.48Å; N266-T269 PolarHBondContact O-N 2.75Å; N266-T269 PolarHBondContact O-OG1 2.86Å; P267-T269 PolarHBondContact O-N 3.47Å; T269-K272 PolarHBondContact O-N 3.41Å; T269-T273 PolarHBondContact O-N 3.48Å; T269-T273 PolarHBondContact O-OG1 2.99Å
270	L	94.9	Very high	92.5	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-76.1	-27.1	177.7	-62.9	-175.1	0	0	0	113	Y197 A199 W254 P263 P267 T273 A274 V329 F331	Y197-L270 HydrophobicContact CD1-CD1 3.93Å; A199-L270 HydrophobicContact CB-CB 4.39Å; A199-L270 VanDerWaalsContact CB-O 3.31Å; A199-L270 WeakPolarHBondContact CB-O 3.47Å; W254-L270 HydrophobicContact CB-CD2 4.43Å; P263-L270 HydrophobicContact CB-CD1 4.44Å; P263-L270 HydrophobicContact CB-CD2 3.67Å; P263-L270 HydrophobicContact CB-CG 4.02Å; P263-L270 WeakPolarHBondContact O-CD1 3.44Å; P267-L270 PolarHBondContact O-N 2.68Å; L270-T273 WeakPolarHBondContact O-CB 3.39Å; L270-T273 PolarHBondContact O-N 2.99Å; L270-A274 WeakPolarHBondContact O-CB 3.39Å; L270-A274 PolarHBondContact O-N 3.42Å; L270-V329 HydrophobicContact CD1-CB 4.15Å; L270-V329 HydrophobicContact CD1-CG1 4.49Å; L270-V329 HydrophobicContact CD1-CG2 3.71Å; L270-F331 HydrophobicContact CB-CE2 3.87Å; L270-F331 HydrophobicContact CB-CZ 3.9Å
271	I	94.8	Very high	92.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66.7	-41.1	169.5	-70.3	161	0	0	0	111.1	P267 M268 A274 I275 W292 F331 I726 L728	P267-I271 WeakPolarHBondContact O-CG1 3.44Å; P267-I271 PolarHBondContact O-N 3.27Å; P267-I271 VanDerWaalsContact O-N 3.11Å; M268-I271 PolarHBondContact O-N 3.02Å; M268-I271 HydrophobicContact SD-CD1 4.48Å; I271-A274 WeakPolarHBondContact O-CB 3.46Å; I271-A274 PolarHBondContact O-N 2.81Å; I271-I275 HydrophobicContact CG2-CD1 3.79Å; I271-I275 HydrophobicContact CG2-CG1 4.47Å; I271-I275 WeakPolarHBondContact O-CD1 3.07Å; I271-I275 VanDerWaalsContact O-CG1 3.26Å; I271-I275 WeakPolarHBondContact O-CG1 3.4Å; I271-I275 PolarHBondContact O-N 2.83Å; I271-W292 HydrophobicContact CB-CD2 4.45Å; I271-W292 HydrophobicContact CB-CE3 4.48Å; I271-W292 HydrophobicContact CD1-CB 3.88Å; I271-W292 HydrophobicContact CD1-CD2 4.42Å; I271-W292 HydrophobicContact CD1-CG 4Å; I271-W292 HydrophobicContact CG1-CB 4.24Å; I271-W292 HydrophobicContact CG1-CD2 3.99Å; I271-W292 HydrophobicContact CG1-CE3 3.98Å; I271-W292 HydrophobicContact CG1-CG 4.1Å; I271-W292 HydrophobicContact CG2-CD2 3.71Å; I271-W292 HydrophobicContact CG2-CE3 4.04Å; I271-W292 HydrophobicContact CG2-CG 4.19Å; I271-W292 HydrophobicContact CG2-CH2 4.28Å; I271-W292 HydrophobicContact CG2-CZ2 3.93Å; I271-W292 HydrophobicContact CG2-CZ3 4.32Å; I271-F331 HydrophobicContact CG1-CD1 4.36Å; I271-F331 HydrophobicContact CG1-CE1 3.9Å; I271-F331 HydrophobicContact CG1-CZ 4.2Å; I271-I726 HydrophobicContact CD1-CD1 4.45Å; I271-I726 HydrophobicContact CD1-CG2 3.8Å; I271-L728 HydrophobicContact CD1-CD2 4.2Å; I271-L728 HydrophobicContact CG2-CD1 4.27Å
272	K	95.3	Very high	92.5	Very high	96 Å²	96	33.1 Å²	33.1	42%	0.417	18%	0.178	S	C	.	.	H	α-helix	trans	-63.8	-43.4	171.8	-74.9	169	171.6	-169.2	0	112.2	D259 M268 T269 A274 I275 R276	D259-K272 HydrophobicContact CB-CB 4.06Å; D259-K272 WeakPolarHBondContact O-CD 3.4Å; D259-K272 PolarHBondContact O-NZ 3.42Å; M268-K272 WeakPolarHBondContact O-CB 3.43Å; M268-K272 WeakPolarHBondContact O-CG 3.43Å; M268-K272 PolarHBondContact O-N 2.91Å; T269-K272 PolarHBondContact O-N 3.41Å; K272-A274 VanDerWaalsContact C-N 3.26Å; K272-A274 PolarHBondContact O-N 2.89Å; K272-I275 PolarHBondContact O-N 2.89Å; K272-I275 VanDerWaalsContact O-N 3.13Å; K272-R276 WeakPolarHBondContact O-CB 3.48Å; K272-R276 PolarHBondContact O-N 2.59Å
273	T	95.9	Very high	92.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-53.1	-47.4	173.2	-53.9	0	0	0	0	110.4	A199 P253 W254 D259 T269 L270 T277	A199-T273 HydrophobicContact CB-CG2 3.8Å; P253-T273 WeakPolarHBondContact O-CG2 3.21Å; W254-T273 HydrophobicContact CB-CG2 4.27Å; D259-T273 WeakPolarHBondContact OD1-CA 3.23Å; D259-T273 PolarHBondContact OD1-N 3.37Å; D259-T273 PolarHBondContact OD2-OG1 3.46Å; D259-T273 VanDerWaalsContact OD2-OG1 3.07Å; T269-T273 PolarHBondContact O-N 3.48Å; T269-T273 PolarHBondContact O-OG1 2.99Å; L270-T273 WeakPolarHBondContact O-CB 3.39Å; L270-T273 PolarHBondContact O-N 2.99Å; T273-T277 WeakPolarHBondContact O-CB 3.26Å; T273-T277 WeakPolarHBondContact O-CG2 3.03Å; T273-T277 PolarHBondContact O-N 2.91Å; T273-T277 PolarHBondContact O-OG1 3.03Å
274	A	95.9	Very high	92.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61	-50.1	175.7	0	0	0	0	0	111.9	A199 V201 L270 I271 K272 R276 T277 F278 W292 F331	A199-A274 HydrophobicContact CB-CB 3.99Å; V201-A274 HydrophobicContact CG2-CB 3.66Å; L270-A274 WeakPolarHBondContact O-CB 3.39Å; L270-A274 PolarHBondContact O-N 3.42Å; I271-A274 WeakPolarHBondContact O-CB 3.46Å; I271-A274 PolarHBondContact O-N 2.81Å; K272-A274 VanDerWaalsContact C-N 3.26Å; K272-A274 PolarHBondContact O-N 2.89Å; A274-R276 PolarHBondContact O-N 3.02Å; A274-T277 PolarHBondContact O-OG1 3.07Å; A274-F278 WeakPolarHBondContact O-CB 3.36Å; A274-F278 PolarHBondContact O-N 3.05Å; A274-W292 HydrophobicContact CB-CH2 4.27Å; A274-W292 HydrophobicContact CB-CZ3 3.86Å; A274-F331 HydrophobicContact CB-CD2 4.5Å
275	I	95.4	Very high	92.8	Very high	27 Å²	27	28.4 Å²	28.4	14%	0.138	17%	0.166	C	C	.	.	H	α-helix	trans	-58.7	-49.5	178.6	-66.9	157.6	0	0	0	111.2	I271 K272 K279 L286 W292	I271-I275 HydrophobicContact CG2-CD1 3.79Å; I271-I275 HydrophobicContact CG2-CG1 4.47Å; I271-I275 WeakPolarHBondContact O-CD1 3.07Å; I271-I275 VanDerWaalsContact O-CG1 3.26Å; I271-I275 WeakPolarHBondContact O-CG1 3.4Å; I271-I275 PolarHBondContact O-N 2.83Å; K272-I275 PolarHBondContact O-N 2.89Å; K272-I275 VanDerWaalsContact O-N 3.13Å; I275-K279 WeakPolarHBondContact O-CB 3.41Å; I275-K279 PolarHBondContact O-N 2.87Å; I275-L286 HydrophobicContact CG1-CB 4.13Å; I275-W292 HydrophobicContact CD1-CZ2 4.09Å; I275-W292 HydrophobicContact CG1-CH2 3.84Å; I275-W292 HydrophobicContact CG1-CZ2 3.78Å
276	R	95.3	Very high	93.3	Very high	18 Å²	18	25.6 Å²	25.6	7%	0.068	14%	0.138	C	C	.	.	H	α-helix	trans	-58.2	-56.3	-179.6	173.7	177.4	58.9	80	-3.6	111.5	L187 P253 D259 K272 A274 K279 G280	L187-R276 HydrophobicContact CB-CG 4.08Å; L187-R276 HydrophobicContact CD2-CG 4.34Å; L187-R276 WeakPolarHBondContact O-CG 3.28Å; L187-R276 PolarHBondContact O-NH1 3.42Å; P253-R276 PolarHBondContact O-NH2 2.94Å; D259-R276 IonicContact OD1-CZ 2.7Å; D259-R276 IonicContact OD1-NE 2.61Å; D259-R276 PolarHBondContact OD1-NE 3Å; D259-R276 IonicContact OD1-NH2 3.08Å; D259-R276 IonicContact OD2-CZ 2.82Å; D259-R276 IonicContact OD2-NE 3.87Å; D259-R276 PolarHBondContact OD2-NE 3.43Å; D259-R276 IonicContact OD2-NH2 3.71Å; D259-R276 PolarHBondContact OD2-NH2 3.06Å; K272-R276 WeakPolarHBondContact O-CB 3.48Å; K272-R276 PolarHBondContact O-N 2.59Å; A274-R276 PolarHBondContact O-N 3.02Å; R276-K279 PolarHBondContact O-N 3.36Å; R276-G280 PolarHBondContact O-N 2.91Å
277	T	94.3	Very high	93.5	Very high	2 Å²	2	26 Å²	26	1%	0.012	15%	0.146	C	C	.	.	H	α-helix	trans	-69.5	-38.5	-175.3	55.6	0	0	0	0	111.8	G251 G252 T273 A274 G280 L281	G251-T277 VanDerWaalsContact CA-OG1 3.32Å; G251-T277 WeakPolarHBondContact CA-OG1 3.42Å; G252-T277 PolarHBondContact N-OG1 3.49Å; T273-T277 WeakPolarHBondContact O-CB 3.26Å; T273-T277 WeakPolarHBondContact O-CG2 3.03Å; T273-T277 PolarHBondContact O-N 2.91Å; T273-T277 PolarHBondContact O-OG1 3.03Å; A274-T277 PolarHBondContact O-OG1 3.07Å; T277-G280 PolarHBondContact O-N 2.7Å; T277-L281 WeakPolarHBondContact O-CG 3.18Å; T277-L281 PolarHBondContact O-N 2.87Å; T277-L281 VanDerWaalsContact O-N 3.07Å
278	F	95	Very high	93.6	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.1	-43.2	175.1	-167.9	-84.3	0	0	0	112.3	V201 L203 L238 L250 A274 L281 T282 L284 L286	V201-F278 HydrophobicContact CB-CD2 3.65Å; V201-F278 HydrophobicContact CB-CE2 4.02Å; V201-F278 HydrophobicContact CG1-CD2 3.76Å; V201-F278 HydrophobicContact CG1-CE2 3.76Å; V201-F278 HydrophobicContact CG2-CB 4.46Å; V201-F278 HydrophobicContact CG2-CD2 4.01Å; L203-F278 HydrophobicContact CD1-CE1 4.07Å; L203-F278 HydrophobicContact CD1-CE2 4.17Å; L203-F278 HydrophobicContact CD1-CZ 3.41Å; L203-F278 VanDerWaalsContact CD1-CZ 3.41Å; L203-F278 HydrophobicContact CG-CE2 4.21Å; L203-F278 HydrophobicContact CG-CZ 3.94Å; L238-F278 HydrophobicContact CD2-CZ 4.05Å; L250-F278 HydrophobicContact CB-CD2 3.67Å; L250-F278 HydrophobicContact CB-CE2 3.73Å; L250-F278 HydrophobicContact CD1-CD2 4.17Å; L250-F278 HydrophobicContact CD1-CE2 3.41Å; L250-F278 VanDerWaalsContact CD1-CE2 3.41Å; L250-F278 HydrophobicContact CD1-CZ 3.96Å; L250-F278 HydrophobicContact CG-CE2 4.2Å; A274-F278 WeakPolarHBondContact O-CB 3.36Å; A274-F278 PolarHBondContact O-N 3.05Å; F278-L281 PolarHBondContact O-N 3.3Å; F278-T282 HydrophobicContact CD1-CG2 4.3Å; F278-T282 VanDerWaalsContact CD1-OG1 3.25Å; F278-T282 WeakPolarHBondContact CD1-OG1 3.46Å; F278-T282 HydrophobicContact CE1-CG2 3.94Å; F278-T282 WeakPolarHBondContact CE1-OG1 3.37Å; F278-T282 HydrophobicContact CE2-CG2 4.39Å; F278-T282 HydrophobicContact CZ-CG2 3.98Å; F278-T282 WeakPolarHBondContact O-CB 3.44Å; F278-T282 PolarHBondContact O-N 3.24Å; F278-T282 PolarHBondContact O-OG1 3.48Å; F278-L284 HydrophobicContact CE1-CB 4.13Å; F278-L284 HydrophobicContact CE1-CD2 4.15Å; F278-L284 HydrophobicContact CE1-CG 4.46Å; F278-L286 HydrophobicContact CB-CD1 4.23Å; F278-L286 HydrophobicContact CD1-CD1 3.5Å; F278-L286 VanDerWaalsContact CD1-CD1 3.5Å; F278-L286 HydrophobicContact CD1-CG 3.79Å; F278-L286 HydrophobicContact CD2-CD1 4.1Å; F278-L286 HydrophobicContact CE1-CD1 3.82Å; F278-L286 HydrophobicContact CE1-CD2 4.31Å; F278-L286 HydrophobicContact CE1-CG 4.08Å; F278-L286 HydrophobicContact CE2-CD1 4.35Å; F278-L286 HydrophobicContact CG-CD1 3.67Å; F278-L286 HydrophobicContact CG-CG 4.4Å; F278-L286 HydrophobicContact CZ-CD1 4.24Å
279	K	94.5	Very high	93.5	Very high	79 Å²	79	22.8 Å²	22.8	34%	0.343	13%	0.131	S	C	.	.	H	α-helix	trans	-63	-43.6	176.1	-175.9	177.1	-178.7	173.9	0	111.6	L187 I275 R276 L281 T282 G283 L284 D285	L187-K279 HydrophobicContact CD1-CB 4.34Å; L187-K279 HydrophobicContact CD1-CD 4.17Å; L187-K279 HydrophobicContact CD1-CG 4.09Å; I275-K279 WeakPolarHBondContact O-CB 3.41Å; I275-K279 PolarHBondContact O-N 2.87Å; R276-K279 PolarHBondContact O-N 3.36Å; K279-L281 VanDerWaalsContact C-N 3.27Å; K279-L281 PolarHBondContact O-N 3.47Å; K279-T282 PolarHBondContact O-N 2.98Å; K279-G283 WeakPolarHBondContact O-CA 3.49Å; K279-G283 PolarHBondContact O-N 3.23Å; K279-L284 WeakPolarHBondContact CA-O 3.49Å; K279-D285 HydrophobicContact CD-CB 4.2Å; K279-D285 WeakPolarHBondContact CD-OD2 3.42Å; K279-D285 WeakPolarHBondContact CE-OD2 3.45Å; K279-D285 IonicContact NZ-OD2 3.04Å; K279-D285 PolarHBondContact NZ-OD2 3.31Å
280	G	92.6	Very high	93	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-62	-30.3	174.5	0	0	0	0	0	114	R276 T277 N508	R276-G280 PolarHBondContact O-N 2.91Å; T277-G280 PolarHBondContact O-N 2.7Å; G280-N508 VanDerWaalsContact O-CB 3.3Å; G280-N508 WeakPolarHBondContact O-CB 3.25Å; G280-N508 PolarHBondContact O-ND2 3.02Å
281	L	92.7	Very high	92.6	Very high	4 Å²	4	28 Å²	28	2%	0.021	16%	0.161	C	C	.	.	H	α-helix	trans	-85.1	-31	177.4	-71	178.3	0	0	0	114.1	L188 L250 T277 F278 K279 N508 A511 F516	L188-L281 HydrophobicContact CD1-CD2 4.1Å; L188-L281 HydrophobicContact CD2-CD2 3.9Å; L188-L281 HydrophobicContact CD2-CG 3.84Å; L250-L281 HydrophobicContact CB-CD1 4.49Å; L250-L281 HydrophobicContact CD2-CD1 4Å; T277-L281 WeakPolarHBondContact O-CG 3.18Å; T277-L281 PolarHBondContact O-N 2.87Å; T277-L281 VanDerWaalsContact O-N 3.07Å; F278-L281 PolarHBondContact O-N 3.3Å; K279-L281 VanDerWaalsContact C-N 3.27Å; K279-L281 PolarHBondContact O-N 3.47Å; L281-N508 PolarHBondContact O-N 2.79Å; L281-A511 HydrophobicContact CD2-CB 3.95Å; L281-F516 HydrophobicContact CB-CE1 4.03Å; L281-F516 HydrophobicContact CB-CZ 3.98Å; L281-F516 HydrophobicContact CD1-CE2 4.49Å; L281-F516 HydrophobicContact CD1-CZ 4.24Å; L281-F516 HydrophobicContact CD2-CD1 4.47Å; L281-F516 HydrophobicContact CD2-CD2 4.37Å; L281-F516 HydrophobicContact CD2-CE1 4.17Å; L281-F516 HydrophobicContact CD2-CE2 4.05Å; L281-F516 HydrophobicContact CD2-CZ 3.95Å; L281-F516 HydrophobicContact CG-CZ 4.27Å; L281-F516 VanDerWaalsContact O-CE1 3.25Å; L281-F516 WeakPolarHBondContact O-CE1 3.37Å
282	T	93.4	Very high	92.5	Very high	1 Å²	1	28 Å²	28	1%	0.006	16%	0.161	C	C	.	.	H	α-helix	trans	-127.8	-10.2	-164.3	66.6	0	0	0	0	115.9	L250 F278 K279 L284 I505 H506	L250-T282 HydrophobicContact CD1-CG2 4.04Å; L250-T282 HydrophobicContact CD2-CG2 4.4Å; F278-T282 HydrophobicContact CD1-CG2 4.3Å; F278-T282 VanDerWaalsContact CD1-OG1 3.25Å; F278-T282 WeakPolarHBondContact CD1-OG1 3.46Å; F278-T282 HydrophobicContact CE1-CG2 3.94Å; F278-T282 WeakPolarHBondContact CE1-OG1 3.37Å; F278-T282 HydrophobicContact CE2-CG2 4.39Å; F278-T282 HydrophobicContact CZ-CG2 3.98Å; F278-T282 WeakPolarHBondContact O-CB 3.44Å; F278-T282 PolarHBondContact O-N 3.24Å; F278-T282 PolarHBondContact O-OG1 3.48Å; K279-T282 PolarHBondContact O-N 2.98Å; T282-L284 PolarHBondContact O-N 3.01Å; T282-L284 VanDerWaalsContact O-N 3.14Å; T282-L284 PolarHBondContact OG1-N 3.4Å; T282-I505 HydrophobicContact CG2-CG2 4.36Å; T282-H506 CarbonylContact C-O 3.58Å; T282-H506 VanDerWaalsContact CA-O 3.28Å; T282-H506 WeakPolarHBondContact CA-O 3.42Å; T282-H506 PolarHBondContact O-N 2.85Å
283	G	90.2	Very high	92.3	Very high	41 Å²	41	23.8 Å²	23.8	42%	0.423	14%	0.143	S	C	.	.	S	Bend	trans	72.6	-12	-171.3	0	0	0	0	0	115.1	L183 K279	L183-G283 VanDerWaalsContact CD2-CA 3.49Å; L183-G283 VanDerWaalsContact CD2-N 3.29Å; K279-G283 WeakPolarHBondContact O-CA 3.49Å; K279-G283 PolarHBondContact O-N 3.23Å
284	L	92.5	Very high	92.2	Very high	28 Å²	28	25.5 Å²	25.5	15%	0.147	15%	0.149	C	C	.	.			trans	-84.5	128.6	-178	179.6	66.2	0	0	0	111.2	L203 F278 K279 T282 L286 L338 I503 I505	L203-L284 HydrophobicContact CD1-CD2 4.31Å; F278-L284 HydrophobicContact CE1-CB 4.13Å; F278-L284 HydrophobicContact CE1-CD2 4.15Å; F278-L284 HydrophobicContact CE1-CG 4.46Å; K279-L284 WeakPolarHBondContact CA-O 3.49Å; T282-L284 PolarHBondContact O-N 3.01Å; T282-L284 VanDerWaalsContact O-N 3.14Å; T282-L284 PolarHBondContact OG1-N 3.4Å; L284-L286 HydrophobicContact CD2-CD2 3.93Å; L284-L286 HydrophobicContact CG-CD2 4.15Å; L284-L338 HydrophobicContact CD1-CD1 4.48Å; L284-L338 HydrophobicContact CD2-CD1 4.47Å; L284-I503 HydrophobicContact CD1-CG2 4.16Å; L284-I503 HydrophobicContact CD2-CG2 3.59Å; L284-I505 HydrophobicContact CB-CD1 4.15Å; L284-I505 HydrophobicContact CD2-CD1 3.73Å
285	D	92.9	Very high	92.2	Very high	53 Å²	53	25.5 Å²	25.5	28%	0.283	15%	0.149	S	C	.	.			trans	-93.4	113.2	178.8	-161.7	-39.6	0	0	0	111.6	K279 S287	K279-D285 HydrophobicContact CD-CB 4.2Å; K279-D285 WeakPolarHBondContact CD-OD2 3.42Å; K279-D285 WeakPolarHBondContact CE-OD2 3.45Å; K279-D285 IonicContact NZ-OD2 3.04Å; K279-D285 PolarHBondContact NZ-OD2 3.31Å; D285-S287 WeakPolarHBondContact OD1-CB 3.25Å; D285-S287 PolarHBondContact OD1-N 3.3Å; D285-S287 PolarHBondContact OD1-OG 3.11Å
286	L	93.8	Very high	92.2	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.142	C	C	.	.			trans	-89.7	3.8	-179.6	-60.3	-179.1	0	0	0	113.8	V201 L203 I275 F278 L284 S288 C289 W292 P333 L338	V201-L286 HydrophobicContact CG1-CD1 4.02Å; L203-L286 HydrophobicContact CD1-CD2 4.49Å; I275-L286 HydrophobicContact CG1-CB 4.13Å; F278-L286 HydrophobicContact CB-CD1 4.23Å; F278-L286 HydrophobicContact CD1-CD1 3.5Å; F278-L286 VanDerWaalsContact CD1-CD1 3.5Å; F278-L286 HydrophobicContact CD1-CG 3.79Å; F278-L286 HydrophobicContact CD2-CD1 4.1Å; F278-L286 HydrophobicContact CE1-CD1 3.82Å; F278-L286 HydrophobicContact CE1-CD2 4.31Å; F278-L286 HydrophobicContact CE1-CG 4.08Å; F278-L286 HydrophobicContact CE2-CD1 4.35Å; F278-L286 HydrophobicContact CG-CD1 3.67Å; F278-L286 HydrophobicContact CG-CG 4.4Å; F278-L286 HydrophobicContact CZ-CD1 4.24Å; L284-L286 HydrophobicContact CD2-CD2 3.93Å; L284-L286 HydrophobicContact CG-CD2 4.15Å; L286-S288 PolarHBondContact O-N 2.95Å; L286-S288 VanDerWaalsContact O-N 3.08Å; L286-C289 WeakPolarHBondContact O-CB 3.49Å; L286-C289 PolarHBondContact O-N 2.88Å; L286-W292 HydrophobicContact CB-CH2 4.03Å; L286-W292 HydrophobicContact CB-CZ2 3.98Å; L286-W292 HydrophobicContact CD1-CH2 4.17Å; L286-P333 HydrophobicContact CD1-CG 4.21Å; L286-L338 HydrophobicContact CD2-CD1 3.97Å
287	S	91.5	Very high	92.3	Very high	80 Å²	80	24.7 Å²	24.7	56%	0.559	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-18.6	-179.6	58.7	0	0	0	0	114.8	D285	D285-S287 WeakPolarHBondContact OD1-CB 3.25Å; D285-S287 PolarHBondContact OD1-N 3.3Å; D285-S287 PolarHBondContact OD1-OG 3.11Å
288	S	89.9	Confident	92.5	Very high	44 Å²	44	24.6 Å²	24.6	31%	0.308	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-9.9	175.6	70.9	0	0	0	0	114.7	L286 T290 H337 L338	L286-S288 PolarHBondContact O-N 2.95Å; L286-S288 VanDerWaalsContact O-N 3.08Å; S288-T290 PolarHBondContact O-N 2.78Å; S288-H337 PolarHBondContact O-NE2 2.98Å; S288-H337 PolarHBondContact OG-NE2 2.89Å; S288-L338 WeakPolarHBondContact OG-CD2 3.48Å
289	C	88.9	Confident	92.5	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.014	15%	0.153	C	C	.	.			trans	-72.1	117.3	179.6	-68.2	0	0	0	0	111	L286 W292 P333 N334	L286-C289 WeakPolarHBondContact O-CB 3.49Å; L286-C289 PolarHBondContact O-N 2.88Å; C289-W292 HydrophobicContact CB-CZ2 4.06Å; C289-W292 PolarHBondContact O-NE1 2.71Å; C289-P333 HydrophobicContact CB-CB 4.22Å; C289-N334 PolarHBondContact SG-O 3.23Å
290	T	82.2	Confident	92.6	Very high	71 Å²	71	22.6 Å²	22.6	44%	0.436	14%	0.136	S	C	.	.			trans	-92.3	-12.4	-175.7	53.1	0	0	0	0	114.8	S288 L728	S288-T290 PolarHBondContact O-N 2.78Å; T290-L728 PolarHBondContact O-N 2.81Å
291	E	87.5	Confident	92.8	Very high	42 Å²	42	27 Å²	27	20%	0.196	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	122	176.9	-179.4	-175.6	-156.8	0	0	108.8	N334 R725	E291-N334 HydrophobicContact CB-CB 3.88Å; E291-N334 HydrophobicContact CG-CB 4.46Å; E291-N334 PolarHBondContact O-N 2.76Å; E291-N334 PolarHBondContact OE2-ND2 3.06Å; E291-R725 VanDerWaalsContact OE1-CD 3.3Å; E291-R725 WeakPolarHBondContact OE1-CD 3.21Å; E291-R725 IonicContact OE1-CZ 3.91Å; E291-R725 IonicContact OE1-NE 2.93Å; E291-R725 IonicContact OE1-NH1 3.64Å; E291-R725 PolarHBondContact OE1-NH1 2.74Å
292	W	92.1	Very high	92.9	Very high	1 Å²	1	27 Å²	27	0%	0.004	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	129.8	177.9	-72	73.4	0	0	0	109.8	I271 A274 I275 L286 C289 F331 P333 I726 L728	I271-W292 HydrophobicContact CB-CD2 4.45Å; I271-W292 HydrophobicContact CB-CE3 4.48Å; I271-W292 HydrophobicContact CD1-CB 3.88Å; I271-W292 HydrophobicContact CD1-CD2 4.42Å; I271-W292 HydrophobicContact CD1-CG 4Å; I271-W292 HydrophobicContact CG1-CB 4.24Å; I271-W292 HydrophobicContact CG1-CD2 3.99Å; I271-W292 HydrophobicContact CG1-CE3 3.98Å; I271-W292 HydrophobicContact CG1-CG 4.1Å; I271-W292 HydrophobicContact CG2-CD2 3.71Å; I271-W292 HydrophobicContact CG2-CE3 4.04Å; I271-W292 HydrophobicContact CG2-CG 4.19Å; I271-W292 HydrophobicContact CG2-CH2 4.28Å; I271-W292 HydrophobicContact CG2-CZ2 3.93Å; I271-W292 HydrophobicContact CG2-CZ3 4.32Å; A274-W292 HydrophobicContact CB-CH2 4.27Å; A274-W292 HydrophobicContact CB-CZ3 3.86Å; I275-W292 HydrophobicContact CD1-CZ2 4.09Å; I275-W292 HydrophobicContact CG1-CH2 3.84Å; I275-W292 HydrophobicContact CG1-CZ2 3.78Å; L286-W292 HydrophobicContact CB-CH2 4.03Å; L286-W292 HydrophobicContact CB-CZ2 3.98Å; L286-W292 HydrophobicContact CD1-CH2 4.17Å; C289-W292 HydrophobicContact CB-CZ2 4.06Å; C289-W292 PolarHBondContact O-NE1 2.71Å; W292-F331 HydrophobicContact CE3-CB 3.89Å; W292-F331 HydrophobicContact CE3-CD1 4.12Å; W292-F331 HydrophobicContact CE3-CG 4.09Å; W292-F331 HydrophobicContact CZ3-CB 4.14Å; W292-P333 HydrophobicContact CD2-CB 3.75Å; W292-P333 HydrophobicContact CE3-CB 3.78Å; W292-P333 HydrophobicContact CE3-CG 4.35Å; W292-P333 HydrophobicContact CG-CB 4.41Å; W292-P333 HydrophobicContact CH2-CB 3.88Å; W292-P333 HydrophobicContact CH2-CG 4.09Å; W292-P333 HydrophobicContact CZ2-CB 3.86Å; W292-P333 HydrophobicContact CZ3-CB 3.84Å; W292-P333 HydrophobicContact CZ3-CG 4.01Å; W292-I726 HydrophobicContact CB-CB 4.44Å; W292-I726 PolarHBondContact N-O 3.49Å; W292-I726 WeakPolarHBondContact O-CA 3.31Å; W292-I726 VanDerWaalsContact O-CB 3.32Å; W292-I726 WeakPolarHBondContact O-CB 3.45Å; W292-I726 PolarHBondContact O-N 3Å; W292-L728 HydrophobicContact CG-CD1 4.48Å
293	V	92.3	Very high	92.9	Very high	6 Å²	6	31.5 Å²	31.5	4%	0.036	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	112.8	179.4	177.1	0	0	0	0	108.1	F156 F295 F331 I332	F156-V293 HydrophobicContact CE1-CG2 4.42Å; F156-V293 HydrophobicContact CE2-CG1 3.63Å; F156-V293 HydrophobicContact CZ-CB 4.28Å; F156-V293 HydrophobicContact CZ-CG1 3.62Å; F156-V293 HydrophobicContact CZ-CG2 3.71Å; V293-F295 HydrophobicContact CG1-CB 4.49Å; V293-F295 PolarHBondContact O-N 3.26Å; V293-F295 VanDerWaalsContact O-N 3.13Å; V293-F331 CarbonylContact O-C 3.28Å; V293-F331 VanDerWaalsContact O-CA 3.25Å; V293-F331 WeakPolarHBondContact O-CA 3.43Å; V293-I332 HydrophobicContact CB-CB 4.31Å; V293-I332 WeakPolarHBondContact CB-O 3.45Å; V293-I332 PolarHBondContact N-O 3.47Å; V293-I332 PolarHBondContact O-N 2.97Å
294	R	93.5	Very high	92.9	Very high	36 Å²	36	32.4 Å²	32.4	14%	0.136	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	95.8	169.6	-163.1	-179.2	178.1	122.6	-8.4	106.7	L151 E297 V329 F331 I726	L151-R294 WeakPolarHBondContact CB-O 3.47Å; L151-R294 HydrophobicContact CD1-CB 4.31Å; L151-R294 HydrophobicContact CD1-CG 3.69Å; R294-E297 IonicContact CZ-OE1 2.61Å; R294-E297 IonicContact NE-OE1 2.96Å; R294-E297 PolarHBondContact NE-OE1 3.34Å; R294-E297 IonicContact NH2-OE1 2.72Å; R294-E297 PolarHBondContact NH2-OE1 3.31Å; R294-V329 HydrophobicContact CG-CG1 3.54Å; R294-F331 HydrophobicContact CB-CD1 4.3Å; R294-F331 HydrophobicContact CB-CE1 3.92Å; R294-F331 HydrophobicContact CG-CE1 3.97Å; R294-F331 HydrophobicContact CG-CZ 4.25Å; R294-I726 HydrophobicContact CB-CD1 3.89Å
295	F	95.4	Very high	92.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	-46	-163.4	-177.4	-94.1	0	0	0	112.6	L151 W152 V293 F330 I332 F544 Q547 F548 M551	L151-F295 CarbonylContact C-O 3.48Å; L151-F295 PolarHBondContact N-O 3.2Å; W152-F295 HydrophobicContact CB-CD2 3.53Å; W152-F295 HydrophobicContact CB-CE2 3.41Å; W152-F295 VanDerWaalsContact CB-CE2 3.41Å; W152-F295 HydrophobicContact CB-CG 4.2Å; W152-F295 HydrophobicContact CB-CZ 4Å; W152-F295 AromaticContact CD1-CE1 3.75Å; W152-F295 AromaticContact CD1-CE2 3.89Å; W152-F295 AromaticContact CD1-CZ 3.53Å; W152-F295 HydrophobicContact CG-CD2 4.2Å; W152-F295 HydrophobicContact CG-CE1 4.38Å; W152-F295 AromaticContact CG-CE2 3.7Å; W152-F295 HydrophobicContact CG-CE2 3.7Å; W152-F295 AromaticContact CG-CZ 3.78Å; W152-F295 HydrophobicContact CG-CZ 3.78Å; W152-F295 PolarHBondContact N-O 2.87Å; V293-F295 HydrophobicContact CG1-CB 4.49Å; V293-F295 PolarHBondContact O-N 3.26Å; V293-F295 VanDerWaalsContact O-N 3.13Å; F295-F330 PolarHBondContact N-O 2.95Å; F295-I332 HydrophobicContact CB-CD1 4.21Å; F295-I332 HydrophobicContact CB-CG1 4.18Å; F295-I332 HydrophobicContact CD2-CD1 3.49Å; F295-I332 VanDerWaalsContact CD2-CD1 3.49Å; F295-I332 HydrophobicContact CD2-CG1 4.36Å; F295-I332 HydrophobicContact CE2-CD1 4.07Å; F295-I332 HydrophobicContact CG-CD1 3.88Å; F295-I332 HydrophobicContact CG-CG1 4.36Å; F295-F544 HydrophobicContact CB-CE2 4.42Å; F295-F544 AromaticContact CD1-CD2 3.53Å; F295-F544 HydrophobicContact CD1-CD2 3.53Å; F295-F544 AromaticContact CD1-CE2 3.45Å; F295-F544 HydrophobicContact CD1-CE2 3.45Å; F295-F544 VanDerWaalsContact CD1-CE2 3.45Å; F295-F544 AromaticContact CE1-CD2 3.81Å; F295-F544 HydrophobicContact CE1-CD2 3.81Å; F295-F544 AromaticContact CE1-CE2 3.83Å; F295-F544 HydrophobicContact CE1-CE2 3.83Å; F295-F544 HydrophobicContact CG-CD2 4.4Å; F295-F544 AromaticContact CG-CE2 3.9Å; F295-F544 HydrophobicContact CG-CE2 3.9Å; F295-Q547 HydrophobicContact CE1-CB 3.9Å; F295-Q547 HydrophobicContact CZ-CB 4.22Å; F295-F548 HydrophobicContact CE1-CB 4.46Å; F295-F548 AromaticContact CE2-CD2 3.9Å; F295-F548 HydrophobicContact CE2-CD2 3.9Å; F295-F548 HydrophobicContact CZ-CB 3.94Å; F295-F548 HydrophobicContact CZ-CD2 4.03Å; F295-F548 HydrophobicContact CZ-CG 4.48Å; F295-M551 HydrophobicContact CE2-CE 4.11Å; F295-M551 HydrophobicContact CE2-SD 3.9Å
296	M	96.3	Very high	92.5	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	160.8	177.9	64.4	-173.3	-71.4	0	0	110.9	C148 T149 L298 F330 L543 F544	C148-M296 WeakPolarHBondContact SG-CE 3.44Å; T149-M296 CarbonylContact O-C 3.55Å; T149-M296 VanDerWaalsContact O-CA 3.24Å; T149-M296 WeakPolarHBondContact O-CA 3.47Å; M296-L298 HydrophobicContact CE-CD1 3.65Å; M296-L298 HydrophobicContact CE-CD2 4.32Å; M296-L298 HydrophobicContact CE-CG 3.9Å; M296-L298 HydrophobicContact CG-CD1 4.38Å; M296-L298 HydrophobicContact SD-CD1 4.48Å; M296-F330 HydrophobicContact CG-CB 3.66Å; M296-F330 HydrophobicContact CG-CD2 4.18Å; M296-F330 HydrophobicContact CG-CG 4Å; M296-F330 PolarHBondContact O-N 3.07Å; M296-F330 HydrophobicContact SD-CG 4.41Å; M296-L543 HydrophobicContact CE-CB 4.27Å; M296-L543 HydrophobicContact CE-CD2 3.83Å; M296-L543 HydrophobicContact CE-CG 3.69Å; M296-F544 VanDerWaalsContact SD-CA 3.55Å; M296-F544 HydrophobicContact SD-CB 3.77Å; M296-F544 HydrophobicContact SD-CD2 3.97Å; M296-F544 HydrophobicContact SD-CG 4.36Å
297	E	96.6	Very high	92.2	Very high	28 Å²	28	43.1 Å²	43.1	13%	0.131	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	140.1	170.1	-48.8	-172.4	153	0	0	109.5	C148 T149 L151 R294 V327 V328 V329	C148-E297 CarbonylContact C-O 3.55Å; C148-E297 VanDerWaalsContact CA-O 3.22Å; C148-E297 WeakPolarHBondContact CA-O 3.26Å; C148-E297 PolarHBondContact SG-O 2.75Å; T149-E297 PolarHBondContact N-O 2.84Å; T149-E297 PolarHBondContact O-N 2.93Å; L151-E297 HydrophobicContact CD1-CG 3.66Å; L151-E297 HydrophobicContact CG-CG 4.4Å; R294-E297 IonicContact CZ-OE1 2.61Å; R294-E297 IonicContact NE-OE1 2.96Å; R294-E297 PolarHBondContact NE-OE1 3.34Å; R294-E297 IonicContact NH2-OE1 2.72Å; R294-E297 PolarHBondContact NH2-OE1 3.31Å; E297-V327 HydrophobicContact CB-CG1 4.33Å; E297-V328 CarbonylContact C-O 3.5Å; E297-V328 WeakPolarHBondContact CA-O 3.43Å; E297-V329 HydrophobicContact CG-CG2 4.41Å
298	L	97.5	Very high	92.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	132.5	168	-55.4	86.1	0	0	0	108	F145 M296 Y300 V327 V328 F330 F539 E540 L543	F145-L298 HydrophobicContact CD2-CB 4.44Å; F145-L298 HydrophobicContact CE2-CB 4.32Å; M296-L298 HydrophobicContact CE-CD1 3.65Å; M296-L298 HydrophobicContact CE-CD2 4.32Å; M296-L298 HydrophobicContact CE-CG 3.9Å; M296-L298 HydrophobicContact CG-CD1 4.38Å; M296-L298 HydrophobicContact SD-CD1 4.48Å; L298-Y300 HydrophobicContact CB-CE2 3.72Å; L298-V327 WeakPolarHBondContact O-CA 3.45Å; L298-V328 HydrophobicContact CB-CB 4.36Å; L298-V328 HydrophobicContact CD1-CB 4.39Å; L298-V328 PolarHBondContact N-O 3.24Å; L298-V328 PolarHBondContact O-N 3.18Å; L298-F330 HydrophobicContact CD1-CD2 3.61Å; L298-F330 HydrophobicContact CD1-CE2 3.59Å; L298-F539 HydrophobicContact CD2-CE1 3.95Å; L298-F539 HydrophobicContact CD2-CZ 4.26Å; L298-E540 HydrophobicContact CD2-CG 4.27Å; L298-L543 HydrophobicContact CD2-CD2 3.94Å; L298-L543 HydrophobicContact CG-CD2 4.44Å
299	K	97.1	Very high	92.1	Very high	38 Å²	38	38.3 Å²	38.3	17%	0.165	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.2	-179	-50.5	180	-160.8	162.6	0	109.6	Y146 E147 T149 E326	Y146-K299 HydrophobicContact CD1-CB 4.28Å; Y146-K299 VanDerWaalsContact CD1-O 3.27Å; Y146-K299 WeakPolarHBondContact CD1-O 3.39Å; Y146-K299 HydrophobicContact CE1-CB 3.6Å; Y146-K299 HydrophobicContact CE2-CB 4.03Å; Y146-K299 HydrophobicContact CE2-CD 4.41Å; Y146-K299 VanDerWaalsContact CZ-CB 3.46Å; Y146-K299 PolarHBondContact N-O 3.49Å; Y146-K299 VanDerWaalsContact N-O 3.09Å; E147-K299 HydrophobicContact CB-CB 4.4Å; E147-K299 HydrophobicContact CB-CD 4.31Å; E147-K299 PolarHBondContact O-N 3.04Å; E147-K299 IonicContact OE1-NZ 3.84Å; E147-K299 PolarHBondContact OE1-NZ 3.42Å; E147-K299 WeakPolarHBondContact OE2-CD 3.3Å; E147-K299 WeakPolarHBondContact OE2-CE 3.24Å; E147-K299 IonicContact OE2-NZ 3.93Å; E147-K299 PolarHBondContact OE2-NZ 3.07Å; T149-K299 WeakPolarHBondContact OG1-CE 3.39Å; T149-K299 PolarHBondContact OG1-NZ 3.37Å; K299-E326 WeakPolarHBondContact CA-O 3.12Å
300	Y	96.6	Very high	91.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	146.5	179.8	-61.1	-94.3	0	0	0	109.3	D144 F145 L298 P325 E326 V328 E536 F539 E540	D144-Y300 HydrophobicContact CB-CD1 4.12Å; D144-Y300 CarbonylContact O-C 3.57Å; D144-Y300 VanDerWaalsContact O-CA 3.29Å; D144-Y300 WeakPolarHBondContact O-CA 2.85Å; F145-Y300 HydrophobicContact CB-CD1 4.06Å; F145-Y300 HydrophobicContact CB-CE1 3.91Å; F145-Y300 HydrophobicContact CD2-CE1 4.5Å; L298-Y300 HydrophobicContact CB-CE2 3.72Å; Y300-P325 CarbonylContact O-C 3.58Å; Y300-P325 WeakPolarHBondContact O-CA 3.46Å; Y300-E326 PolarHBondContact N-O 2.9Å; Y300-E326 PolarHBondContact O-N 3.02Å; Y300-V328 HydrophobicContact CD2-CG2 3.99Å; Y300-V328 HydrophobicContact CE2-CB 4.3Å; Y300-V328 HydrophobicContact CE2-CG2 3.56Å; Y300-E536 VanDerWaalsContact CE1-CD 3.42Å; Y300-E536 HydrophobicContact CE1-CG 3.93Å; Y300-E536 WeakPolarHBondContact CE1-OE2 3.49Å; Y300-F539 HydrophobicContact CE1-CE1 4.25Å; Y300-F539 WeakPolarHBondContact OH-CE1 3.08Å; Y300-E540 WeakPolarHBondContact OH-CG 3.34Å
301	Y	95.7	Very high	91.6	Very high	93 Å²	93	35.8 Å²	35.8	37%	0.365	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	103.9	171.6	-176.2	-97.1	0	0	0	108.2	D144 M303 E323	D144-Y301 PolarHBondContact O-N 3.44Å; Y301-M303 HydrophobicContact CD1-CE 4.33Å; Y301-M303 HydrophobicContact CE1-CE 3.77Å; Y301-M303 HydrophobicContact CE1-SD 3.86Å; Y301-E323 PolarHBondContact OH-OE2 2.88Å
302	R	94.8	Very high	90.6	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.015	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	134.3	-177.5	-53	-57.6	-173.9	-177.2	-2.7	109.6	D144 I320 E323 R324 E326 E536	D144-R302 WeakPolarHBondContact OD2-CD 3.29Å; D144-R302 IonicContact OD2-CZ 2.94Å; D144-R302 IonicContact OD2-NE 3.82Å; D144-R302 IonicContact OD2-NH1 2.7Å; D144-R302 PolarHBondContact OD2-NH1 2.89Å; R302-I320 HydrophobicContact CB-CD1 3.96Å; R302-I320 HydrophobicContact CB-CG1 3.98Å; R302-I320 HydrophobicContact CB-CG2 3.86Å; R302-I320 HydrophobicContact CG-CD1 3.95Å; R302-I320 HydrophobicContact CG-CG1 4.36Å; R302-E323 VanDerWaalsContact O-CA 3.31Å; R302-E323 WeakPolarHBondContact O-CA 3.17Å; R302-R324 HydrophobicContact CB-CG 4.1Å; R302-R324 HydrophobicContact CG-CG 4.35Å; R302-R324 PolarHBondContact N-O 3.42Å; R302-R324 PolarHBondContact O-N 3.12Å; R302-R324 VanDerWaalsContact O-N 3.13Å; R302-E326 VanDerWaalsContact CG-CD 3.47Å; R302-E326 HydrophobicContact CG-CG 3.94Å; R302-E326 WeakPolarHBondContact CG-OE2 3.26Å; R302-E326 IonicContact CZ-OE2 2.69Å; R302-E326 IonicContact NE-OE2 3.49Å; R302-E326 PolarHBondContact NE-OE2 3.2Å; R302-E326 IonicContact NH2-OE2 3.21Å; R302-E326 PolarHBondContact NH2-OE2 2.86Å; R302-E536 IonicContact CZ-OE1 3.71Å; R302-E536 IonicContact CZ-OE2 2.71Å; R302-E536 IonicContact NH1-OE1 3.28Å; R302-E536 PolarHBondContact NH1-OE1 2.93Å; R302-E536 IonicContact NH1-OE2 2.77Å; R302-E536 PolarHBondContact NH1-OE2 3.01Å; R302-E536 IonicContact NH2-OE1 2.78Å; R302-E536 PolarHBondContact NH2-OE1 3.45Å; R302-E536 IonicContact NH2-OE2 3.81Å
303	M	92.5	Very high	89.2	Confident	95 Å²	95	39.9 Å²	39.9	47%	0.468	20%	0.198	S	C	.	.	P	Polyproline II helix	trans	-96.6	154.1	172.4	-74.4	-70.7	-165.9	0	0	110.1	Y301 T306 I320	Y301-M303 HydrophobicContact CD1-CE 4.33Å; Y301-M303 HydrophobicContact CE1-CE 3.77Å; Y301-M303 HydrophobicContact CE1-SD 3.86Å; M303-T306 HydrophobicContact CB-CG2 3.74Å; M303-T306 PolarHBondContact O-N 2.69Å; M303-T306 PolarHBondContact O-OG1 2.81Å; M303-T306 VanDerWaalsContact O-OG1 3.08Å; M303-I320 VanDerWaalsContact O-CB 3.27Å; M303-I320 WeakPolarHBondContact O-CB 3.32Å; M303-I320 WeakPolarHBondContact O-CG2 3.5Å
304	P	91.2	Very high	87.8	Confident	59 Å²	59	44.3 Å²	44.3	38%	0.383	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	152.9	168.3	28	-35.3	0	0	0	111.2	T306 I320	P304-T306 PolarHBondContact O-N 3.2Å; P304-T306 VanDerWaalsContact O-N 3.12Å; P304-I320 WeakPolarHBondContact CA-O 3.36Å
305	D	86.6	Confident	86.7	Confident	140 Å²	140	48.1 Å²	48.1	75%	0.749	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	12.5	-179.3	-47	-29.3	0	0	0	114.6	I320	D305-I320 PolarHBondContact N-O 2.78Å
306	T	89.6	Confident	85.8	Confident	39 Å²	39	52.9 Å²	52.9	24%	0.239	28%	0.277	C	S	.	.			trans	-94.8	169.3	167	78.8	0	0	0	0	111.9	M303 P304 I320	M303-T306 HydrophobicContact CB-CG2 3.74Å; M303-T306 PolarHBondContact O-N 2.69Å; M303-T306 PolarHBondContact O-OG1 2.81Å; M303-T306 VanDerWaalsContact O-OG1 3.08Å; P304-T306 PolarHBondContact O-N 3.2Å; P304-T306 VanDerWaalsContact O-N 3.12Å; T306-I320 WeakPolarHBondContact O-CG1 3.23Å; T306-I320 PolarHBondContact O-N 2.83Å
307	K	89.2	Confident	85.2	Confident	127 Å²	127	57.8 Å²	57.8	55%	0.552	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	136.9	176.8	-64.2	-162	-176.3	-166.3	0	111.2	E317 R318	K307-E317 HydrophobicContact CB-CB 4.33Å; K307-E317 HydrophobicContact CD-CB 3.91Å; K307-E317 HydrophobicContact CD-CG 4.36Å; K307-E317 WeakPolarHBondContact CD-OE2 3.23Å; K307-E317 WeakPolarHBondContact CE-OE2 3.43Å; K307-E317 IonicContact NZ-OE2 3.95Å; K307-E317 PolarHBondContact NZ-OE2 3.45Å; K307-R318 WeakPolarHBondContact CA-O 3.48Å
308	A	90.6	Very high	84.9	Confident	2 Å²	2	57.9 Å²	57.9	2%	0.017	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	158.3	170.7	0	0	0	0	0	110.5	A310 E317 R318 I320	A308-A310 PolarHBondContact O-N 3.17Å; A308-E317 CarbonylContact O-C 3.58Å; A308-E317 WeakPolarHBondContact O-CA 3.43Å; A308-R318 HydrophobicContact CB-CG 4.4Å; A308-R318 PolarHBondContact N-O 3.13Å; A308-R318 WeakPolarHBondContact O-CG 3.11Å; A308-R318 PolarHBondContact O-N 3.46Å; A308-I320 HydrophobicContact CB-CD1 3.85Å; A308-I320 HydrophobicContact CB-CG1 4.26Å
309	P	87.6	Confident	84.5	Confident	22 Å²	22	64.6 Å²	64.6	14%	0.143	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	140	177	-23.9	34	0	0	0	112.7	R318 E536 H537	P309-R318 PolarHBondContact O-NE 2.91Å; P309-E536 WeakPolarHBondContact CD-OE1 3.42Å; P309-E536 HydrophobicContact CG-CB 3.84Å; P309-E536 HydrophobicContact CG-CG 4.23Å; P309-E536 WeakPolarHBondContact CG-OE1 3.49Å; P309-H537 VanDerWaalsContact CB-CE1 3.49Å; P309-H537 WeakPolarHBondContact CB-CE1 3.17Å
310	A	84.6	Confident	84.2	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.008	32%	0.323	C	S	.	.			trans	-103.7	152.8	170.7	0	0	0	0	0	111.3	A308 E315 E316 R318 K512	A308-A310 PolarHBondContact O-N 3.17Å; A310-E315 WeakPolarHBondContact CB-O 3.21Å; A310-E316 PolarHBondContact N-O 3.46Å; A310-R318 HydrophobicContact CB-CB 4.28Å; A310-R318 HydrophobicContact CB-CG 4.44Å; A310-K512 PolarHBondContact O-NZ 3.48Å
311	F	75.6	Confident	83.8	Confident	19 Å²	19	68.5 Å²	68.5	8%	0.083	36%	0.358	C	S	.	.			trans	-108.3	-2.1	172.7	-82	-94.9	0	0	0	113.4	Y195 M248 G251 P253 H537	Y195-F311 HydrophobicContact CE1-CD2 4.19Å; Y195-F311 PolarHBondContact OH-N 2.89Å; Y195-F311 VanDerWaalsContact OH-N 3.12Å; M248-F311 HydrophobicContact CE-CE1 3.65Å; M248-F311 HydrophobicContact CE-CZ 4.21Å; G251-F311 VanDerWaalsContact O-CD1 3.31Å; G251-F311 WeakPolarHBondContact O-CD1 3.32Å; G251-F311 WeakPolarHBondContact O-CE1 3.24Å; P253-F311 HydrophobicContact CG-CB 4.38Å; F311-H537 AromaticContact CE2-CE1 3.52Å; F311-H537 AromaticContact CE2-NE2 3.88Å; F311-H537 AromaticContact CZ-CE1 3.46Å; F311-H537 VanDerWaalsContact CZ-CE1 3.46Å; F311-H537 WeakPolarHBondContact CZ-CE1 3.4Å; F311-H537 AromaticContact CZ-NE2 3.69Å
312	T	67	Low	83.5	Confident	52 Å²	52	66.5 Å²	66.5	32%	0.319	36%	0.357	S	S	.	.	S	Bend	trans	-71.6	162.3	177.5	47.4	0	0	0	0	112.4	N189	N189-T312 WeakPolarHBondContact OD1-CA 3.2Å
313	E	61.9	Low	83.4	Confident	76 Å²	76	72.5 Å²	72.5	36%	0.355	39%	0.386	S	S	.	.	S	Bend	trans	-78.7	-23.5	-178.2	-74.5	170.3	-156.4	0	0	114	N189	N189-E313 PolarHBondContact ND2-OE1 2.78Å
314	A	63.4	Low	83.5	Confident	99 Å²	99	71.1 Å²	71.1	82%	0.818	38%	0.375	S	S	*	.	S	Bend	trans	-87.6	-27.8	-174.5	0	0	0	0	0	114.3
315	E	70.5	Confident	83.7	Confident	117 Å²	117	72 Å²	72	55%	0.547	38%	0.381	S	S	.	.			trans	-134.3	139	-168.7	-64.8	178.8	160.2	0	0	110.9	A310	A310-E315 WeakPolarHBondContact CB-O 3.21Å
316	E	76.4	Confident	84.1	Confident	99 Å²	99	65.6 Å²	65.6	46%	0.463	35%	0.346	S	S	.	.	S	Bend	trans	-84.9	-28.1	172.5	-67.2	-174.6	-146.9	0	0	112.2	R242 A310 K535	R242-E316 VanDerWaalsContact CZ-CD 3.49Å; R242-E316 IonicContact CZ-OE1 2.81Å; R242-E316 IonicContact CZ-OE2 3.89Å; R242-E316 IonicContact NH1-OE1 3.15Å; R242-E316 PolarHBondContact NH1-OE1 3.4Å; R242-E316 IonicContact NH1-OE2 3.26Å; R242-E316 PolarHBondContact NH1-OE2 3.45Å; R242-E316 IonicContact NH2-OE1 2.67Å; R242-E316 PolarHBondContact NH2-OE1 2.92Å; R242-E316 IonicContact NH2-OE2 3.34Å; A310-E316 PolarHBondContact N-O 3.46Å; E316-K535 IonicContact OE2-NZ 3.36Å; E316-K535 PolarHBondContact OE2-NZ 3.43Å
317	E	84.6	Confident	84.5	Confident	103 Å²	103	64.5 Å²	64.5	48%	0.481	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	129.5	-174	-56.4	176.2	137.6	0	0	107.8	K307 A308	K307-E317 HydrophobicContact CB-CB 4.33Å; K307-E317 HydrophobicContact CD-CB 3.91Å; K307-E317 HydrophobicContact CD-CG 4.36Å; K307-E317 WeakPolarHBondContact CD-OE2 3.23Å; K307-E317 WeakPolarHBondContact CE-OE2 3.43Å; K307-E317 IonicContact NZ-OE2 3.95Å; K307-E317 PolarHBondContact NZ-OE2 3.45Å; A308-E317 CarbonylContact O-C 3.58Å; A308-E317 WeakPolarHBondContact O-CA 3.43Å
318	R	89.6	Confident	84.9	Confident	30 Å²	30	58.7 Å²	58.7	11%	0.113	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	144.9	170.2	55.9	178.8	170.4	107.4	9.6	109.7	Y195 K307 A308 P309 A310 E326	Y195-R318 VanDerWaalsContact CG-CZ 3.43Å; K307-R318 WeakPolarHBondContact CA-O 3.48Å; A308-R318 HydrophobicContact CB-CG 4.4Å; A308-R318 PolarHBondContact N-O 3.13Å; A308-R318 WeakPolarHBondContact O-CG 3.11Å; A308-R318 PolarHBondContact O-N 3.46Å; P309-R318 PolarHBondContact O-NE 2.91Å; A310-R318 HydrophobicContact CB-CB 4.28Å; A310-R318 HydrophobicContact CB-CG 4.44Å; R318-E326 IonicContact CZ-OE1 3.95Å; R318-E326 VanDerWaalsContact CZ-OE1 3.28Å; R318-E326 IonicContact CZ-OE2 2.84Å; R318-E326 IonicContact NH1-OE1 3.33Å; R318-E326 PolarHBondContact NH1-OE1 3.07Å; R318-E326 IonicContact NH1-OE2 2.69Å; R318-E326 IonicContact NH2-OE1 2.73Å; R318-E326 PolarHBondContact NH2-OE1 3.21Å; R318-E326 IonicContact NH2-OE2 3.99Å; R318-E326 PolarHBondContact NH2-OE2 2.91Å
319	E	88.9	Confident	85.2	Confident	141 Å²	141	58.6 Å²	58.6	66%	0.659	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	136.7	171.8	-168.5	160.6	-124.8	0	0	110.4
320	I	91	Very high	85.6	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.01	31%	0.307	C	S	.	.			trans	-88.5	114	-178.2	-60.5	-67.1	0	0	0	109.4	R302 M303 P304 D305 T306 A308 S322	R302-I320 HydrophobicContact CB-CD1 3.96Å; R302-I320 HydrophobicContact CB-CG1 3.98Å; R302-I320 HydrophobicContact CB-CG2 3.86Å; R302-I320 HydrophobicContact CG-CD1 3.95Å; R302-I320 HydrophobicContact CG-CG1 4.36Å; M303-I320 VanDerWaalsContact O-CB 3.27Å; M303-I320 WeakPolarHBondContact O-CB 3.32Å; M303-I320 WeakPolarHBondContact O-CG2 3.5Å; P304-I320 WeakPolarHBondContact CA-O 3.36Å; D305-I320 PolarHBondContact N-O 2.78Å; T306-I320 WeakPolarHBondContact O-CG1 3.23Å; T306-I320 PolarHBondContact O-N 2.83Å; A308-I320 HydrophobicContact CB-CD1 3.85Å; A308-I320 HydrophobicContact CB-CG1 4.26Å; I320-S322 WeakPolarHBondContact CG2-O 3.2Å
321	T	89	Confident	86.2	Confident	118 Å²	118	57.5 Å²	57.5	72%	0.724	31%	0.307	S	S	*	.			trans	-86	-11.5	-178.4	55	0	0	0	0	114.6	R324	T321-R324 PolarHBondContact OG1-NH2 3.01Å
322	S	90	Very high	87.2	Confident	51 Å²	51	57.2 Å²	57.2	36%	0.357	31%	0.306	S	S	.	.	S	Bend	trans	-157.7	146.5	-178.8	74.7	0	0	0	0	111.5	I320 R324	I320-S322 WeakPolarHBondContact CG2-O 3.2Å; S322-R324 PolarHBondContact O-N 2.95Å; S322-R324 PolarHBondContact O-NE 3.06Å; S322-R324 PolarHBondContact OG-NE 3.34Å; S322-R324 PolarHBondContact OG-NH2 3.24Å
323	E	92.1	Very high	88.5	Confident	130 Å²	130	55 Å²	55	61%	0.607	29%	0.293	S	S	*	.			trans	-54.1	132.3	169.3	56.8	176.5	-148.7	0	0	111.1	Y301 R302	Y301-E323 PolarHBondContact OH-OE2 2.88Å; R302-E323 VanDerWaalsContact O-CA 3.31Å; R302-E323 WeakPolarHBondContact O-CA 3.17Å
324	R	93.7	Very high	89.8	Confident	66 Å²	66	54.6 Å²	54.6	25%	0.249	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	145.7	179	64.6	-172.8	75	-177.1	3	112.8	R302 T321 S322 E326	R302-R324 HydrophobicContact CB-CG 4.1Å; R302-R324 HydrophobicContact CG-CG 4.35Å; R302-R324 PolarHBondContact N-O 3.42Å; R302-R324 PolarHBondContact O-N 3.12Å; R302-R324 VanDerWaalsContact O-N 3.13Å; T321-R324 PolarHBondContact OG1-NH2 3.01Å; S322-R324 PolarHBondContact O-N 2.95Å; S322-R324 PolarHBondContact O-NE 3.06Å; S322-R324 PolarHBondContact OG-NE 3.34Å; S322-R324 PolarHBondContact OG-NH2 3.24Å; R324-E326 HydrophobicContact CG-CG 4.11Å
325	P	95.3	Very high	91.1	Very high	78 Å²	78	50.1 Å²	50.1	51%	0.506	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	147.4	161.2	33.6	-33.1	0	0	0	110.5	Y300	Y300-P325 CarbonylContact O-C 3.58Å; Y300-P325 WeakPolarHBondContact O-CA 3.46Å
326	E	96.2	Very high	91.9	Very high	5 Å²	5	46.1 Å²	46.1	2%	0.023	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	137.8	172.5	-62.3	-175.3	163.8	0	0	110.2	Y195 S196 K299 Y300 R302 R318 R324	Y195-E326 WeakPolarHBondContact O-CB 3.44Å; Y195-E326 WeakPolarHBondContact O-CG 3.49Å; S196-E326 WeakPolarHBondContact O-CA 3.49Å; K299-E326 WeakPolarHBondContact CA-O 3.12Å; Y300-E326 PolarHBondContact N-O 2.9Å; Y300-E326 PolarHBondContact O-N 3.02Å; R302-E326 VanDerWaalsContact CG-CD 3.47Å; R302-E326 HydrophobicContact CG-CG 3.94Å; R302-E326 WeakPolarHBondContact CG-OE2 3.26Å; R302-E326 IonicContact CZ-OE2 2.69Å; R302-E326 IonicContact NE-OE2 3.49Å; R302-E326 PolarHBondContact NE-OE2 3.2Å; R302-E326 IonicContact NH2-OE2 3.21Å; R302-E326 PolarHBondContact NH2-OE2 2.86Å; R318-E326 IonicContact CZ-OE1 3.95Å; R318-E326 VanDerWaalsContact CZ-OE1 3.28Å; R318-E326 IonicContact CZ-OE2 2.84Å; R318-E326 IonicContact NH1-OE1 3.33Å; R318-E326 PolarHBondContact NH1-OE1 3.07Å; R318-E326 IonicContact NH1-OE2 2.69Å; R318-E326 IonicContact NH2-OE1 2.73Å; R318-E326 PolarHBondContact NH2-OE1 3.21Å; R318-E326 IonicContact NH2-OE2 3.99Å; R318-E326 PolarHBondContact NH2-OE2 2.91Å; R324-E326 HydrophobicContact CG-CG 4.11Å
327	V	97	Very high	92.5	Very high	17 Å²	17	45.8 Å²	45.8	10%	0.103	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	122.1	-176.1	-172.4	0	0	0	0	110.8	S196 Y197 S198 E297 L298 V329	S196-V327 PolarHBondContact O-N 3.42Å; Y197-V327 CarbonylContact C-O 3.56Å; Y197-V327 WeakPolarHBondContact CA-O 3.34Å; Y197-V327 HydrophobicContact CD1-CB 3.75Å; Y197-V327 HydrophobicContact CD1-CG1 4.19Å; Y197-V327 HydrophobicContact CD1-CG2 4.38Å; Y197-V327 HydrophobicContact CE1-CB 3.76Å; Y197-V327 HydrophobicContact CE1-CG1 4.05Å; Y197-V327 HydrophobicContact CE1-CG2 3.96Å; Y197-V327 HydrophobicContact CG-CB 4.45Å; S198-V327 PolarHBondContact N-O 3.03Å; E297-V327 HydrophobicContact CB-CG1 4.33Å; L298-V327 WeakPolarHBondContact O-CA 3.45Å; V327-V329 HydrophobicContact CG1-CG2 3.87Å
328	V	97.1	Very high	92.8	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.03	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	114.4	174.4	-174.1	0	0	0	0	108.6	R200 E297 L298 Y300 F330 E540	R200-V328 HydrophobicContact CG-CG1 3.62Å; E297-V328 CarbonylContact C-O 3.5Å; E297-V328 WeakPolarHBondContact CA-O 3.43Å; L298-V328 HydrophobicContact CB-CB 4.36Å; L298-V328 HydrophobicContact CD1-CB 4.39Å; L298-V328 PolarHBondContact N-O 3.24Å; L298-V328 PolarHBondContact O-N 3.18Å; Y300-V328 HydrophobicContact CD2-CG2 3.99Å; Y300-V328 HydrophobicContact CE2-CB 4.3Å; Y300-V328 HydrophobicContact CE2-CG2 3.56Å; V328-F330 HydrophobicContact CG1-CD2 4.26Å; V328-F330 HydrophobicContact CG1-CE2 3.98Å; V328-E540 WeakPolarHBondContact CG2-OE1 3.43Å
329	V	96.9	Very high	92.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	121.3	-176.2	-176.2	0	0	0	0	110.1	S198 A199 R200 L270 R294 E297 V327 F331	S198-V329 PolarHBondContact O-N 3.25Å; A199-V329 WeakPolarHBondContact CA-O 3.23Å; R200-V329 PolarHBondContact N-O 3.25Å; L270-V329 HydrophobicContact CD1-CB 4.15Å; L270-V329 HydrophobicContact CD1-CG1 4.49Å; L270-V329 HydrophobicContact CD1-CG2 3.71Å; R294-V329 HydrophobicContact CG-CG1 3.54Å; E297-V329 HydrophobicContact CG-CG2 4.41Å; V327-V329 HydrophobicContact CG1-CG2 3.87Å; V329-F331 HydrophobicContact CB-CE2 4.14Å; V329-F331 HydrophobicContact CG1-CD2 4.22Å; V329-F331 HydrophobicContact CG1-CE1 4.46Å; V329-F331 HydrophobicContact CG1-CE2 3.55Å; V329-F331 HydrophobicContact CG1-CZ 3.7Å
330	F	97.8	Very high	93.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	132.3	178	-89.7	-108	0	0	0	111.7	R200 M202 A249 F295 M296 L298 V328 E540 F544	R200-F330 HydrophobicContact CB-CD1 4.23Å; R200-F330 HydrophobicContact CB-CD2 4.15Å; R200-F330 HydrophobicContact CB-CE1 4.24Å; R200-F330 HydrophobicContact CB-CE2 4.14Å; R200-F330 HydrophobicContact CB-CG 4.19Å; R200-F330 HydrophobicContact CB-CZ 4.19Å; R200-F330 HydrophobicContact CG-CD2 4.4Å; R200-F330 HydrophobicContact CG-CE2 4.09Å; R200-F330 HydrophobicContact CG-CZ 4.35Å; M202-F330 HydrophobicContact CG-CD1 3.65Å; M202-F330 HydrophobicContact CG-CE1 3.68Å; M202-F330 HydrophobicContact SD-CE1 4.2Å; A249-F330 HydrophobicContact CB-CE1 3.54Å; A249-F330 HydrophobicContact CB-CZ 3.62Å; F295-F330 PolarHBondContact N-O 2.95Å; M296-F330 HydrophobicContact CG-CB 3.66Å; M296-F330 HydrophobicContact CG-CD2 4.18Å; M296-F330 HydrophobicContact CG-CG 4Å; M296-F330 PolarHBondContact O-N 3.07Å; M296-F330 HydrophobicContact SD-CG 4.41Å; L298-F330 HydrophobicContact CD1-CD2 3.61Å; L298-F330 HydrophobicContact CD1-CE2 3.59Å; V328-F330 HydrophobicContact CG1-CD2 4.26Å; V328-F330 HydrophobicContact CG1-CE2 3.98Å; F330-E540 HydrophobicContact CE2-CB 4.15Å; F330-E540 HydrophobicContact CZ-CB 3.95Å; F330-F544 HydrophobicContact CB-CD2 4.37Å; F330-F544 HydrophobicContact CD1-CB 4.13Å; F330-F544 AromaticContact CD1-CD2 3.42Å; F330-F544 HydrophobicContact CD1-CD2 3.42Å; F330-F544 VanDerWaalsContact CD1-CD2 3.42Å; F330-F544 HydrophobicContact CD1-CE2 4.08Å; F330-F544 AromaticContact CD1-CG 3.92Å; F330-F544 HydrophobicContact CD1-CG 3.92Å; F330-F544 HydrophobicContact CE1-CB 3.86Å; F330-F544 AromaticContact CE1-CD2 3.97Å; F330-F544 HydrophobicContact CE1-CD2 3.97Å; F330-F544 AromaticContact CE1-CG 3.98Å; F330-F544 HydrophobicContact CE1-CG 3.98Å; F330-F544 HydrophobicContact CG-CD2 4.14Å; F330-F544 HydrophobicContact CZ-CB 4.44Å
331	F	97	Very high	93.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	140.7	175.3	-67.9	-83.1	0	0	0	112.4	A199 R200 V201 M202 L270 I271 A274 W292 V293 R294 V329 I726	A199-F331 HydrophobicContact CB-CD2 4.37Å; A199-F331 HydrophobicContact CB-CE2 4.16Å; R200-F331 PolarHBondContact O-N 2.93Å; V201-F331 WeakPolarHBondContact CA-O 3.43Å; M202-F331 PolarHBondContact N-O 2.87Å; L270-F331 HydrophobicContact CB-CE2 3.87Å; L270-F331 HydrophobicContact CB-CZ 3.9Å; I271-F331 HydrophobicContact CG1-CD1 4.36Å; I271-F331 HydrophobicContact CG1-CE1 3.9Å; I271-F331 HydrophobicContact CG1-CZ 4.2Å; A274-F331 HydrophobicContact CB-CD2 4.5Å; W292-F331 HydrophobicContact CE3-CB 3.89Å; W292-F331 HydrophobicContact CE3-CD1 4.12Å; W292-F331 HydrophobicContact CE3-CG 4.09Å; W292-F331 HydrophobicContact CZ3-CB 4.14Å; V293-F331 CarbonylContact O-C 3.28Å; V293-F331 VanDerWaalsContact O-CA 3.25Å; V293-F331 WeakPolarHBondContact O-CA 3.43Å; R294-F331 HydrophobicContact CB-CD1 4.3Å; R294-F331 HydrophobicContact CB-CE1 3.92Å; R294-F331 HydrophobicContact CG-CE1 3.97Å; R294-F331 HydrophobicContact CG-CZ 4.25Å; V329-F331 HydrophobicContact CB-CE2 4.14Å; V329-F331 HydrophobicContact CG1-CD2 4.22Å; V329-F331 HydrophobicContact CG1-CE1 4.46Å; V329-F331 HydrophobicContact CG1-CE2 3.55Å; V329-F331 HydrophobicContact CG1-CZ 3.7Å; F331-I726 HydrophobicContact CE1-CD1 4.22Å
332	I	95.5	Very high	93.3	Very high	12 Å²	12	42.7 Å²	42.7	6%	0.062	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	101.6	163.6	-53.6	176.6	0	0	0	107.1	V293 F295 F544 F548	V293-I332 HydrophobicContact CB-CB 4.31Å; V293-I332 WeakPolarHBondContact CB-O 3.45Å; V293-I332 PolarHBondContact N-O 3.47Å; V293-I332 PolarHBondContact O-N 2.97Å; F295-I332 HydrophobicContact CB-CD1 4.21Å; F295-I332 HydrophobicContact CB-CG1 4.18Å; F295-I332 HydrophobicContact CD2-CD1 3.49Å; F295-I332 VanDerWaalsContact CD2-CD1 3.49Å; F295-I332 HydrophobicContact CD2-CG1 4.36Å; F295-I332 HydrophobicContact CE2-CD1 4.07Å; F295-I332 HydrophobicContact CG-CD1 3.88Å; F295-I332 HydrophobicContact CG-CG1 4.36Å; I332-F544 HydrophobicContact CD1-CE2 3.92Å; I332-F544 HydrophobicContact CD1-CZ 3.77Å; I332-F544 HydrophobicContact CG1-CE2 4.03Å; I332-F544 HydrophobicContact CG1-CZ 4.05Å; I332-F548 HydrophobicContact CD1-CD2 3.94Å; I332-F548 HydrophobicContact CD1-CE2 3.91Å
333	P	93.9	Very high	93.4	Very high	7 Å²	7	47 Å²	47	5%	0.045	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	145.5	174.3	30.9	-30.6	0	0	0	111.2	V201 L203 L286 C289 W292 A335	V201-P333 HydrophobicContact CG1-CG 3.87Å; L203-P333 HydrophobicContact CD2-CG 3.69Å; L286-P333 HydrophobicContact CD1-CG 4.21Å; C289-P333 HydrophobicContact CB-CB 4.22Å; W292-P333 HydrophobicContact CD2-CB 3.75Å; W292-P333 HydrophobicContact CE3-CB 3.78Å; W292-P333 HydrophobicContact CE3-CG 4.35Å; W292-P333 HydrophobicContact CG-CB 4.41Å; W292-P333 HydrophobicContact CH2-CB 3.88Å; W292-P333 HydrophobicContact CH2-CG 4.09Å; W292-P333 HydrophobicContact CZ2-CB 3.86Å; W292-P333 HydrophobicContact CZ3-CB 3.84Å; W292-P333 HydrophobicContact CZ3-CG 4.01Å; P333-A335 PolarHBondContact O-N 2.99Å
334	N	89.6	Confident	93.5	Very high	67 Å²	67	46 Å²	46	36%	0.358	24%	0.24	S	C	.	.			trans	-76.7	108.7	173	-167.2	-19.3	0	0	0	109.9	C289 E291 A336 H337	C289-N334 PolarHBondContact SG-O 3.23Å; E291-N334 HydrophobicContact CB-CB 3.88Å; E291-N334 HydrophobicContact CG-CB 4.46Å; E291-N334 PolarHBondContact O-N 2.76Å; E291-N334 PolarHBondContact OE2-ND2 3.06Å; N334-A336 WeakPolarHBondContact OD1-CB 3.27Å; N334-A336 PolarHBondContact OD1-N 2.73Å; N334-H337 PolarHBondContact O-CE1 3.11Å
335	A	90.8	Very high	93.5	Very high	4 Å²	4	43 Å²	43	3%	0.033	23%	0.229	C	C	.	.			trans	-106.3	9.1	-177.6	0	0	0	0	0	113.5	L203 P333 H337 L338 I503	L203-A335 HydrophobicContact CD2-CB 3.95Å; P333-A335 PolarHBondContact O-N 2.99Å; A335-H337 PolarHBondContact O-N 3.19Å; A335-L338 HydrophobicContact CB-CD1 4.16Å; A335-L338 WeakPolarHBondContact O-CB 3.43Å; A335-L338 PolarHBondContact O-N 3.49Å; A335-I503 HydrophobicContact CB-CD1 4.35Å
336	A	88.4	Confident	93.4	Very high	34 Å²	34	41.3 Å²	41.3	28%	0.281	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-62.4	-28.9	-172.6	0	0	0	0	0	113.9	T168 N334 L338 I339	T168-A336 HydrophobicContact CG2-CB 4.21Å; N334-A336 WeakPolarHBondContact OD1-CB 3.27Å; N334-A336 PolarHBondContact OD1-N 2.73Å; A336-L338 VanDerWaalsContact C-N 3.29Å; A336-L338 PolarHBondContact O-N 2.96Å; A336-I339 WeakPolarHBondContact O-CD1 3.43Å; A336-I339 WeakPolarHBondContact O-CG1 3.46Å
337	H	87.9	Confident	93.4	Very high	92 Å²	92	47 Å²	47	43%	0.426	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-78.2	-6.8	176.2	68.4	-70.8	0	0	0	114.3	S288 N334 A335	S288-H337 PolarHBondContact O-NE2 2.98Å; S288-H337 PolarHBondContact OG-NE2 2.89Å; N334-H337 PolarHBondContact O-CE1 3.11Å; A335-H337 PolarHBondContact O-N 3.19Å
338	L	91.2	Very high	93.2	Very high	41 Å²	41	47.9 Å²	47.9	22%	0.215	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-85.9	-9.1	176.4	-66.4	177.3	0	0	0	113	L284 L286 S288 A335 A336 P340 I503	L284-L338 HydrophobicContact CD1-CD1 4.48Å; L284-L338 HydrophobicContact CD2-CD1 4.47Å; L286-L338 HydrophobicContact CD2-CD1 3.97Å; S288-L338 WeakPolarHBondContact OG-CD2 3.48Å; A335-L338 HydrophobicContact CB-CD1 4.16Å; A335-L338 WeakPolarHBondContact O-CB 3.43Å; A335-L338 PolarHBondContact O-N 3.49Å; A336-L338 VanDerWaalsContact C-N 3.29Å; A336-L338 PolarHBondContact O-N 2.96Å; L338-P340 WeakPolarHBondContact O-CD 3.43Å; L338-I503 HydrophobicContact CB-CD1 3.75Å; L338-I503 HydrophobicContact CB-CG1 4Å
339	I	91.9	Very high	93	Very high	49 Å²	49	50.2 Å²	50.2	25%	0.251	26%	0.261	S	S	.	.	S	Bend	trans	-65.5	122.7	176.7	-54.7	169	0	0	0	108.4	T168 A336 P501 I503	T168-I339 HydrophobicContact CG2-CD1 3.97Å; T168-I339 HydrophobicContact CG2-CG1 4.34Å; A336-I339 WeakPolarHBondContact O-CD1 3.43Å; A336-I339 WeakPolarHBondContact O-CG1 3.46Å; I339-P501 HydrophobicContact CG2-CB 4.11Å; I339-I503 HydrophobicContact CG1-CD1 4.19Å; I339-I503 HydrophobicContact CG1-CG1 4.31Å
340	P	92.4	Very high	92.8	Very high	23 Å²	23	56.2 Å²	56.2	15%	0.149	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-67	147	179.6	25.5	-31.6	0	0	0	111.4	L338 Q344 W345 P501 A502	L338-P340 WeakPolarHBondContact O-CD 3.43Å; P340-Q344 HydrophobicContact CB-CB 3.84Å; P340-W345 HydrophobicContact CG-CB 4.49Å; P340-W345 HydrophobicContact CG-CD2 4.47Å; P340-W345 HydrophobicContact CG-CE3 3.75Å; P340-W345 HydrophobicContact CG-CZ3 4.33Å; P340-P501 HydrophobicContact CG-CB 4.27Å; P340-P501 VanDerWaalsContact O-CB 3.27Å; P340-P501 WeakPolarHBondContact O-CB 3.28Å; P340-A502 WeakPolarHBondContact CD-O 3.3Å; P340-A502 WeakPolarHBondContact CG-O 3.17Å
341	S	92.1	Very high	92.5	Very high	56 Å²	56	60.9 Å²	60.9	39%	0.392	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-64.1	162.3	170.1	75.8	0	0	0	0	111.2	E343 Q344 W345	S341-E343 PolarHBondContact O-N 3.07Å; S341-Q344 PolarHBondContact O-N 3.14Å; S341-Q344 WeakPolarHBondContact OG-CG 3.04Å; S341-Q344 PolarHBondContact OG-N 3.19Å; S341-W345 WeakPolarHBondContact O-CB 3.21Å; S341-W345 PolarHBondContact O-N 3.34Å
342	E	91.8	Very high	92.3	Very high	160 Å²	160	61.3 Å²	61.3	75%	0.748	31%	0.309	S	S	*	.	H	α-helix	trans	-58.3	-36.5	178.8	-61.9	-171.1	153.4	0	0	112.5	W345 A346 P501	E342-W345 PolarHBondContact O-N 3.48Å; E342-A346 WeakPolarHBondContact O-CB 3.4Å; E342-A346 PolarHBondContact O-N 2.97Å; E342-P501 HydrophobicContact CG-CG 4.21Å
343	E	93.1	Very high	92.1	Very high	141 Å²	141	64.3 Å²	64.3	66%	0.659	33%	0.325	S	S	*	.	H	α-helix	trans	-66.8	-39.6	173.6	-64.2	-178.9	-162.4	0	0	113.2	S341 K347	S341-E343 PolarHBondContact O-N 3.07Å; E343-K347 WeakPolarHBondContact O-CD 3.34Å; E343-K347 WeakPolarHBondContact O-CG 3.36Å; E343-K347 PolarHBondContact O-N 3.5Å
344	Q	93.3	Very high	92	Very high	108 Å²	108	66.2 Å²	66.2	51%	0.505	34%	0.338	S	S	.	.	H	α-helix	trans	-67.4	-42.6	175.4	-72.9	169.4	-19.7	0	0	110.2	P340 S341 A346 K347 T348	P340-Q344 HydrophobicContact CB-CB 3.84Å; S341-Q344 PolarHBondContact O-N 3.14Å; S341-Q344 WeakPolarHBondContact OG-CG 3.04Å; S341-Q344 PolarHBondContact OG-N 3.19Å; Q344-A346 PolarHBondContact O-N 3.4Å; Q344-K347 PolarHBondContact O-N 2.92Å; Q344-T348 PolarHBondContact O-N 3.18Å; Q344-T348 PolarHBondContact O-OG1 2.82Å
345	W	94.1	Very high	92	Very high	5 Å²	5	64.7 Å²	64.7	2%	0.019	33%	0.33	C	S	.	.	H	α-helix	trans	-65.5	-36.5	178.3	-169.1	-127.6	0	0	0	112.8	H171 P340 S341 E342 T348 K349 L497 G498 D499 K500 P501 A502 V504	H171-W345 HydrophobicContact CB-CH2 4.1Å; P340-W345 HydrophobicContact CG-CB 4.49Å; P340-W345 HydrophobicContact CG-CD2 4.47Å; P340-W345 HydrophobicContact CG-CE3 3.75Å; P340-W345 HydrophobicContact CG-CZ3 4.33Å; S341-W345 WeakPolarHBondContact O-CB 3.21Å; S341-W345 PolarHBondContact O-N 3.34Å; E342-W345 PolarHBondContact O-N 3.48Å; W345-T348 HydrophobicContact CE3-CG2 4.25Å; W345-T348 HydrophobicContact CZ3-CG2 4.29Å; W345-T348 WeakPolarHBondContact O-CB 3.39Å; W345-T348 PolarHBondContact O-N 3.38Å; W345-K349 VanDerWaalsContact CD1-CE 3.43Å; W345-K349 WeakPolarHBondContact O-CG 3.27Å; W345-K349 PolarHBondContact O-N 2.67Å; W345-L497 HydrophobicContact CH2-CD2 3.46Å; W345-L497 VanDerWaalsContact CH2-CD2 3.46Å; W345-L497 HydrophobicContact CZ2-CB 4.34Å; W345-L497 HydrophobicContact CZ2-CD2 4Å; W345-L497 HydrophobicContact CZ3-CD2 3.99Å; W345-G498 PolarHBondContact NE1-O 3.32Å; W345-G498 VanDerWaalsContact NE1-O 3.09Å; W345-D499 PolarHBondContact NE1-O 3.49Å; W345-D499 VanDerWaalsContact NE1-O 3.11Å; W345-K500 VanDerWaalsContact CE2-O 3.25Å; W345-K500 VanDerWaalsContact CZ2-O 3.31Å; W345-K500 WeakPolarHBondContact CZ2-O 3.13Å; W345-K500 PolarHBondContact NE1-O 3.03Å; W345-P501 HydrophobicContact CB-CB 4.18Å; W345-P501 HydrophobicContact CB-CG 4.13Å; W345-P501 HydrophobicContact CD2-CB 4.36Å; W345-P501 HydrophobicContact CG-CB 4.02Å; W345-P501 HydrophobicContact CG-CG 4.09Å; W345-A502 HydrophobicContact CH2-CB 3.99Å; W345-A502 HydrophobicContact CZ2-CB 4.33Å; W345-A502 WeakPolarHBondContact CZ3-O 3.45Å; W345-V504 HydrophobicContact CH2-CG2 4.48Å; W345-V504 HydrophobicContact CZ3-CG2 3.86Å
346	A	94.5	Very high	91.9	Very high	42 Å²	42	65.4 Å²	65.4	35%	0.347	33%	0.333	S	S	.	.	H	α-helix	trans	-59.4	-50.1	170.4	0	0	0	0	0	111.4	E342 Q344 T348 K349 E350	E342-A346 WeakPolarHBondContact O-CB 3.4Å; E342-A346 PolarHBondContact O-N 2.97Å; Q344-A346 PolarHBondContact O-N 3.4Å; A346-T348 VanDerWaalsContact C-N 3.3Å; A346-T348 PolarHBondContact O-N 3.36Å; A346-K349 WeakPolarHBondContact O-CB 3.37Å; A346-K349 PolarHBondContact O-N 2.92Å; A346-K349 VanDerWaalsContact O-N 3.08Å; A346-E350 WeakPolarHBondContact O-CG 3.4Å; A346-E350 PolarHBondContact O-N 3.29Å
347	K	94.6	Very high	92	Very high	125 Å²	125	70 Å²	70	54%	0.543	35%	0.349	S	S	.	.	H	α-helix	trans	-61.2	-36.5	175.7	-67.6	164.2	-174.4	167.2	0	112.3	E343 Q344 E350 Y351	E343-K347 WeakPolarHBondContact O-CD 3.34Å; E343-K347 WeakPolarHBondContact O-CG 3.36Å; E343-K347 PolarHBondContact O-N 3.5Å; Q344-K347 PolarHBondContact O-N 2.92Å; K347-E350 PolarHBondContact O-N 3.19Å; K347-Y351 WeakPolarHBondContact O-CB 3.43Å; K347-Y351 PolarHBondContact O-N 3.09Å
348	T	92.8	Very high	92	Very high	34 Å²	34	72.7 Å²	72.7	21%	0.209	36%	0.359	C	S	.	.	H	α-helix	trans	-61.6	-46.3	172.1	-53	0	0	0	0	111.2	Q344 W345 A346 Y351 Y352 L497 V504	Q344-T348 PolarHBondContact O-N 3.18Å; Q344-T348 PolarHBondContact O-OG1 2.82Å; W345-T348 HydrophobicContact CE3-CG2 4.25Å; W345-T348 HydrophobicContact CZ3-CG2 4.29Å; W345-T348 WeakPolarHBondContact O-CB 3.39Å; W345-T348 PolarHBondContact O-N 3.38Å; A346-T348 VanDerWaalsContact C-N 3.3Å; A346-T348 PolarHBondContact O-N 3.36Å; T348-Y351 PolarHBondContact O-N 2.95Å; T348-Y352 HydrophobicContact CG2-CD2 3.85Å; T348-Y352 HydrophobicContact CG2-CE2 3.68Å; T348-Y352 VanDerWaalsContact O-CD2 3.27Å; T348-Y352 WeakPolarHBondContact O-CD2 3.47Å; T348-Y352 PolarHBondContact O-N 3.38Å; T348-Y352 VanDerWaalsContact O-N 3.11Å; T348-L497 HydrophobicContact CG2-CD1 4.11Å; T348-V504 HydrophobicContact CG2-CG2 4.32Å
349	K	92.7	Very high	91.7	Very high	55 Å²	55	74.4 Å²	74.4	24%	0.239	37%	0.366	C	S	.	.	H	α-helix	trans	-60.3	-46.6	175.6	-70.2	173.8	-172.2	177.3	0	112	W345 A346 Y351 Y352 N353 L497 G498 D499	W345-K349 VanDerWaalsContact CD1-CE 3.43Å; W345-K349 WeakPolarHBondContact O-CG 3.27Å; W345-K349 PolarHBondContact O-N 2.67Å; A346-K349 WeakPolarHBondContact O-CB 3.37Å; A346-K349 PolarHBondContact O-N 2.92Å; A346-K349 VanDerWaalsContact O-N 3.08Å; K349-Y351 VanDerWaalsContact C-N 3.33Å; K349-Y351 PolarHBondContact O-N 3.12Å; K349-Y352 PolarHBondContact O-N 3.08Å; K349-N353 VanDerWaalsContact O-CB 3.24Å; K349-N353 WeakPolarHBondContact O-CB 3.48Å; K349-N353 PolarHBondContact O-N 3.43Å; K349-N353 PolarHBondContact O-ND2 3.09Å; K349-N353 VanDerWaalsContact O-ND2 3.12Å; K349-L497 HydrophobicContact CB-CD1 4.43Å; K349-L497 HydrophobicContact CG-CB 4.07Å; K349-L497 HydrophobicContact CG-CD1 4Å; K349-G498 WeakPolarHBondContact CE-O 3.37Å; K349-G498 PolarHBondContact NZ-O 2.77Å; K349-D499 PolarHBondContact NZ-O 3.09Å
350	E	93.1	Very high	91.3	Very high	125 Å²	125	74.5 Å²	74.5	58%	0.584	37%	0.367	S	S	*	.	H	α-helix	trans	-57.8	-44.9	176.9	-70.8	166	178	0	0	111.7	A346 K347 N353 S354	A346-E350 WeakPolarHBondContact O-CG 3.4Å; A346-E350 PolarHBondContact O-N 3.29Å; K347-E350 PolarHBondContact O-N 3.19Å; E350-N353 PolarHBondContact O-N 2.91Å; E350-S354 PolarHBondContact O-N 2.73Å
351	Y	92.7	Very high	90.6	Very high	99 Å²	99	77.8 Å²	77.8	39%	0.388	39%	0.387	S	S	.	.	H	α-helix	trans	-58.8	-54.8	176.8	176.7	-95.1	0	0	0	112.7	P180 K347 T348 K349 N353 S354 I355	P180-Y351 WeakPolarHBondContact CA-OH 3.47Å; P180-Y351 HydrophobicContact CB-CE1 4.23Å; P180-Y351 WeakPolarHBondContact CB-OH 3.39Å; P180-Y351 HydrophobicContact CG-CE1 3.83Å; K347-Y351 WeakPolarHBondContact O-CB 3.43Å; K347-Y351 PolarHBondContact O-N 3.09Å; T348-Y351 PolarHBondContact O-N 2.95Å; K349-Y351 VanDerWaalsContact C-N 3.33Å; K349-Y351 PolarHBondContact O-N 3.12Å; Y351-N353 VanDerWaalsContact C-N 3.34Å; Y351-N353 PolarHBondContact O-N 3.43Å; Y351-S354 WeakPolarHBondContact O-CB 3.39Å; Y351-S354 PolarHBondContact O-N 2.69Å; Y351-S354 VanDerWaalsContact O-N 3.08Å; Y351-S354 PolarHBondContact O-OG 2.98Å; Y351-I355 HydrophobicContact CD1-CD1 4Å; Y351-I355 HydrophobicContact CE1-CD1 3.36Å; Y351-I355 HydrophobicContact CE1-CG1 4.45Å; Y351-I355 HydrophobicContact CE2-CD1 4.46Å; Y351-I355 PolarHBondContact O-N 2.88Å; Y351-I355 VanDerWaalsContact O-N 3.12Å
352	Y	92	Very high	88.9	Confident	8 Å²	8	79.7 Å²	79.7	3%	0.031	40%	0.396	C	S	.	.	H	α-helix	trans	-69.4	-29.8	-179.8	-72.4	-77.7	0	0	0	113.1	F173 P180 T348 K349 S354 I355 L356 Y495 L497 H506	F173-Y352 HydrophobicContact CE1-CD1 4.4Å; F173-Y352 HydrophobicContact CE2-CD1 4.17Å; F173-Y352 HydrophobicContact CE2-CD2 4.31Å; F173-Y352 AromaticContact CE2-CE1 3.71Å; F173-Y352 HydrophobicContact CE2-CE1 3.71Å; F173-Y352 AromaticContact CE2-CE2 3.87Å; F173-Y352 HydrophobicContact CE2-CE2 3.87Å; F173-Y352 HydrophobicContact CE2-CG 4.46Å; F173-Y352 AromaticContact CE2-CZ 3.56Å; F173-Y352 AromaticContact CZ-CD1 3.72Å; F173-Y352 HydrophobicContact CZ-CD1 3.72Å; F173-Y352 AromaticContact CZ-CD2 3.95Å; F173-Y352 HydrophobicContact CZ-CD2 3.95Å; F173-Y352 AromaticContact CZ-CE1 3.76Å; F173-Y352 HydrophobicContact CZ-CE1 3.76Å; F173-Y352 AromaticContact CZ-CE2 3.99Å; F173-Y352 HydrophobicContact CZ-CE2 3.99Å; F173-Y352 AromaticContact CZ-CG 3.83Å; F173-Y352 HydrophobicContact CZ-CG 3.83Å; F173-Y352 AromaticContact CZ-CZ 3.92Å; P180-Y352 WeakPolarHBondContact CD-OH 3.37Å; P180-Y352 VanDerWaalsContact CG-OH 3.3Å; P180-Y352 WeakPolarHBondContact CG-OH 3.32Å; T348-Y352 HydrophobicContact CG2-CD2 3.85Å; T348-Y352 HydrophobicContact CG2-CE2 3.68Å; T348-Y352 VanDerWaalsContact O-CD2 3.27Å; T348-Y352 WeakPolarHBondContact O-CD2 3.47Å; T348-Y352 PolarHBondContact O-N 3.38Å; T348-Y352 VanDerWaalsContact O-N 3.11Å; K349-Y352 PolarHBondContact O-N 3.08Å; Y352-S354 VanDerWaalsContact C-N 3.32Å; Y352-I355 HydrophobicContact CD1-CD1 4.22Å; Y352-I355 HydrophobicContact CE1-CD1 4.49Å; Y352-I355 PolarHBondContact O-N 3.32Å; Y352-L356 WeakPolarHBondContact O-CB 3.28Å; Y352-L356 PolarHBondContact O-N 2.69Å; Y352-Y495 AromaticContact CD1-CD1 3.97Å; Y352-Y495 HydrophobicContact CD1-CD1 3.97Å; Y352-Y495 HydrophobicContact CD1-CE1 4.13Å; Y352-L497 HydrophobicContact CD2-CD1 3.69Å; Y352-L497 HydrophobicContact CG-CD1 4.2Å; Y352-H506 AromaticContact CZ-NE2 3.94Å; Y352-H506 PolarHBondContact OH-CE1 2.93Å; Y352-H506 PolarHBondContact OH-NE2 2.77Å
353	N	91	Very high	86.7	Confident	76 Å²	76	79.4 Å²	79.4	41%	0.406	39%	0.394	S	S	.	.	H	α-helix	trans	-63.2	-37.7	169.2	-74.3	-27	0	0	0	111.7	K349 E350 Y351 L356 Q357	K349-N353 VanDerWaalsContact O-CB 3.24Å; K349-N353 WeakPolarHBondContact O-CB 3.48Å; K349-N353 PolarHBondContact O-N 3.43Å; K349-N353 PolarHBondContact O-ND2 3.09Å; K349-N353 VanDerWaalsContact O-ND2 3.12Å; E350-N353 PolarHBondContact O-N 2.91Å; Y351-N353 VanDerWaalsContact C-N 3.34Å; Y351-N353 PolarHBondContact O-N 3.43Å; N353-L356 PolarHBondContact O-N 3.17Å; N353-Q357 VanDerWaalsContact O-CG 3.32Å; N353-Q357 WeakPolarHBondContact O-CG 3.33Å; N353-Q357 PolarHBondContact O-N 3.46Å
354	S	91.8	Very high	83.9	Confident	46 Å²	46	82.7 Å²	82.7	32%	0.322	41%	0.406	S	S	.	.	H	α-helix	trans	-68.4	-35.3	176.4	81	0	0	0	0	112.8	E350 Y351 Y352 Q357 K358	E350-S354 PolarHBondContact O-N 2.73Å; Y351-S354 WeakPolarHBondContact O-CB 3.39Å; Y351-S354 PolarHBondContact O-N 2.69Å; Y351-S354 VanDerWaalsContact O-N 3.08Å; Y351-S354 PolarHBondContact O-OG 2.98Å; Y352-S354 VanDerWaalsContact C-N 3.32Å; S354-Q357 PolarHBondContact O-N 3.11Å; S354-K358 WeakPolarHBondContact O-CG 3.47Å; S354-K358 PolarHBondContact O-N 3.46Å; S354-K358 VanDerWaalsContact O-N 3.09Å
355	I	90.2	Very high	81.2	Confident	35 Å²	35	83.8 Å²	83.8	18%	0.179	42%	0.42	C	S	.	.	H	α-helix	trans	-65.9	-47.8	172.3	-65.6	170.7	0	0	0	110.2	Y351 Y352 Q357 K358 Q359 Y495	Y351-I355 HydrophobicContact CD1-CD1 4Å; Y351-I355 HydrophobicContact CE1-CD1 3.36Å; Y351-I355 HydrophobicContact CE1-CG1 4.45Å; Y351-I355 HydrophobicContact CE2-CD1 4.46Å; Y351-I355 PolarHBondContact O-N 2.88Å; Y351-I355 VanDerWaalsContact O-N 3.12Å; Y352-I355 HydrophobicContact CD1-CD1 4.22Å; Y352-I355 HydrophobicContact CE1-CD1 4.49Å; Y352-I355 PolarHBondContact O-N 3.32Å; I355-Q357 VanDerWaalsContact C-N 3.29Å; I355-Q357 PolarHBondContact O-N 3.45Å; I355-K358 PolarHBondContact O-N 2.94Å; I355-Q359 HydrophobicContact CG2-CG 4.35Å; I355-Q359 WeakPolarHBondContact O-CG 3.39Å; I355-Q359 PolarHBondContact O-N 3.08Å; I355-Y495 HydrophobicContact CB-CE1 4.15Å; I355-Y495 HydrophobicContact CG2-CD1 4.32Å; I355-Y495 HydrophobicContact CG2-CE1 3.55Å
356	L	89.1	Confident	78.4	Confident	20 Å²	20	90.5 Å²	90.5	11%	0.105	45%	0.452	C	S	.	.	H	α-helix	trans	-56.4	-44.1	176.6	175.8	62.2	0	0	0	111.3	Y352 N353 Q359 L360 L491 E492 Y495	Y352-L356 WeakPolarHBondContact O-CB 3.28Å; Y352-L356 PolarHBondContact O-N 2.69Å; N353-L356 PolarHBondContact O-N 3.17Å; L356-Q359 PolarHBondContact O-N 2.93Å; L356-L360 HydrophobicContact CD1-CD1 4Å; L356-L360 HydrophobicContact CD1-CG 4.18Å; L356-L360 HydrophobicContact CG-CD1 4.02Å; L356-L360 WeakPolarHBondContact O-CB 3.41Å; L356-L360 VanDerWaalsContact O-CG 3.23Å; L356-L360 WeakPolarHBondContact O-CG 3.49Å; L356-L360 PolarHBondContact O-N 3.36Å; L356-L491 HydrophobicContact CD1-CB 3.88Å; L356-L491 HydrophobicContact CD1-CD2 4Å; L356-L491 HydrophobicContact CD1-CG 3.72Å; L356-E492 HydrophobicContact CD2-CG 4.41Å; L356-Y495 HydrophobicContact CB-CG 4.11Å; L356-Y495 HydrophobicContact CD1-CD2 4.15Å; L356-Y495 HydrophobicContact CD1-CG 4.43Å
357	Q	89.6	Confident	75.4	Confident	130 Å²	130	95.9 Å²	95.9	61%	0.607	48%	0.475	S	S	*	.	H	α-helix	trans	-59.3	-49.8	175.5	-76.5	171.6	-5.3	0	0	111.9	N353 S354 I355 Q359 L360 T361	N353-Q357 VanDerWaalsContact O-CG 3.32Å; N353-Q357 WeakPolarHBondContact O-CG 3.33Å; N353-Q357 PolarHBondContact O-N 3.46Å; S354-Q357 PolarHBondContact O-N 3.11Å; I355-Q357 VanDerWaalsContact C-N 3.29Å; I355-Q357 PolarHBondContact O-N 3.45Å; Q357-Q359 VanDerWaalsContact C-N 3.33Å; Q357-Q359 PolarHBondContact O-N 3.33Å; Q357-L360 PolarHBondContact O-N 2.96Å; Q357-L360 VanDerWaalsContact O-N 3.07Å; Q357-T361 PolarHBondContact O-N 2.87Å; Q357-T361 PolarHBondContact O-OG1 2.89Å
358	K	88.8	Confident	72.6	Confident	149 Å²	149	99.5 Å²	99.5	65%	0.648	49%	0.494	S	S	*	.	H	α-helix	trans	-59.2	-39.9	177.9	-73.4	179.9	175.5	-169.9	0	113.4	S354 I355 L360 T361 V362	S354-K358 WeakPolarHBondContact O-CG 3.47Å; S354-K358 PolarHBondContact O-N 3.46Å; S354-K358 VanDerWaalsContact O-N 3.09Å; I355-K358 PolarHBondContact O-N 2.94Å; K358-L360 VanDerWaalsContact C-N 3.3Å; K358-L360 PolarHBondContact O-N 3.33Å; K358-T361 PolarHBondContact O-N 2.95Å; K358-T361 PolarHBondContact O-OG1 3.49Å; K358-V362 PolarHBondContact O-N 2.86Å
359	Q	84	Confident	69.9	Low	77 Å²	77	103.6 Å²	103.6	36%	0.36	52%	0.523	S	S	.	.	H	α-helix	trans	-73.7	-21.5	177.5	-65.7	179.6	-8	0	0	113.2	I355 L356 Q357 L491 Y495	I355-Q359 HydrophobicContact CG2-CG 4.35Å; I355-Q359 WeakPolarHBondContact O-CG 3.39Å; I355-Q359 PolarHBondContact O-N 3.08Å; L356-Q359 PolarHBondContact O-N 2.93Å; Q357-Q359 VanDerWaalsContact C-N 3.33Å; Q357-Q359 PolarHBondContact O-N 3.33Å; Q359-L491 HydrophobicContact CB-CD2 3.67Å; Q359-Y495 PolarHBondContact NE2-OH 2.75Å; Q359-Y495 PolarHBondContact OE1-OH 2.85Å
360	L	83.6	Confident	67.2	Low	50 Å²	50	109.8 Å²	109.8	26%	0.262	56%	0.555	S	S	.	*	H	α-helix	trans	-83.4	-23.6	173	-70.3	174.3	0	0	0	113.1	L356 Q357 K358 L483 R488 L491	L356-L360 HydrophobicContact CD1-CD1 4Å; L356-L360 HydrophobicContact CD1-CG 4.18Å; L356-L360 HydrophobicContact CG-CD1 4.02Å; L356-L360 WeakPolarHBondContact O-CB 3.41Å; L356-L360 VanDerWaalsContact O-CG 3.23Å; L356-L360 WeakPolarHBondContact O-CG 3.49Å; L356-L360 PolarHBondContact O-N 3.36Å; Q357-L360 PolarHBondContact O-N 2.96Å; Q357-L360 VanDerWaalsContact O-N 3.07Å; K358-L360 VanDerWaalsContact C-N 3.3Å; K358-L360 PolarHBondContact O-N 3.33Å; L360-L483 HydrophobicContact CD2-CD2 4.23Å; L360-R488 HydrophobicContact CD1-CG 4.41Å; L360-R488 HydrophobicContact CD2-CB 3.99Å; L360-R488 HydrophobicContact CD2-CG 3.73Å; L360-L491 HydrophobicContact CD2-CD2 3.89Å; L360-L491 HydrophobicContact CG-CD2 4.18Å
361	T	76.9	Confident	64.6	Low	93 Å²	93	110 Å²	110	57%	0.571	57%	0.565	S	S	*	*	H	α-helix	trans	-91.1	-18.2	-178.4	52	0	0	0	0	115.1	Q357 K358 E363	Q357-T361 PolarHBondContact O-N 2.87Å; Q357-T361 PolarHBondContact O-OG1 2.89Å; K358-T361 PolarHBondContact O-N 2.95Å; K358-T361 PolarHBondContact O-OG1 3.49Å; T361-E363 PolarHBondContact O-N 3.11Å
362	V	57.7	Low	62	Low	95 Å²	95	114.7 Å²	114.7	58%	0.576	59%	0.591	S	S	*	*			trans	46.8	57.5	172.2	-163.6	0	0	0	0	113	K358 K364 L483	K358-V362 PolarHBondContact O-N 2.86Å; V362-K364 PolarHBondContact O-N 3.24Å; V362-L483 HydrophobicContact CG2-CD1 3.58Å
363	E	46.2	Very low	59.3	Low	155 Å²	155	122.8 Å²	122.8	72%	0.724	63%	0.629	S	S	*	*			trans	-65.7	134	178.6	-73.7	-175.5	125.2	0	0	112.1	T361 V365	T361-E363 PolarHBondContact O-N 3.11Å; E363-V365 PolarHBondContact O-N 3.24Å
364	K	33.6	Very low	56.8	Low	209 Å²	209	128.5 Å²	128.5	91%	0.909	65%	0.653	S	S	*	*			trans	-69.8	114.8	167.6	-62.9	171.3	-178.3	171.5	0	108.5	V362	V362-K364 PolarHBondContact O-N 3.24Å
365	V	36.9	Very low	54.2	Low	132 Å²	132	134.5 Å²	134.5	80%	0.8	68%	0.681	S	S	*	*			trans	-134.9	73.2	164.6	-169.3	0	0	0	0	108.3	E363	E363-V365 PolarHBondContact O-N 3.24Å
366	E	34.1	Very low	51.7	Low	146 Å²	146	136.5 Å²	136.5	68%	0.682	71%	0.711	S	S	*	*	S	Bend	trans	-110.7	121.1	158.6	-74.3	-179.5	141.8	0	0	106.2	K427	E366-K427 IonicContact OE1-NZ 2.67Å; E366-K427 PolarHBondContact OE1-NZ 3.39Å
367	D	32.4	Very low	49.2	Very low	154 Å²	154	143 Å²	143	82%	0.824	75%	0.745	S	S	*	*	S	Bend	trans	64.7	59.4	153.3	-49.4	-24.5	0	0	0	122.5
368	E	36	Very low	46.7	Very low	202 Å²	202	145 Å²	145	94%	0.944	76%	0.757	S	S	*	*			trans	-136.1	65.1	155.1	-75.9	-160.8	160.5	0	0	113.6
369	S	36.4	Very low	44.1	Very low	119 Å²	119	142.4 Å²	142.4	83%	0.832	76%	0.758	S	S	*	*			trans	-153.9	74.6	163.6	71.3	0	0	0	0	114.1
370	M	35.5	Very low	41.9	Very low	185 Å²	185	145.1 Å²	145.1	91%	0.911	78%	0.779	S	S	*	*			trans	-127.8	158.9	158.7	-78.8	-163.5	74.3	0	0	109.7
371	V	37.8	Very low	39.8	Very low	129 Å²	129	147 Å²	147	78%	0.782	80%	0.801	S	S	*	*			trans	72.6	86.8	180	-165.6	0	0	0	0	114.9
372	E	38.9	Very low	37.6	Very low	199 Å²	199	149.2 Å²	149.2	93%	0.93	81%	0.81	S	S	*	*				-148.6	151.4	123	-119.1	175.3	-152.5	0	0	109.4
373	Q	34.7	Very low	36.7	Very low	177 Å²	177	151 Å²	151	83%	0.827	82%	0.821	S	S	*	*			trans	-110.4	138.9	-162.6	-58.9	170	-79.6	0	0	112.2
374	Q	39.6	Very low	36.2	Very low	197 Å²	197	148.4 Å²	148.4	92%	0.921	82%	0.82	S	S	*	*			trans	-140.5	137	154.9	-71.1	-164.5	-11.3	0	0	110.3
375	D	35.8	Very low	36.6	Very low	171 Å²	171	145 Å²	145	91%	0.914	82%	0.817	S	S	*	*			trans	-76	144.2	-174.5	-57.1	-77.1	0	0	0	113.1
376	G	38.4	Very low	36.6	Very low	77 Å²	77	147.6 Å²	147.6	79%	0.794	82%	0.82	S	S	*	*			trans	-160.5	79.2	179.9	0	0	0	0	0	112.1	M378	G376-M378 PolarHBondContact O-N 3.5Å
377	D	35.8	Very low	36.5	Very low	156 Å²	156	149.5 Å²	149.5	83%	0.834	83%	0.829	S	S	*	*			trans	-75.9	112.1	-176.8	-177.5	20.1	0	0	0	112.7
378	M	37.4	Very low	37	Very low	172 Å²	172	148 Å²	148	85%	0.847	83%	0.827	S	S	*	*			trans	-156.4	132.2	156.7	-165.6	68.2	67.8	0	0	109.7	G376	G376-M378 PolarHBondContact O-N 3.5Å
379	S	34.4	Very low	36.9	Very low	95 Å²	95	147.7 Å²	147.7	66%	0.664	83%	0.826	S	S	*	*			trans	-99.6	158.3	-178.7	54.3	0	0	0	0	112.9
380	V	38.7	Very low	37.1	Very low	135 Å²	135	150.4 Å²	150.4	82%	0.818	83%	0.826	S	S	*	*			trans	156.8	143.1	131.8	158.6	0	0	0	0	112.6
381	A	38	Very low	37.5	Very low	88 Å²	88	146.5 Å²	146.5	73%	0.727	82%	0.816	S	S	*	*			trans	69.6	78.4	161.5	0	0	0	0	0	119.6
382	D	32.1	Very low	37.9	Very low	141 Å²	141	147.8 Å²	147.8	75%	0.754	82%	0.817	S	S	*	*			trans	-47.4	128.3	144.7	163.9	30.5	0	0	0	113.2
383	V	38.4	Very low	38.6	Very low	131 Å²	131	140.4 Å²	140.4	79%	0.794	79%	0.79	S	S	*	*			trans	-145.2	119	149.3	-179.5	0	0	0	0	108.4
384	S	35.7	Very low	39.5	Very low	102 Å²	102	140.4 Å²	140.4	71%	0.713	78%	0.782	S	S	*	*			trans	-92.2	140.4	174.4	-61.7	0	0	0	0	112.5
385	V	42.4	Very low	40.3	Very low	138 Å²	138	135.2 Å²	135.2	84%	0.836	77%	0.768	S	S	*	*			trans	-139	140.9	162.3	-178.5	0	0	0	0	108.1
386	E	36.9	Very low	41.4	Very low	186 Å²	186	134.2 Å²	134.2	87%	0.869	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-90.4	143.5	-162	-59.7	160.9	139.7	0	0	113.2
387	E	32.4	Very low	42.8	Very low	185 Å²	185	134.2 Å²	134.2	86%	0.864	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-84.2	143.5	167.2	-70.5	-166	138.2	0	0	111.4
388	P	42.3	Very low	44.4	Very low	122 Å²	122	135.1 Å²	135.1	79%	0.792	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-78.8	136	172	32	-33.2	0	0	0	112	E390	P388-E390 PolarHBondContact O-N 2.9Å
389	E	33	Very low	46.4	Very low	197 Å²	197	129.8 Å²	129.8	92%	0.921	72%	0.721	S	S	*	*			trans	-62.6	116	-172.3	-54.1	174.2	148.5	0	0	114.2
390	E	41.9	Very low	48.7	Very low	176 Å²	176	127.8 Å²	127.8	82%	0.822	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-79.8	141.7	156.5	-84.9	-136.2	150.1	0	0	110.8	P388 I392	P388-E390 PolarHBondContact O-N 2.9Å; E390-I392 PolarHBondContact O-N 2.93Å
391	S	42	Very low	50.8	Low	102 Å²	102	125.4 Å²	125.4	71%	0.713	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-62.7	116.6	-165.2	61.2	0	0	0	0	114.3	A393	S391-A393 PolarHBondContact O-N 3.44Å
392	I	48.3	Very low	53	Low	156 Å²	156	124.1 Å²	124.1	80%	0.8	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-57.4	116.9	170.1	-59.9	170.5	0	0	0	110	E390	E390-I392 PolarHBondContact O-N 2.93Å
393	A	52.1	Low	55.4	Low	44 Å²	44	121.4 Å²	121.4	36%	0.364	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-68.4	128.9	169.1	0	0	0	0	0	109.3	S391 S395	S391-A393 PolarHBondContact O-N 3.44Å; A393-S395 PolarHBondContact O-N 2.81Å
394	R	53.1	Low	57.5	Low	177 Å²	177	123.5 Å²	123.5	67%	0.668	65%	0.652	S	S	*	*			trans	-82.8	111.3	-174.7	-70.2	-178.5	177.2	176.5	-1.4	110.5	D396 I397	R394-D396 PolarHBondContact O-N 3.05Å; R394-I397 HydrophobicContact CB-CD1 3.77Å; R394-I397 HydrophobicContact CB-CG1 4.08Å
395	S	56.7	Low	59.6	Low	88 Å²	88	120 Å²	120	62%	0.615	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-23.6	175.2	42.8	0	0	0	0	114.2	A393 I397	A393-S395 PolarHBondContact O-N 2.81Å; S395-I397 VanDerWaalsContact C-N 3.34Å; S395-I397 PolarHBondContact O-N 3.26Å
396	D	59.1	Low	61.6	Low	151 Å²	151	117.3 Å²	117.3	81%	0.807	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	24.2	-159.9	-48.4	-17.6	0	0	0	113.1	R394	R394-D396 PolarHBondContact O-N 3.05Å
397	I	68	Low	63.9	Low	77 Å²	77	108.5 Å²	108.5	40%	0.395	57%	0.565	S	S	.	*	S	Bend	trans	-109.5	126.3	-177.5	-55.9	179.7	0	0	0	108.9	R394 S395 A421	R394-I397 HydrophobicContact CB-CD1 3.77Å; R394-I397 HydrophobicContact CB-CG1 4.08Å; S395-I397 VanDerWaalsContact C-N 3.34Å; S395-I397 PolarHBondContact O-N 3.26Å; I397-A421 VanDerWaalsContact O-CB 3.27Å; I397-A421 WeakPolarHBondContact O-CB 3.39Å
398	E	70	Confident	66.3	Low	174 Å²	174	104.8 Å²	104.8	81%	0.813	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-62.9	134.7	173.3	-64.4	-175.9	146.5	0	0	110.6	T400	E398-T400 PolarHBondContact O-N 3.24Å
399	P	78.4	Confident	68.5	Low	61 Å²	61	103.8 Å²	103.8	40%	0.396	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-63.3	131.9	-177.4	25.4	-33.9	0	0	0	110.8	A421 R422	P399-A421 HydrophobicContact CB-CB 3.84Å; P399-R422 HydrophobicContact CB-CG 3.89Å
400	T	82.5	Confident	70.9	Confident	53 Å²	53	95.7 Å²	95.7	33%	0.325	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-78.4	133.7	-175.6	67.6	0	0	0	0	111.2	E398 Y402 L405 E418 R422	E398-T400 PolarHBondContact O-N 3.24Å; T400-Y402 PolarHBondContact O-N 2.87Å; T400-L405 VanDerWaalsContact O-CD1 3.28Å; T400-L405 WeakPolarHBondContact O-CD1 2.85Å; T400-L405 WeakPolarHBondContact OG1-CD1 3.49Å; T400-L405 WeakPolarHBondContact OG1-CD2 3.37Å; T400-L405 WeakPolarHBondContact OG1-CG 3.46Å; T400-E418 WeakPolarHBondContact CB-OE1 3.29Å; T400-E418 VanDerWaalsContact CG2-OE1 3.24Å; T400-E418 WeakPolarHBondContact CG2-OE1 3.49Å; T400-E418 PolarHBondContact N-OE2 2.7Å; T400-E418 VanDerWaalsContact N-OE2 3.09Å; T400-E418 VanDerWaalsContact OG1-CD 3.25Å; T400-E418 PolarHBondContact OG1-OE1 3.3Å; T400-E418 PolarHBondContact OG1-OE2 3.29Å; T400-R422 PolarHBondContact O-NH2 3.3Å
401	H	84	Confident	73.3	Confident	85 Å²	85	94.3 Å²	94.3	39%	0.394	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-55	132.7	-173.8	-176.6	-88	0	0	0	112.8	S403 K404 D448	H401-S403 PolarHBondContact CE1-OG 3.29Å; H401-S403 PolarHBondContact ND1-N 3.48Å; H401-S403 PolarHBondContact ND1-OG 3.16Å; H401-S403 PolarHBondContact O-N 2.77Å; H401-K404 PolarHBondContact O-N 3.43Å; H401-D448 IonicContact NE2-OD2 2.9Å
402	Y	83.7	Confident	75.6	Confident	60 Å²	60	92.3 Å²	92.3	24%	0.235	48%	0.481	C	S	.	.	G	3₁₀ helix	trans	-46.4	-36.5	-171.3	68.2	-91.5	0	0	0	115.2	T400 K404 L405 E444 K445	T400-Y402 PolarHBondContact O-N 2.87Å; Y402-K404 PolarHBondContact O-N 3.11Å; Y402-K404 VanDerWaalsContact O-N 3.11Å; Y402-L405 PolarHBondContact O-N 3.05Å; Y402-E444 HydrophobicContact CD1-CB 4.08Å; Y402-K445 HydrophobicContact CD2-CB 4.01Å; Y402-K445 HydrophobicContact CD2-CD 4.2Å; Y402-K445 HydrophobicContact CD2-CG 4.21Å; Y402-K445 HydrophobicContact CE2-CB 3.93Å; Y402-K445 HydrophobicContact CE2-CD 4.11Å; Y402-K445 HydrophobicContact CE2-CG 3.8Å; Y402-K445 HydrophobicContact CG-CB 4.37Å
403	S	82.9	Confident	77.5	Confident	85 Å²	85	87.5 Å²	87.5	59%	0.594	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-68	-4.9	179.4	69.5	0	0	0	0	115.6	H401	H401-S403 PolarHBondContact CE1-OG 3.29Å; H401-S403 PolarHBondContact ND1-N 3.48Å; H401-S403 PolarHBondContact ND1-OG 3.16Å; H401-S403 PolarHBondContact O-N 2.77Å
404	K	82.4	Confident	79.4	Confident	175 Å²	175	88.1 Å²	88.1	76%	0.761	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-111.2	-3.8	178.8	-62.7	177.2	-178.2	171.6	0	113.7	H401 Y402	H401-K404 PolarHBondContact O-N 3.43Å; Y402-K404 PolarHBondContact O-N 3.11Å; Y402-K404 VanDerWaalsContact O-N 3.11Å
405	L	80	Confident	81.3	Confident	28 Å²	28	79.7 Å²	79.7	15%	0.147	43%	0.426	C	S	.	.			trans	-104.4	120.1	-177.1	-75.7	167.4	0	0	0	111.6	T400 Y402 L410 E418 L441	T400-L405 VanDerWaalsContact O-CD1 3.28Å; T400-L405 WeakPolarHBondContact O-CD1 2.85Å; T400-L405 WeakPolarHBondContact OG1-CD1 3.49Å; T400-L405 WeakPolarHBondContact OG1-CD2 3.37Å; T400-L405 WeakPolarHBondContact OG1-CG 3.46Å; Y402-L405 PolarHBondContact O-N 3.05Å; L405-L410 HydrophobicContact CD2-CD1 4.06Å; L405-L410 HydrophobicContact CD2-CD2 4.36Å; L405-E418 HydrophobicContact CD1-CG 4.46Å; L405-E418 HydrophobicContact CD2-CG 3.99Å; L405-L441 HydrophobicContact CB-CD1 3.84Å; L405-L441 HydrophobicContact CD1-CD1 3.94Å; L405-L441 HydrophobicContact CD1-CD2 3.87Å
406	D	84.4	Confident	83.1	Confident	81 Å²	81	79.8 Å²	79.8	43%	0.433	41%	0.413	S	S	.	.			trans	-100.7	95	157.9	-176.2	-5.6	0	0	0	109.6	N408 T409	D406-N408 PolarHBondContact O-N 3.37Å; D406-N408 WeakPolarHBondContact OD1-CB 3.41Å; D406-N408 PolarHBondContact OD1-N 2.9Å; D406-N408 VanDerWaalsContact OD1-N 3.08Å; D406-N408 PolarHBondContact OD1-ND2 2.83Å; D406-T409 HydrophobicContact CB-CG2 4.15Å; D406-T409 PolarHBondContact O-N 3.32Å; D406-T409 PolarHBondContact O-OG1 2.8Å; D406-T409 WeakPolarHBondContact OD2-CG2 3.27Å
407	V	84.2	Confident	84.6	Confident	2 Å²	2	74.8 Å²	74.8	1%	0.012	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-29.6	-177.7	-171.9	0	0	0	0	112.8	T409 L415 V434 L437 L441	V407-T409 VanDerWaalsContact C-N 3.34Å; V407-T409 PolarHBondContact O-N 3.49Å; V407-L415 HydrophobicContact CG1-CD2 3.95Å; V407-V434 HydrophobicContact CG1-CB 4.15Å; V407-V434 HydrophobicContact CG1-CG1 3.89Å; V407-V434 HydrophobicContact CG1-CG2 4.19Å; V407-L437 HydrophobicContact CG1-CB 4.28Å; V407-L437 HydrophobicContact CG1-CD2 4.26Å; V407-L437 HydrophobicContact CG2-CD2 4.37Å; V407-L437 HydrophobicContact CG2-CG 4.42Å; V407-L441 HydrophobicContact CG2-CD1 3.57Å
408	N	83.2	Confident	85.8	Confident	107 Å²	107	72.3 Å²	72.3	57%	0.572	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-30.4	-178.7	-58.1	-76.2	0	0	0	112.6	D406	D406-N408 PolarHBondContact O-N 3.37Å; D406-N408 WeakPolarHBondContact OD1-CB 3.41Å; D406-N408 PolarHBondContact OD1-N 2.9Å; D406-N408 VanDerWaalsContact OD1-N 3.08Å; D406-N408 PolarHBondContact OD1-ND2 2.83Å
409	T	87.7	Confident	86.9	Confident	101 Å²	101	64 Å²	64	62%	0.62	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-23.1	-174.9	65.9	0	0	0	0	113.8	D406 V407	D406-T409 HydrophobicContact CB-CG2 4.15Å; D406-T409 PolarHBondContact O-N 3.32Å; D406-T409 PolarHBondContact O-OG1 2.8Å; D406-T409 WeakPolarHBondContact OD2-CG2 3.27Å; V407-T409 VanDerWaalsContact C-N 3.34Å; V407-T409 PolarHBondContact O-N 3.49Å
410	L	84.5	Confident	87.5	Confident	26 Å²	26	62.4 Å²	62.4	14%	0.136	33%	0.326	C	S	.	.			trans	-61.6	147.4	-175	-63.4	175.5	0	0	0	113.1	L405 D414 L415 K430 L437	L405-L410 HydrophobicContact CD2-CD1 4.06Å; L405-L410 HydrophobicContact CD2-CD2 4.36Å; L410-D414 HydrophobicContact CB-CB 4.27Å; L410-D414 HydrophobicContact CD2-CB 4.1Å; L410-L415 HydrophobicContact CB-CD2 4.02Å; L410-L415 HydrophobicContact CB-CG 3.79Å; L410-L415 HydrophobicContact CD1-CD2 3.8Å; L410-L415 HydrophobicContact CD1-CG 4.31Å; L410-K430 WeakPolarHBondContact O-CE 3.48Å; L410-K430 PolarHBondContact O-NZ 2.69Å; L410-L437 HydrophobicContact CD1-CD2 3.89Å
411	K	91.2	Very high	87.9	Confident	147 Å²	147	60.7 Å²	60.7	64%	0.639	32%	0.318	S	S	*	.			trans	-80	169.3	169.3	-57.5	174.9	-178.5	174.2	0	110.6	S413 D414 L415	K411-S413 VanDerWaalsContact C-N 3.28Å; K411-S413 PolarHBondContact O-N 3.48Å; K411-D414 WeakPolarHBondContact CB-OD2 3.48Å; K411-D414 WeakPolarHBondContact CG-OD2 3.47Å; K411-D414 PolarHBondContact N-OD2 3.14Å; K411-D414 PolarHBondContact O-N 3.01Å; K411-D414 VanDerWaalsContact O-N 3.13Å; K411-L415 WeakPolarHBondContact O-CB 3.49Å; K411-L415 WeakPolarHBondContact O-CG 3.24Å; K411-L415 PolarHBondContact O-N 2.69Å
412	V	90.9	Very high	88.2	Confident	61 Å²	61	58.3 Å²	58.3	37%	0.37	31%	0.305	S	S	.	.	H	α-helix	trans	-63.7	-34.9	178.8	179.8	0	0	0	0	111.7	R416 K430 L433	V412-R416 WeakPolarHBondContact O-CB 3.19Å; V412-R416 WeakPolarHBondContact O-CG 3.39Å; V412-R416 PolarHBondContact O-N 2.79Å; V412-K430 HydrophobicContact CG2-CB 4.11Å; V412-K430 HydrophobicContact CG2-CD 4.28Å; V412-K430 HydrophobicContact CG2-CG 4.05Å; V412-L433 HydrophobicContact CG1-CD1 4Å
413	S	89.4	Confident	88.4	Confident	54 Å²	54	64.9 Å²	64.9	38%	0.378	34%	0.335	S	S	.	.	H	α-helix	trans	-55.6	-48.9	169.4	44.7	0	0	0	0	112.2	K411 R416 N417	K411-S413 VanDerWaalsContact C-N 3.28Å; K411-S413 PolarHBondContact O-N 3.48Å; S413-R416 PolarHBondContact O-N 3.33Å; S413-N417 PolarHBondContact O-N 3.49Å; S413-N417 PolarHBondContact O-ND2 2.84Å
414	D	91.1	Very high	88.7	Confident	57 Å²	57	63.7 Å²	63.7	31%	0.305	32%	0.321	S	S	.	.	H	α-helix	trans	-76.5	-39	-168.9	-35.2	-27.5	0	0	0	109.7	L410 K411 N417 E418	L410-D414 HydrophobicContact CB-CB 4.27Å; L410-D414 HydrophobicContact CD2-CB 4.1Å; K411-D414 WeakPolarHBondContact CB-OD2 3.48Å; K411-D414 WeakPolarHBondContact CG-OD2 3.47Å; K411-D414 PolarHBondContact N-OD2 3.14Å; K411-D414 PolarHBondContact O-N 3.01Å; K411-D414 VanDerWaalsContact O-N 3.13Å; D414-N417 PolarHBondContact O-N 3.4Å; D414-E418 PolarHBondContact O-N 2.95Å
415	L	93.3	Very high	89	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-58.3	-43.8	168.3	-72.4	165.4	0	0	0	112	V407 L410 K411 L419 K430 L433 V434 L437	V407-L415 HydrophobicContact CG1-CD2 3.95Å; L410-L415 HydrophobicContact CB-CD2 4.02Å; L410-L415 HydrophobicContact CB-CG 3.79Å; L410-L415 HydrophobicContact CD1-CD2 3.8Å; L410-L415 HydrophobicContact CD1-CG 4.31Å; K411-L415 WeakPolarHBondContact O-CB 3.49Å; K411-L415 WeakPolarHBondContact O-CG 3.24Å; K411-L415 PolarHBondContact O-N 2.69Å; L415-L419 VanDerWaalsContact O-CB 3.3Å; L415-L419 WeakPolarHBondContact O-CB 3.41Å; L415-L419 WeakPolarHBondContact O-CD1 3.5Å; L415-L419 WeakPolarHBondContact O-CG 3.18Å; L415-L419 PolarHBondContact O-N 3.31Å; L415-K430 HydrophobicContact CD1-CD 4.24Å; L415-K430 VanDerWaalsContact CD1-CE 3.48Å; L415-K430 HydrophobicContact CD1-CG 3.66Å; L415-L433 HydrophobicContact CB-CB 4.2Å; L415-L433 HydrophobicContact CD1-CB 4.38Å; L415-V434 HydrophobicContact CD1-CG2 3.75Å; L415-V434 HydrophobicContact CD2-CG2 4.08Å; L415-L437 HydrophobicContact CD2-CD2 3.84Å
416	R	94.2	Very high	89.7	Confident	90 Å²	90	59.6 Å²	59.6	34%	0.34	31%	0.31	S	S	.	.	H	α-helix	trans	-64.5	-40	176.1	-78.2	-176.8	171.6	169.4	1.7	111.9	V412 S413 A420 T426 L433	V412-R416 WeakPolarHBondContact O-CB 3.19Å; V412-R416 WeakPolarHBondContact O-CG 3.39Å; V412-R416 PolarHBondContact O-N 2.79Å; S413-R416 PolarHBondContact O-N 3.33Å; R416-A420 VanDerWaalsContact O-CB 3.28Å; R416-A420 WeakPolarHBondContact O-CB 3.45Å; R416-A420 PolarHBondContact O-N 3.44Å; R416-T426 HydrophobicContact CB-CG2 4.45Å; R416-T426 PolarHBondContact NE-O 3.06Å; R416-T426 WeakPolarHBondContact O-CG2 3.48Å; R416-L433 HydrophobicContact CG-CD1 4.15Å
417	N	90.3	Very high	89.9	Confident	47 Å²	47	61.7 Å²	61.7	25%	0.251	32%	0.315	S	S	.	.	H	α-helix	trans	-67.4	-45.7	177.5	-68.8	-27.6	0	0	0	112.1	S413 D414 L419 A420 A421	S413-N417 PolarHBondContact O-N 3.49Å; S413-N417 PolarHBondContact O-ND2 2.84Å; D414-N417 PolarHBondContact O-N 3.4Å; N417-L419 VanDerWaalsContact C-N 3.31Å; N417-L419 PolarHBondContact O-N 2.99Å; N417-A420 PolarHBondContact O-N 3.1Å; N417-A421 WeakPolarHBondContact O-CB 3.3Å; N417-A421 PolarHBondContact O-N 3.44Å
418	E	92.4	Very high	90.1	Very high	24 Å²	24	63.6 Å²	63.6	11%	0.112	34%	0.335	C	S	.	.	H	α-helix	trans	-68.3	-27.1	177.9	-73.2	-68.1	165.7	0	0	113.5	T400 L405 D414 R422 L437	T400-E418 WeakPolarHBondContact CB-OE1 3.29Å; T400-E418 VanDerWaalsContact CG2-OE1 3.24Å; T400-E418 WeakPolarHBondContact CG2-OE1 3.49Å; T400-E418 PolarHBondContact N-OE2 2.7Å; T400-E418 VanDerWaalsContact N-OE2 3.09Å; T400-E418 VanDerWaalsContact OG1-CD 3.25Å; T400-E418 PolarHBondContact OG1-OE1 3.3Å; T400-E418 PolarHBondContact OG1-OE2 3.29Å; L405-E418 HydrophobicContact CD1-CG 4.46Å; L405-E418 HydrophobicContact CD2-CG 3.99Å; D414-E418 PolarHBondContact O-N 2.95Å; E418-R422 WeakPolarHBondContact O-CG 3.11Å; E418-R422 PolarHBondContact O-N 2.99Å; E418-R422 PolarHBondContact O-NH1 3.45Å; E418-R422 IonicContact OE2-CZ 2.78Å; E418-R422 IonicContact OE2-NH1 3.2Å; E418-R422 PolarHBondContact OE2-NH1 2.93Å; E418-L437 HydrophobicContact CB-CD1 4Å; E418-L437 HydrophobicContact CB-CD2 3.77Å
419	L	93.3	Very high	90.4	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-74	-44.2	169.5	-73.2	167.4	0	0	0	111.4	L415 N417 A421 R422 K423 L424 T426 L433 R436 L437	L415-L419 VanDerWaalsContact O-CB 3.3Å; L415-L419 WeakPolarHBondContact O-CB 3.41Å; L415-L419 WeakPolarHBondContact O-CD1 3.5Å; L415-L419 WeakPolarHBondContact O-CG 3.18Å; L415-L419 PolarHBondContact O-N 3.31Å; N417-L419 VanDerWaalsContact C-N 3.31Å; N417-L419 PolarHBondContact O-N 2.99Å; L419-A421 PolarHBondContact O-N 3.32Å; L419-R422 CarbonylContact O-C 3.46Å; L419-R422 WeakPolarHBondContact O-CA 3.33Å; L419-R422 PolarHBondContact O-N 3.05Å; L419-R422 VanDerWaalsContact O-N 3.12Å; L419-K423 PolarHBondContact O-N 3.18Å; L419-L424 HydrophobicContact CB-CB 4.23Å; L419-L424 HydrophobicContact CD2-CB 3.7Å; L419-L424 HydrophobicContact CD2-CD1 3.77Å; L419-L424 HydrophobicContact CD2-CG 4.4Å; L419-L424 PolarHBondContact O-N 2.86Å; L419-T426 HydrophobicContact CB-CG2 4.17Å; L419-L433 HydrophobicContact CD1-CB 3.84Å; L419-L433 HydrophobicContact CD1-CD2 3.64Å; L419-L433 HydrophobicContact CD1-CG 4.3Å; L419-R436 HydrophobicContact CD2-CB 4.08Å; L419-R436 HydrophobicContact CD2-CG 3.79Å; L419-L437 HydrophobicContact CD2-CB 3.94Å; L419-L437 HydrophobicContact CD2-CD1 4.3Å; L419-L437 HydrophobicContact CG-CB 4.3Å
420	A	91.9	Very high	90.5	Very high	27 Å²	27	63.9 Å²	63.9	22%	0.223	33%	0.328	C	S	.	.	H	α-helix	trans	-61.1	-44.2	176.5	0	0	0	0	0	112.1	R416 N417 R422 K423 T426	R416-A420 VanDerWaalsContact O-CB 3.28Å; R416-A420 WeakPolarHBondContact O-CB 3.45Å; R416-A420 PolarHBondContact O-N 3.44Å; N417-A420 PolarHBondContact O-N 3.1Å; A420-R422 PolarHBondContact O-N 3.34Å; A420-K423 WeakPolarHBondContact O-CA 3.22Å; A420-K423 PolarHBondContact O-N 3.34Å; A420-T426 HydrophobicContact CB-CG2 4.07Å
421	A	90.1	Very high	90.8	Very high	18 Å²	18	68 Å²	68	15%	0.149	35%	0.354	C	S	.	.	H	α-helix	trans	-59.7	-29.5	174.9	0	0	0	0	0	112.9	I397 P399 N417 L419	I397-A421 VanDerWaalsContact O-CB 3.27Å; I397-A421 WeakPolarHBondContact O-CB 3.39Å; P399-A421 HydrophobicContact CB-CB 3.84Å; N417-A421 WeakPolarHBondContact O-CB 3.3Å; N417-A421 PolarHBondContact O-N 3.44Å; L419-A421 PolarHBondContact O-N 3.32Å
422	R	91.6	Very high	90.8	Very high	35 Å²	35	65 Å²	65	13%	0.132	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	3.2	173.2	-71	177.5	171	74.9	7.5	114.3	P399 T400 E418 L419 A420 L424 L441 E444	P399-R422 HydrophobicContact CB-CG 3.89Å; T400-R422 PolarHBondContact O-NH2 3.3Å; E418-R422 WeakPolarHBondContact O-CG 3.11Å; E418-R422 PolarHBondContact O-N 2.99Å; E418-R422 PolarHBondContact O-NH1 3.45Å; E418-R422 IonicContact OE2-CZ 2.78Å; E418-R422 IonicContact OE2-NH1 3.2Å; E418-R422 PolarHBondContact OE2-NH1 2.93Å; L419-R422 CarbonylContact O-C 3.46Å; L419-R422 WeakPolarHBondContact O-CA 3.33Å; L419-R422 PolarHBondContact O-N 3.05Å; L419-R422 VanDerWaalsContact O-N 3.12Å; A420-R422 PolarHBondContact O-N 3.34Å; R422-L424 HydrophobicContact CB-CD1 3.8Å; R422-L424 HydrophobicContact CB-CG 4.01Å; R422-L424 PolarHBondContact O-N 3.05Å; R422-L441 VanDerWaalsContact CZ-CD2 3.47Å; R422-E444 IonicContact CZ-OE1 2.82Å; R422-E444 IonicContact CZ-OE2 3.42Å; R422-E444 IonicContact NE-OE1 3.73Å; R422-E444 PolarHBondContact NE-OE1 2.81Å; R422-E444 IonicContact NE-OE2 3.09Å; R422-E444 IonicContact NH2-OE1 3.79Å; R422-E444 PolarHBondContact NH2-OE1 2.78Å; R422-E444 VanDerWaalsContact NH2-OE1 3.14Å; R422-E444 IonicContact NH2-OE2 3.44Å; R422-E444 PolarHBondContact NH2-OE2 2.99Å
423	K	87.3	Confident	90.9	Very high	198 Å²	198	62.1 Å²	62.1	86%	0.861	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	32.2	-176.2	-52.1	-179.1	-177	178.8	0	113.6	L419 A420	L419-K423 PolarHBondContact O-N 3.18Å; A420-K423 WeakPolarHBondContact O-CA 3.22Å; A420-K423 PolarHBondContact O-N 3.34Å
424	L	89.3	Confident	91.1	Very high	59 Å²	59	60.8 Å²	60.8	31%	0.309	32%	0.317	S	S	.	.			trans	-99.2	152.3	177.1	-64.1	169.4	0	0	0	111	L419 R422 T426 A440	L419-L424 HydrophobicContact CB-CB 4.23Å; L419-L424 HydrophobicContact CD2-CB 3.7Å; L419-L424 HydrophobicContact CD2-CD1 3.77Å; L419-L424 HydrophobicContact CD2-CG 4.4Å; L419-L424 PolarHBondContact O-N 2.86Å; R422-L424 HydrophobicContact CB-CD1 3.8Å; R422-L424 HydrophobicContact CB-CG 4.01Å; R422-L424 PolarHBondContact O-N 3.05Å; L424-T426 PolarHBondContact O-N 2.9Å; L424-A440 HydrophobicContact CD1-CB 3.61Å
425	D	89.3	Confident	91.1	Very high	74 Å²	74	60.9 Å²	60.9	40%	0.396	33%	0.326	S	S	.	.			trans	-53	131.6	177.4	172.3	31.2	0	0	0	112.1	K427 R436	D425-K427 VanDerWaalsContact OD1-CB 3.25Å; D425-K427 WeakPolarHBondContact OD1-CB 3.45Å; D425-K427 WeakPolarHBondContact OD1-CG 3.46Å; D425-K427 PolarHBondContact OD1-N 3.42Å; D425-R436 VanDerWaalsContact CG-NH1 3.34Å; D425-R436 VanDerWaalsContact O-CD 3.24Å; D425-R436 WeakPolarHBondContact O-CD 3.42Å; D425-R436 PolarHBondContact O-NH1 3.12Å; D425-R436 IonicContact OD2-CZ 2.75Å; D425-R436 IonicContact OD2-NH1 3.15Å; D425-R436 PolarHBondContact OD2-NH1 3.25Å; D425-R436 IonicContact OD2-NH2 3.2Å; D425-R436 PolarHBondContact OD2-NH2 3.43Å
426	T	93.3	Very high	91.1	Very high	43 Å²	43	64.2 Å²	64.2	26%	0.264	34%	0.338	S	S	.	.			trans	-103.8	-4.8	-179.8	59.3	0	0	0	0	113.3	R416 L419 A420 L424 L433	R416-T426 HydrophobicContact CB-CG2 4.45Å; R416-T426 PolarHBondContact NE-O 3.06Å; R416-T426 WeakPolarHBondContact O-CG2 3.48Å; L419-T426 HydrophobicContact CB-CG2 4.17Å; A420-T426 HydrophobicContact CB-CG2 4.07Å; L424-T426 PolarHBondContact O-N 2.9Å; T426-L433 WeakPolarHBondContact O-CD2 3.32Å
427	K	89.6	Confident	91.1	Very high	126 Å²	126	59.9 Å²	59.9	55%	0.548	32%	0.322	S	S	.	.			trans	-77.9	145.6	174.4	-56.6	175.1	-176.9	175	0	110.1	E366 D425 R436	E366-K427 IonicContact OE1-NZ 2.67Å; E366-K427 PolarHBondContact OE1-NZ 3.39Å; D425-K427 VanDerWaalsContact OD1-CB 3.25Å; D425-K427 WeakPolarHBondContact OD1-CB 3.45Å; D425-K427 WeakPolarHBondContact OD1-CG 3.46Å; D425-K427 PolarHBondContact OD1-N 3.42Å; K427-R436 PolarHBondContact O-NH1 2.75Å
428	G	87.5	Confident	91.2	Very high	42 Å²	42	61.2 Å²	61.2	43%	0.433	33%	0.326	S	S	.	.	S	Bend	trans	122.1	172.1	174.2	0	0	0	0	0	116.4
429	L	89.3	Confident	91.1	Very high	130 Å²	130	63.2 Å²	63.2	68%	0.681	34%	0.343	S	S	*	.			trans	-67.9	155.2	176.3	-67.8	169	0	0	0	111.7	V431 N432 L433	L429-V431 PolarHBondContact O-N 3.01Å; L429-V431 VanDerWaalsContact O-N 3.07Å; L429-N432 WeakPolarHBondContact O-CA 3.44Å; L429-N432 WeakPolarHBondContact O-CB 3.19Å; L429-N432 PolarHBondContact O-N 3.09Å; L429-L433 PolarHBondContact O-N 3.39Å; L429-L433 VanDerWaalsContact O-N 3.13Å
430	K	90.9	Very high	90.9	Very high	83 Å²	83	63.9 Å²	63.9	36%	0.361	35%	0.349	S	S	.	.	H	α-helix	trans	-49.7	-41.6	-179.1	-168.1	-173.8	-177.8	-169.9	0	112.9	L410 V412 L415 N432 L433 V434	L410-K430 WeakPolarHBondContact O-CE 3.48Å; L410-K430 PolarHBondContact O-NZ 2.69Å; V412-K430 HydrophobicContact CG2-CB 4.11Å; V412-K430 HydrophobicContact CG2-CD 4.28Å; V412-K430 HydrophobicContact CG2-CG 4.05Å; L415-K430 HydrophobicContact CD1-CD 4.24Å; L415-K430 VanDerWaalsContact CD1-CE 3.48Å; L415-K430 HydrophobicContact CD1-CG 3.66Å; K430-N432 VanDerWaalsContact C-N 3.3Å; K430-N432 PolarHBondContact O-N 3.02Å; K430-L433 PolarHBondContact O-N 3.5Å; K430-V434 HydrophobicContact CG-CG2 4.2Å; K430-V434 WeakPolarHBondContact O-CB 3.43Å; K430-V434 WeakPolarHBondContact O-CG2 3.42Å; K430-V434 PolarHBondContact O-N 2.93Å
431	V	91.1	Very high	90.9	Very high	113 Å²	113	63.1 Å²	63.1	69%	0.685	34%	0.341	S	S	*	.	H	α-helix	trans	-60.5	-38.8	179.1	-176.8	0	0	0	0	112	L429 A435	L429-V431 PolarHBondContact O-N 3.01Å; L429-V431 VanDerWaalsContact O-N 3.07Å; V431-A435 WeakPolarHBondContact O-CB 3.43Å; V431-A435 PolarHBondContact O-N 3.36Å
432	N	90.1	Very high	90.8	Very high	84 Å²	84	65.4 Å²	65.4	45%	0.449	35%	0.351	S	S	.	.	H	α-helix	trans	-71.2	-40.8	178.1	-60.7	10	0	0	0	110.8	L429 K430 A435 R436	L429-N432 WeakPolarHBondContact O-CA 3.44Å; L429-N432 WeakPolarHBondContact O-CB 3.19Å; L429-N432 PolarHBondContact O-N 3.09Å; K430-N432 VanDerWaalsContact C-N 3.3Å; K430-N432 PolarHBondContact O-N 3.02Å; N432-A435 PolarHBondContact O-N 3.18Å; N432-R436 WeakPolarHBondContact O-CB 3.18Å; N432-R436 PolarHBondContact O-N 3Å
433	L	93.3	Very high	90.5	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-64.4	-43.6	176.4	-57.4	177.2	0	0	0	111.4	V412 L415 R416 L419 T426 L429 K430 R436 L437	V412-L433 HydrophobicContact CG1-CD1 4Å; L415-L433 HydrophobicContact CB-CB 4.2Å; L415-L433 HydrophobicContact CD1-CB 4.38Å; R416-L433 HydrophobicContact CG-CD1 4.15Å; L419-L433 HydrophobicContact CD1-CB 3.84Å; L419-L433 HydrophobicContact CD1-CD2 3.64Å; L419-L433 HydrophobicContact CD1-CG 4.3Å; T426-L433 WeakPolarHBondContact O-CD2 3.32Å; L429-L433 PolarHBondContact O-N 3.39Å; L429-L433 VanDerWaalsContact O-N 3.13Å; K430-L433 PolarHBondContact O-N 3.5Å; L433-R436 PolarHBondContact O-N 3.36Å; L433-L437 WeakPolarHBondContact O-CB 3.46Å; L433-L437 PolarHBondContact O-N 2.78Å
434	V	93.4	Very high	90.4	Very high	27 Å²	27	63 Å²	63	16%	0.164	34%	0.344	C	S	.	.	H	α-helix	trans	-57.1	-55.2	172.6	162.2	0	0	0	0	110.4	V407 L415 K430 R436 L437 Q438	V407-V434 HydrophobicContact CG1-CB 4.15Å; V407-V434 HydrophobicContact CG1-CG1 3.89Å; V407-V434 HydrophobicContact CG1-CG2 4.19Å; L415-V434 HydrophobicContact CD1-CG2 3.75Å; L415-V434 HydrophobicContact CD2-CG2 4.08Å; K430-V434 HydrophobicContact CG-CG2 4.2Å; K430-V434 WeakPolarHBondContact O-CB 3.43Å; K430-V434 WeakPolarHBondContact O-CG2 3.42Å; K430-V434 PolarHBondContact O-N 2.93Å; V434-R436 VanDerWaalsContact C-N 3.31Å; V434-R436 PolarHBondContact O-N 2.72Å; V434-L437 PolarHBondContact O-N 2.88Å; V434-Q438 VanDerWaalsContact O-CB 3.27Å; V434-Q438 WeakPolarHBondContact O-CB 3.36Å; V434-Q438 PolarHBondContact O-N 3.36Å
435	A	91.8	Very high	90.3	Very high	58 Å²	58	65.7 Å²	65.7	48%	0.479	35%	0.353	S	S	.	.	H	α-helix	trans	-61.1	-38.7	-178.3	0	0	0	0	0	112.9	V431 N432 S439	V431-A435 WeakPolarHBondContact O-CB 3.43Å; V431-A435 PolarHBondContact O-N 3.36Å; N432-A435 PolarHBondContact O-N 3.18Å; A435-S439 PolarHBondContact O-N 3.04Å
436	R	93.7	Very high	89.9	Confident	70 Å²	70	69.4 Å²	69.4	26%	0.264	37%	0.366	S	S	.	.	H	α-helix	trans	-67.1	-41.5	178.3	-171	-177.9	-67.1	149.1	-9	112.1	L419 D425 K427 N432 L433 V434 A440	L419-R436 HydrophobicContact CD2-CB 4.08Å; L419-R436 HydrophobicContact CD2-CG 3.79Å; D425-R436 VanDerWaalsContact CG-NH1 3.34Å; D425-R436 VanDerWaalsContact O-CD 3.24Å; D425-R436 WeakPolarHBondContact O-CD 3.42Å; D425-R436 PolarHBondContact O-NH1 3.12Å; D425-R436 IonicContact OD2-CZ 2.75Å; D425-R436 IonicContact OD2-NH1 3.15Å; D425-R436 PolarHBondContact OD2-NH1 3.25Å; D425-R436 IonicContact OD2-NH2 3.2Å; D425-R436 PolarHBondContact OD2-NH2 3.43Å; K427-R436 PolarHBondContact O-NH1 2.75Å; N432-R436 WeakPolarHBondContact O-CB 3.18Å; N432-R436 PolarHBondContact O-N 3Å; L433-R436 PolarHBondContact O-N 3.36Å; V434-R436 VanDerWaalsContact C-N 3.31Å; V434-R436 PolarHBondContact O-N 2.72Å; R436-A440 PolarHBondContact O-N 2.96Å
437	L	93.3	Very high	89.1	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-70.5	-44.6	175.4	-173.9	60.5	0	0	0	110.8	V407 L410 L415 E418 L419 L433 V434 S439 A440 L441	V407-L437 HydrophobicContact CG1-CB 4.28Å; V407-L437 HydrophobicContact CG1-CD2 4.26Å; V407-L437 HydrophobicContact CG2-CD2 4.37Å; V407-L437 HydrophobicContact CG2-CG 4.42Å; L410-L437 HydrophobicContact CD1-CD2 3.89Å; L415-L437 HydrophobicContact CD2-CD2 3.84Å; E418-L437 HydrophobicContact CB-CD1 4Å; E418-L437 HydrophobicContact CB-CD2 3.77Å; L419-L437 HydrophobicContact CD2-CB 3.94Å; L419-L437 HydrophobicContact CD2-CD1 4.3Å; L419-L437 HydrophobicContact CG-CB 4.3Å; L433-L437 WeakPolarHBondContact O-CB 3.46Å; L433-L437 PolarHBondContact O-N 2.78Å; V434-L437 PolarHBondContact O-N 2.88Å; L437-S439 VanDerWaalsContact C-N 3.31Å; L437-S439 PolarHBondContact O-N 3.18Å; L437-A440 PolarHBondContact O-N 3.41Å; L437-A440 VanDerWaalsContact O-N 3.1Å; L437-L441 HydrophobicContact CD1-CD2 4.37Å; L437-L441 HydrophobicContact CG-CG 4.42Å; L437-L441 WeakPolarHBondContact O-CG 3.3Å; L437-L441 PolarHBondContact O-N 2.9Å
438	Q	92.6	Very high	88.2	Confident	74 Å²	74	70.5 Å²	70.5	35%	0.346	39%	0.388	S	S	.	.	H	α-helix	trans	-53.6	-46.4	177.8	-162	88.2	43.5	0	0	111.7	V434 A440 L441 D442	V434-Q438 VanDerWaalsContact O-CB 3.27Å; V434-Q438 WeakPolarHBondContact O-CB 3.36Å; V434-Q438 PolarHBondContact O-N 3.36Å; Q438-A440 VanDerWaalsContact C-N 3.34Å; Q438-A440 PolarHBondContact O-N 3.3Å; Q438-L441 PolarHBondContact O-N 2.73Å; Q438-D442 PolarHBondContact O-N 2.77Å
439	S	91.2	Very high	86.8	Confident	66 Å²	66	71.3 Å²	71.3	46%	0.462	39%	0.39	S	S	.	.	H	α-helix	trans	-61.9	-39.8	178.4	-162.4	0	0	0	0	112.6	A435 L437 D442 E443	A435-S439 PolarHBondContact O-N 3.04Å; L437-S439 VanDerWaalsContact C-N 3.31Å; L437-S439 PolarHBondContact O-N 3.18Å; S439-D442 PolarHBondContact O-N 3.46Å; S439-E443 WeakPolarHBondContact O-CG 3.15Å; S439-E443 PolarHBondContact O-N 2.86Å; S439-E443 VanDerWaalsContact O-N 3.07Å
440	A	89.2	Confident	84.8	Confident	15 Å²	15	70.9 Å²	70.9	12%	0.124	40%	0.396	C	S	.	.	H	α-helix	trans	-69	-39.1	177.6	0	0	0	0	0	112.2	L424 R436 L437 Q438 D442 E443 E444	L424-A440 HydrophobicContact CD1-CB 3.61Å; R436-A440 PolarHBondContact O-N 2.96Å; L437-A440 PolarHBondContact O-N 3.41Å; L437-A440 VanDerWaalsContact O-N 3.1Å; Q438-A440 VanDerWaalsContact C-N 3.34Å; Q438-A440 PolarHBondContact O-N 3.3Å; A440-D442 VanDerWaalsContact C-N 3.34Å; A440-D442 PolarHBondContact O-N 3.17Å; A440-E443 PolarHBondContact O-N 3.06Å; A440-E444 WeakPolarHBondContact O-CG 3.41Å; A440-E444 PolarHBondContact O-N 2.99Å
441	L	91	Very high	82.3	Confident	10 Å²	10	76.5 Å²	76.5	5%	0.052	42%	0.423	C	S	.	.	H	α-helix	trans	-65.9	-35.6	174.6	-59.8	-167.4	0	0	0	112.3	L405 V407 R422 L437 Q438 E443 K445	L405-L441 HydrophobicContact CB-CD1 3.84Å; L405-L441 HydrophobicContact CD1-CD1 3.94Å; L405-L441 HydrophobicContact CD1-CD2 3.87Å; V407-L441 HydrophobicContact CG2-CD1 3.57Å; R422-L441 VanDerWaalsContact CZ-CD2 3.47Å; L437-L441 HydrophobicContact CD1-CD2 4.37Å; L437-L441 HydrophobicContact CG-CG 4.42Å; L437-L441 WeakPolarHBondContact O-CG 3.3Å; L437-L441 PolarHBondContact O-N 2.9Å; Q438-L441 PolarHBondContact O-N 2.73Å; L441-E443 VanDerWaalsContact C-N 3.3Å; L441-K445 WeakPolarHBondContact O-CB 3.48Å; L441-K445 PolarHBondContact O-N 3.38Å
442	D	87.5	Confident	79.9	Confident	66 Å²	66	78.5 Å²	78.5	35%	0.353	43%	0.43	S	S	.	.	H	α-helix	trans	-75.2	-16.5	174.8	-80.5	-34	0	0	0	113.2	Q438 S439 A440 K446	Q438-D442 PolarHBondContact O-N 2.77Å; S439-D442 PolarHBondContact O-N 3.46Å; A440-D442 VanDerWaalsContact C-N 3.34Å; A440-D442 PolarHBondContact O-N 3.17Å; D442-K446 VanDerWaalsContact O-CD 3.3Å; D442-K446 WeakPolarHBondContact O-CD 3.31Å; D442-K446 VanDerWaalsContact O-CG 3.24Å; D442-K446 WeakPolarHBondContact O-CG 3.48Å
443	E	86.8	Confident	77.5	Confident	125 Å²	125	82.1 Å²	82.1	58%	0.584	45%	0.448	S	S	*	.	H	α-helix	trans	-84.1	-45.9	168.6	-77.1	176.5	176.2	0	0	111.8	S439 A440 L441 K445 K446 A447	S439-E443 WeakPolarHBondContact O-CG 3.15Å; S439-E443 PolarHBondContact O-N 2.86Å; S439-E443 VanDerWaalsContact O-N 3.07Å; A440-E443 PolarHBondContact O-N 3.06Å; L441-E443 VanDerWaalsContact C-N 3.3Å; E443-K445 VanDerWaalsContact C-N 3.28Å; E443-K445 PolarHBondContact O-N 3.43Å; E443-K446 PolarHBondContact O-N 2.9Å; E443-A447 PolarHBondContact O-N 2.77Å
444	E	85.5	Confident	74.7	Confident	58 Å²	58	91 Å²	91	27%	0.271	49%	0.486	S	S	.	.	H	α-helix	trans	-50.6	-49.9	169.9	-76.3	173	-168.6	0	0	110.8	Y402 R422 A440 K446 A447 D448	Y402-E444 HydrophobicContact CD1-CB 4.08Å; R422-E444 IonicContact CZ-OE1 2.82Å; R422-E444 IonicContact CZ-OE2 3.42Å; R422-E444 IonicContact NE-OE1 3.73Å; R422-E444 PolarHBondContact NE-OE1 2.81Å; R422-E444 IonicContact NE-OE2 3.09Å; R422-E444 IonicContact NH2-OE1 3.79Å; R422-E444 PolarHBondContact NH2-OE1 2.78Å; R422-E444 VanDerWaalsContact NH2-OE1 3.14Å; R422-E444 IonicContact NH2-OE2 3.44Å; R422-E444 PolarHBondContact NH2-OE2 2.99Å; A440-E444 WeakPolarHBondContact O-CG 3.41Å; A440-E444 PolarHBondContact O-N 2.99Å; E444-K446 PolarHBondContact O-N 2.81Å; E444-A447 PolarHBondContact O-N 3.41Å; E444-A447 VanDerWaalsContact O-N 3.11Å; E444-D448 PolarHBondContact O-N 3.09Å
445	K	85.9	Confident	71.9	Confident	116 Å²	116	96.6 Å²	96.6	50%	0.504	51%	0.514	S	S	.	.	H	α-helix	trans	-67.6	-16.3	179.6	-176.9	178.3	170.3	-165.7	0	114.7	Y402 L441 E443	Y402-K445 HydrophobicContact CD2-CB 4.01Å; Y402-K445 HydrophobicContact CD2-CD 4.2Å; Y402-K445 HydrophobicContact CD2-CG 4.21Å; Y402-K445 HydrophobicContact CE2-CB 3.93Å; Y402-K445 HydrophobicContact CE2-CD 4.11Å; Y402-K445 HydrophobicContact CE2-CG 3.8Å; Y402-K445 HydrophobicContact CG-CB 4.37Å; L441-K445 WeakPolarHBondContact O-CB 3.48Å; L441-K445 PolarHBondContact O-N 3.38Å; E443-K445 VanDerWaalsContact C-N 3.28Å; E443-K445 PolarHBondContact O-N 3.43Å
446	K	80.8	Confident	69.3	Low	152 Å²	152	101 Å²	101	66%	0.661	53%	0.53	S	S	*	.	H	α-helix	trans	-89.7	-32.6	170	-77.2	168.7	-171.7	162.3	0	112.1	D442 E443 E444 A449	D442-K446 VanDerWaalsContact O-CD 3.3Å; D442-K446 WeakPolarHBondContact O-CD 3.31Å; D442-K446 VanDerWaalsContact O-CG 3.24Å; D442-K446 WeakPolarHBondContact O-CG 3.48Å; E443-K446 PolarHBondContact O-N 2.9Å; E444-K446 PolarHBondContact O-N 2.81Å; K446-A449 WeakPolarHBondContact O-CB 3.27Å; K446-A449 PolarHBondContact O-N 2.92Å
447	A	76.9	Confident	66.8	Low	87 Å²	87	107.2 Å²	107.2	72%	0.719	56%	0.561	S	S	*	*	H	α-helix	trans	-68.7	-34.7	176	0	0	0	0	0	112.3	E443 E444 A449	E443-A447 PolarHBondContact O-N 2.77Å; E444-A447 PolarHBondContact O-N 3.41Å; E444-A447 VanDerWaalsContact O-N 3.11Å; A447-A449 PolarHBondContact O-N 3.3Å
448	D	70.8	Confident	64	Low	105 Å²	105	116.2 Å²	116.2	56%	0.561	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	1.2	173.7	-94.8	-18.6	0	0	0	114.2	H401 E444 P450	H401-D448 IonicContact NE2-OD2 2.9Å; E444-D448 PolarHBondContact O-N 3.09Å; D448-P450 WeakPolarHBondContact O-CD 3.23Å
449	A	57.8	Low	61.6	Low	58 Å²	58	120.2 Å²	120.2	48%	0.479	63%	0.626	S	S	.	*	S	Bend	trans	-83.3	118.8	176.3	0	0	0	0	0	110.4	K446 A447 E451	K446-A449 WeakPolarHBondContact O-CB 3.27Å; K446-A449 PolarHBondContact O-N 2.92Å; A447-A449 PolarHBondContact O-N 3.3Å; A449-E451 PolarHBondContact O-N 3.11Å
450	P	47.7	Very low	59.1	Low	122 Å²	122	126.5 Å²	126.5	79%	0.792	65%	0.645	S	S	*	*			trans	-66.3	132.4	177.3	27	-33.7	0	0	0	110.9	D448 D452	D448-P450 WeakPolarHBondContact O-CD 3.23Å; P450-D452 PolarHBondContact O-N 2.89Å
451	E	37.3	Very low	56.6	Low	201 Å²	201	129.7 Å²	129.7	94%	0.939	67%	0.671	S	S	*	*			trans	-67.1	97.7	175.5	-71.6	-164.2	149.5	0	0	111.4	A449	A449-E451 PolarHBondContact O-N 3.11Å
452	D	41.6	Very low	54	Low	154 Å²	154	137.2 Å²	137.2	82%	0.824	71%	0.706	S	S	*	*			trans	-149.3	158.4	164.3	-132.2	-31	0	0	0	111.9	P450	P450-D452 PolarHBondContact O-N 2.89Å
453	I	38.8	Very low	51.7	Low	161 Å²	161	142.9 Å²	142.9	83%	0.826	73%	0.731	S	S	*	*			trans	68.3	84.1	-177.8	-46.4	-179.3	0	0	0	115.1
454	K	36.1	Very low	49.3	Very low	186 Å²	186	142.2 Å²	142.2	81%	0.809	74%	0.735	S	S	*	*			trans	-69.9	164.4	159.6	-72.2	166	171.5	157.9	0	112.7
455	I	33.6	Very low	47.1	Very low	145 Å²	145	145 Å²	145	74%	0.744	76%	0.758	S	S	*	*			trans	71.3	107.6	154.1	-64.9	146.5	0	0	0	116.6
456	D	37.7	Very low	44.8	Very low	151 Å²	151	146 Å²	146	81%	0.807	77%	0.769	S	S	*	*				174.1	111.2	115.1	-99.5	-29.1	0	0	0	111.3
457	E	40.1	Very low	42.6	Very low	199 Å²	199	147 Å²	147	93%	0.93	77%	0.773	S	S	*	*			trans	171	70.3	146.9	-98.5	-170	-178.6	0	0	111.4
458	E	34.8	Very low	40.8	Very low	189 Å²	189	150.3 Å²	150.3	88%	0.883	78%	0.777	S	S	*	*			trans	-104	-176.1	157.5	-77.1	-163.7	127.2	0	0	110.3
459	I	42.3	Very low	39.1	Very low	159 Å²	159	150 Å²	150	82%	0.815	78%	0.783	S	S	*	*			trans	82.7	77.4	173.6	-43.7	166.9	0	0	0	115.9
460	K	39.9	Very low	38.2	Very low	197 Å²	197	152.6 Å²	152.6	86%	0.857	80%	0.798	S	S	*	*				-167.9	93	125.6	-98.6	144.4	-169.2	162.7	0	109.7
461	A	35.8	Very low	37.8	Very low	83 Å²	83	152.5 Å²	152.5	69%	0.686	80%	0.797	S	S	*	*				70.5	90.2	89.1	0	0	0	0	0	111.7
462	E	36	Very low	37.8	Very low	167 Å²	167	148.6 Å²	148.6	78%	0.78	79%	0.792	S	S	*	*				78.3	115	69.1	-73.2	-163.6	120.4	0	0	115.4
463	Q	39.5	Very low	37.7	Very low	186 Å²	186	145 Å²	145	87%	0.869	78%	0.784	S	S	*	*			trans	178.7	96.2	141.3	-97.7	149	98.7	0	0	107
464	T	37.2	Very low	37.6	Very low	111 Å²	111	143.2 Å²	143.2	68%	0.681	78%	0.781	S	S	*	*				62.5	151.2	68.8	71.7	0	0	0	0	114.9
465	P	37.7	Very low	37.8	Very low	115 Å²	115	142.1 Å²	142.1	75%	0.747	78%	0.778	S	S	*	*			cis	-113.3	-160.8	-8.8	43.7	-31.5	0	0	0	110.2
466	N	37.5	Very low	37.9	Very low	138 Å²	138	140.6 Å²	140.6	74%	0.738	78%	0.778	S	S	*	*			cis	-153	150.6	-10.6	-118.6	-9.4	0	0	0	104.2
467	K	35.6	Very low	37.8	Very low	174 Å²	174	142.9 Å²	142.9	76%	0.757	78%	0.781	S	S	*	*			cis	101.8	109.8	34.7	-170.1	179.2	-175.7	173.6	0	113.6
468	I	38.6	Very low	37.7	Very low	155 Å²	155	140.3 Å²	140.3	80%	0.795	77%	0.774	S	S	*	*			trans	170.2	98.9	143.6	-86.7	151.9	0	0	0	104.3
469	S	36.5	Very low	37.8	Very low	98 Å²	98	138.1 Å²	138.1	69%	0.685	77%	0.768	S	S	*	*				61.1	130.7	72.7	75.1	0	0	0	0	113.3
470	S	38.5	Very low	38	Very low	114 Å²	114	134.6 Å²	134.6	80%	0.797	76%	0.757	S	S	*	*			cis	-157.9	-170.9	26.4	82.1	0	0	0	0	111.7
471	P	38.7	Very low	38.7	Very low	119 Å²	119	134.6 Å²	134.6	77%	0.773	76%	0.757	S	S	*	*			trans	-131.4	-154.8	-131.6	41.6	-19.7	0	0	0	116.5
472	S	37.3	Very low	39.7	Very low	120 Å²	120	137.5 Å²	137.5	84%	0.839	76%	0.761	S	S	*	*			trans	92.1	135.7	178.6	-153.2	0	0	0	0	114.3
473	A	38.9	Very low	41.2	Very low	78 Å²	78	132.5 Å²	132.5	65%	0.645	74%	0.739	S	S	*	*			cis	-142.6	135.6	-0.6	0	0	0	0	0	108.9
474	T	36.7	Very low	43.1	Very low	123 Å²	123	126.9 Å²	126.9	76%	0.755	72%	0.721	S	S	*	*				73.3	136.6	92.8	-41.7	0	0	0	0	115.9
475	Q	40.8	Very low	45.3	Very low	163 Å²	163	126 Å²	126	76%	0.762	71%	0.709	S	S	*	*			trans	78	159.3	-174.5	-50	-57.2	-15.2	0	0	114.6
476	P	36.6	Very low	47.6	Very low	114 Å²	114	128 Å²	128	74%	0.74	71%	0.706	S	S	*	*				-111.1	175.4	-93.4	8.2	14.9	0	0	0	113.1
477	K	35.4	Very low	49.8	Very low	198 Å²	198	124.8 Å²	124.8	86%	0.861	69%	0.689	S	S	*	*			trans	-69.9	130.1	166.1	-70	-176.6	176.2	-175.8	0	109.9
478	D	38.1	Very low	52.2	Low	146 Å²	146	121.2 Å²	121.2	78%	0.781	67%	0.67	S	S	*	*			trans	-112.4	125.4	159.8	-170.7	4.9	0	0	0	106.4	S480	D478-S480 PolarHBondContact O-N 2.99Å
479	D	37.3	Very low	54.6	Low	143 Å²	143	119.8 Å²	119.8	77%	0.765	66%	0.655	S	S	*	*			trans	-83.5	65.1	-172.9	-75.2	-48	0	0	0	110.6	K481	D479-K481 PolarHBondContact O-N 2.94Å
480	S	45	Very low	57.1	Low	84 Å²	84	121.1 Å²	121.1	59%	0.587	65%	0.645	S	S	*	*			trans	-58.5	119.2	172.5	55.6	0	0	0	0	110.3	D478 D482	D478-S480 PolarHBondContact O-N 2.99Å; S480-D482 PolarHBondContact O-N 3.09Å
481	K	54.6	Low	59.4	Low	198 Å²	198	117.1 Å²	117.1	86%	0.861	62%	0.615	S	S	*	*			trans	-72	71.5	178.9	-69.1	173.8	-179.5	163.9	0	111.7	D479 L483	D479-K481 PolarHBondContact O-N 2.94Å; K481-L483 PolarHBondContact O-N 3.41Å
482	D	57.8	Low	61.8	Low	143 Å²	143	114.5 Å²	114.5	77%	0.765	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-51.5	126.5	165.1	-82.5	-14.9	0	0	0	109.3	S480 S484	S480-D482 PolarHBondContact O-N 3.09Å; D482-S484 PolarHBondContact O-N 3.45Å
483	L	67.9	Low	64.3	Low	62 Å²	62	117.3 Å²	117.3	33%	0.325	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-55.7	127.3	171.8	-110.3	76.2	0	0	0	108.7	L360 V362 K481 E485 L491	L360-L483 HydrophobicContact CD2-CD2 4.23Å; V362-L483 HydrophobicContact CG2-CD1 3.58Å; K481-L483 PolarHBondContact O-N 3.41Å; L483-E485 PolarHBondContact O-N 2.62Å; L483-L491 HydrophobicContact CD2-CD2 4.45Å
484	S	78.3	Confident	66.7	Low	69 Å²	69	115.1 Å²	115.1	48%	0.483	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-46.4	135.6	177.7	-174.7	0	0	0	0	109.9	D482 K486 D487 R488	D482-S484 PolarHBondContact O-N 3.45Å; S484-K486 PolarHBondContact O-N 2.71Å; S484-D487 WeakPolarHBondContact O-CA 3.48Å; S484-D487 PolarHBondContact O-N 3.37Å; S484-R488 PolarHBondContact O-N 2.85Å
485	E	84.1	Confident	69.2	Low	91 Å²	91	109.7 Å²	109.7	43%	0.425	53%	0.527	S	S	.	.	H	α-helix	trans	-58	-26.2	-173.5	-149.8	-148.3	166.6	0	0	112.2	L483 R488 R489	L483-E485 PolarHBondContact O-N 2.62Å; E485-R488 IonicContact OE1-NH2 2.97Å; E485-R488 PolarHBondContact OE1-NH2 3.45Å; E485-R489 VanDerWaalsContact CD-CZ 3.47Å; E485-R489 WeakPolarHBondContact O-CB 3.48Å; E485-R489 WeakPolarHBondContact O-CD 3.39Å; E485-R489 WeakPolarHBondContact O-CG 3.24Å; E485-R489 PolarHBondContact O-N 3.39Å; E485-R489 IonicContact OE1-CZ 3.67Å; E485-R489 IonicContact OE1-NE 3.02Å; E485-R489 PolarHBondContact OE1-NE 2.85Å; E485-R489 IonicContact OE1-NH2 2.59Å; E485-R489 PolarHBondContact OE1-NH2 3.34Å; E485-R489 IonicContact OE2-CZ 3.65Å; E485-R489 IonicContact OE2-NE 2.72Å; E485-R489 IonicContact OE2-NH2 3.77Å; E485-R489 PolarHBondContact OE2-NH2 3.4Å
486	K	85.4	Confident	71.4	Confident	157 Å²	157	110.7 Å²	110.7	68%	0.683	52%	0.524	S	S	*	.	H	α-helix	trans	-62.5	-41.1	171.5	-178	-175	174.7	-169.1	0	113.1	S484 R490	S484-K486 PolarHBondContact O-N 2.71Å; K486-R490 PolarHBondContact O-N 3.5Å
487	D	84.6	Confident	74	Confident	71 Å²	71	106.2 Å²	106.2	38%	0.38	49%	0.494	S	S	.	.	H	α-helix	trans	-83.9	-37.7	-177.7	-63.4	-47.8	0	0	0	111.4	S484 R489 R490 L491	S484-D487 WeakPolarHBondContact O-CA 3.48Å; S484-D487 PolarHBondContact O-N 3.37Å; D487-R489 PolarHBondContact O-N 3.45Å; D487-R490 WeakPolarHBondContact O-CA 3.2Å; D487-R490 WeakPolarHBondContact O-CB 3.3Å; D487-R490 PolarHBondContact O-N 3.27Å; D487-L491 PolarHBondContact O-N 2.97Å
488	R	86.3	Confident	76.5	Confident	99 Å²	99	98.2 Å²	98.2	37%	0.374	47%	0.468	S	S	.	.	H	α-helix	trans	-53.2	-53.2	163.8	175	168.1	77.6	97.2	-7.8	110.7	L360 S484 E485 R490 L491 E492	L360-R488 HydrophobicContact CD1-CG 4.41Å; L360-R488 HydrophobicContact CD2-CB 3.99Å; L360-R488 HydrophobicContact CD2-CG 3.73Å; S484-R488 PolarHBondContact O-N 2.85Å; E485-R488 IonicContact OE1-NH2 2.97Å; E485-R488 PolarHBondContact OE1-NH2 3.45Å; R488-R490 PolarHBondContact O-N 2.87Å; R488-L491 PolarHBondContact O-N 2.89Å; R488-L491 VanDerWaalsContact O-N 3.14Å; R488-E492 HydrophobicContact CG-CG 4.29Å; R488-E492 VanDerWaalsContact CG-OE1 3.26Å; R488-E492 WeakPolarHBondContact CG-OE1 3.16Å; R488-E492 IonicContact CZ-OE1 3.49Å; R488-E492 IonicContact NE-OE1 2.91Å; R488-E492 IonicContact NH1-OE1 2.77Å; R488-E492 PolarHBondContact NH1-OE1 2.88Å; R488-E492 WeakPolarHBondContact O-CB 3.28Å; R488-E492 VanDerWaalsContact O-CG 3.29Å; R488-E492 WeakPolarHBondContact O-CG 3.35Å; R488-E492 PolarHBondContact O-N 3.25Å
489	R	88	Confident	78.9	Confident	126 Å²	126	98 Å²	98	48%	0.475	47%	0.466	S	S	.	.	H	α-helix	trans	-64.9	-15.8	174.6	-70.1	171.4	-176.8	-166.7	8.8	113.6	E485 D487 R493	E485-R489 VanDerWaalsContact CD-CZ 3.47Å; E485-R489 WeakPolarHBondContact O-CB 3.48Å; E485-R489 WeakPolarHBondContact O-CD 3.39Å; E485-R489 WeakPolarHBondContact O-CG 3.24Å; E485-R489 PolarHBondContact O-N 3.39Å; E485-R489 IonicContact OE1-CZ 3.67Å; E485-R489 IonicContact OE1-NE 3.02Å; E485-R489 PolarHBondContact OE1-NE 2.85Å; E485-R489 IonicContact OE1-NH2 2.59Å; E485-R489 PolarHBondContact OE1-NH2 3.34Å; E485-R489 IonicContact OE2-CZ 3.65Å; E485-R489 IonicContact OE2-NE 2.72Å; E485-R489 IonicContact OE2-NH2 3.77Å; E485-R489 PolarHBondContact OE2-NH2 3.4Å; D487-R489 PolarHBondContact O-N 3.45Å; R489-R493 PolarHBondContact O-NE 2.98Å; R489-R493 PolarHBondContact O-NH2 2.83Å
490	R	89	Confident	81.4	Confident	125 Å²	125	97.2 Å²	97.2	47%	0.472	46%	0.456	S	S	.	.	H	α-helix	trans	-77.7	-51.2	169.2	177.3	-175.7	172.3	-175.2	-3.7	109	D176 K486 D487 R488 E492 R493 L494	D176-R490 IonicContact OD2-CZ 3.5Å; D176-R490 IonicContact OD2-NH2 3.97Å; D176-R490 PolarHBondContact OD2-NH2 3.24Å; K486-R490 PolarHBondContact O-N 3.5Å; D487-R490 WeakPolarHBondContact O-CA 3.2Å; D487-R490 WeakPolarHBondContact O-CB 3.3Å; D487-R490 PolarHBondContact O-N 3.27Å; R488-R490 PolarHBondContact O-N 2.87Å; R490-E492 PolarHBondContact O-N 3.13Å; R490-R493 WeakPolarHBondContact O-CA 3.47Å; R490-R493 WeakPolarHBondContact O-CB 3.49Å; R490-R493 PolarHBondContact O-N 3.39Å; R490-L494 HydrophobicContact CG-CD1 4.22Å; R490-L494 HydrophobicContact CG-CG 4.49Å; R490-L494 WeakPolarHBondContact O-CG 3.4Å; R490-L494 PolarHBondContact O-N 2.71Å; R490-L494 VanDerWaalsContact O-N 3.09Å
491	L	86.8	Confident	83.7	Confident	30 Å²	30	94.8 Å²	94.8	16%	0.157	44%	0.438	C	S	.	.	H	α-helix	trans	-61.4	-45.3	-177.9	-146.1	64.7	0	0	0	111.9	L356 Q359 L360 L483 D487 R488 R493 L494 Y495	L356-L491 HydrophobicContact CD1-CB 3.88Å; L356-L491 HydrophobicContact CD1-CD2 4Å; L356-L491 HydrophobicContact CD1-CG 3.72Å; Q359-L491 HydrophobicContact CB-CD2 3.67Å; L360-L491 HydrophobicContact CD2-CD2 3.89Å; L360-L491 HydrophobicContact CG-CD2 4.18Å; L483-L491 HydrophobicContact CD2-CD2 4.45Å; D487-L491 PolarHBondContact O-N 2.97Å; R488-L491 PolarHBondContact O-N 2.89Å; R488-L491 VanDerWaalsContact O-N 3.14Å; L491-R493 PolarHBondContact O-N 3.34Å; L491-R493 VanDerWaalsContact O-N 3.11Å; L491-L494 HydrophobicContact CD1-CD1 4.4Å; L491-L494 PolarHBondContact O-N 3.41Å; L491-Y495 HydrophobicContact CD1-CD2 4.46Å; L491-Y495 HydrophobicContact CD1-CE2 4.16Å; L491-Y495 HydrophobicContact CG-CD2 4.24Å; L491-Y495 HydrophobicContact CG-CE2 4.34Å; L491-Y495 PolarHBondContact O-N 3.02Å; L491-Y495 VanDerWaalsContact O-N 3.07Å
492	E	89.3	Confident	85.7	Confident	65 Å²	65	85.7 Å²	85.7	30%	0.304	40%	0.401	S	S	.	.	H	α-helix	trans	-54.8	-28.2	171.3	-72.7	169.6	176	0	0	113.1	L356 R488 R490 R496	L356-E492 HydrophobicContact CD2-CG 4.41Å; R488-E492 HydrophobicContact CG-CG 4.29Å; R488-E492 VanDerWaalsContact CG-OE1 3.26Å; R488-E492 WeakPolarHBondContact CG-OE1 3.16Å; R488-E492 IonicContact CZ-OE1 3.49Å; R488-E492 IonicContact NE-OE1 2.91Å; R488-E492 IonicContact NH1-OE1 2.77Å; R488-E492 PolarHBondContact NH1-OE1 2.88Å; R488-E492 WeakPolarHBondContact O-CB 3.28Å; R488-E492 VanDerWaalsContact O-CG 3.29Å; R488-E492 WeakPolarHBondContact O-CG 3.35Å; R488-E492 PolarHBondContact O-N 3.25Å; R490-E492 PolarHBondContact O-N 3.13Å; E492-R496 VanDerWaalsContact O-CB 3.27Å; E492-R496 WeakPolarHBondContact O-CB 3.34Å
493	R	89.1	Confident	87.4	Confident	179 Å²	179	79.1 Å²	79.1	68%	0.675	37%	0.365	S	S	*	.	H	α-helix	trans	-87.1	-23.3	175.3	-82.3	178.9	-71.9	149	3.9	113.8	R489 R490 L491	R489-R493 PolarHBondContact O-NE 2.98Å; R489-R493 PolarHBondContact O-NH2 2.83Å; R490-R493 WeakPolarHBondContact O-CA 3.47Å; R490-R493 WeakPolarHBondContact O-CB 3.49Å; R490-R493 PolarHBondContact O-N 3.39Å; L491-R493 PolarHBondContact O-N 3.34Å; L491-R493 VanDerWaalsContact O-N 3.11Å
494	L	88.8	Confident	88.7	Confident	32 Å²	32	77.8 Å²	77.8	17%	0.168	36%	0.36	C	S	.	.	H	α-helix	trans	-78.3	-37.3	177	-65.8	176.1	0	0	0	111.6	F173 H174 V177 R490 L491	F173-L494 WeakPolarHBondContact CD1-O 3.42Å; H174-L494 HydrophobicContact CB-CD2 3.66Å; V177-L494 HydrophobicContact CG2-CB 3.85Å; R490-L494 HydrophobicContact CG-CD1 4.22Å; R490-L494 HydrophobicContact CG-CG 4.49Å; R490-L494 WeakPolarHBondContact O-CG 3.4Å; R490-L494 PolarHBondContact O-N 2.71Å; R490-L494 VanDerWaalsContact O-N 3.09Å; L491-L494 HydrophobicContact CD1-CD1 4.4Å; L491-L494 PolarHBondContact O-N 3.41Å
495	Y	90.4	Very high	89.5	Confident	8 Å²	8	74.5 Å²	74.5	3%	0.031	34%	0.337	C	S	.	.	S	Bend	trans	-93.6	-1.1	-177.5	-75.5	-87.6	0	0	0	114.7	V177 Y352 I355 L356 Q359 L491 L497	V177-Y495 HydrophobicContact CG1-CD1 4.43Å; V177-Y495 HydrophobicContact CG1-CE1 3.72Å; V177-Y495 HydrophobicContact CG2-CE2 4.15Å; Y352-Y495 AromaticContact CD1-CD1 3.97Å; Y352-Y495 HydrophobicContact CD1-CD1 3.97Å; Y352-Y495 HydrophobicContact CD1-CE1 4.13Å; I355-Y495 HydrophobicContact CB-CE1 4.15Å; I355-Y495 HydrophobicContact CG2-CD1 4.32Å; I355-Y495 HydrophobicContact CG2-CE1 3.55Å; L356-Y495 HydrophobicContact CB-CG 4.11Å; L356-Y495 HydrophobicContact CD1-CD2 4.15Å; L356-Y495 HydrophobicContact CD1-CG 4.43Å; Q359-Y495 PolarHBondContact NE2-OH 2.75Å; Q359-Y495 PolarHBondContact OE1-OH 2.85Å; L491-Y495 HydrophobicContact CD1-CD2 4.46Å; L491-Y495 HydrophobicContact CD1-CE2 4.16Å; L491-Y495 HydrophobicContact CG-CD2 4.24Å; L491-Y495 HydrophobicContact CG-CE2 4.34Å; L491-Y495 PolarHBondContact O-N 3.02Å; L491-Y495 VanDerWaalsContact O-N 3.07Å; Y495-L497 PolarHBondContact O-N 2.85Å
496	R	86.9	Confident	90	Very high	185 Å²	185	71 Å²	71	70%	0.698	32%	0.32	S	S	*	.			trans	-78.6	103.2	-177	179.5	175.4	177	177.1	0.6	112.9	H171 E492	H171-R496 PolarHBondContact CE1-O 3.47Å; E492-R496 VanDerWaalsContact O-CB 3.27Å; E492-R496 WeakPolarHBondContact O-CB 3.34Å
497	L	90.2	Very high	90.4	Very high	19 Å²	19	63.8 Å²	63.8	10%	0.099	29%	0.289	C	S	.	.			trans	-68.7	158.6	166.9	-72.7	154.9	0	0	0	112.9	H171 F173 W345 T348 K349 Y352 Y495	H171-L497 HydrophobicContact CB-CD2 4.41Å; H171-L497 VanDerWaalsContact CD2-CD2 3.46Å; H171-L497 WeakPolarHBondContact CD2-CD2 3.27Å; F173-L497 HydrophobicContact CE2-CD2 4.42Å; F173-L497 HydrophobicContact CZ-CD2 3.92Å; F173-L497 HydrophobicContact CZ-CG 4.12Å; W345-L497 HydrophobicContact CH2-CD2 3.46Å; W345-L497 VanDerWaalsContact CH2-CD2 3.46Å; W345-L497 HydrophobicContact CZ2-CB 4.34Å; W345-L497 HydrophobicContact CZ2-CD2 4Å; W345-L497 HydrophobicContact CZ3-CD2 3.99Å; T348-L497 HydrophobicContact CG2-CD1 4.11Å; K349-L497 HydrophobicContact CB-CD1 4.43Å; K349-L497 HydrophobicContact CG-CB 4.07Å; K349-L497 HydrophobicContact CG-CD1 4Å; Y352-L497 HydrophobicContact CD2-CD1 3.69Å; Y352-L497 HydrophobicContact CG-CD1 4.2Å; Y495-L497 PolarHBondContact O-N 2.85Å
498	G	88.6	Confident	90.7	Very high	31 Å²	31	60.5 Å²	60.5	32%	0.32	27%	0.272	S	S	.	.			trans	-83.5	165.2	176.5	0	0	0	0	0	113.7	W345 K349	W345-G498 PolarHBondContact NE1-O 3.32Å; W345-G498 VanDerWaalsContact NE1-O 3.09Å; K349-G498 WeakPolarHBondContact CE-O 3.37Å; K349-G498 PolarHBondContact NZ-O 2.77Å
499	D	89.3	Confident	90.7	Very high	140 Å²	140	60 Å²	60	75%	0.749	27%	0.273	S	S	*	.	S	Bend	trans	-67.7	-54.6	-178.6	-64.2	-51.6	0	0	0	112	W345 K349	W345-D499 PolarHBondContact NE1-O 3.49Å; W345-D499 VanDerWaalsContact NE1-O 3.11Å; K349-D499 PolarHBondContact NZ-O 3.09Å
500	K	90.1	Very high	90.6	Very high	127 Å²	127	56.9 Å²	56.9	55%	0.552	27%	0.27	S	S	*	.	S	Bend	trans	-65.2	144.3	175.3	-69	-171.7	172.4	-171.8	0	112.3	E211 W345	E211-K500 IonicContact OE1-NZ 3.64Å; E211-K500 PolarHBondContact OE1-NZ 3.26Å; E211-K500 IonicContact OE2-NZ 2.87Å; E211-K500 PolarHBondContact OE2-NZ 3.36Å; W345-K500 VanDerWaalsContact CE2-O 3.25Å; W345-K500 VanDerWaalsContact CZ2-O 3.31Å; W345-K500 WeakPolarHBondContact CZ2-O 3.13Å; W345-K500 PolarHBondContact NE1-O 3.03Å
501	P	93.5	Very high	90.5	Very high	33 Å²	33	50.9 Å²	50.9	21%	0.214	25%	0.247	C	C	.	.			trans	-56.5	141	168.9	-24.1	34.5	0	0	0	113.1	I339 P340 E342 W345	I339-P501 HydrophobicContact CG2-CB 4.11Å; P340-P501 HydrophobicContact CG-CB 4.27Å; P340-P501 VanDerWaalsContact O-CB 3.27Å; P340-P501 WeakPolarHBondContact O-CB 3.28Å; E342-P501 HydrophobicContact CG-CG 4.21Å; W345-P501 HydrophobicContact CB-CB 4.18Å; W345-P501 HydrophobicContact CB-CG 4.13Å; W345-P501 HydrophobicContact CD2-CB 4.36Å; W345-P501 HydrophobicContact CG-CB 4.02Å; W345-P501 HydrophobicContact CG-CG 4.09Å
502	A	94.7	Very high	90.2	Very high	8 Å²	8	51 Å²	51	7%	0.066	25%	0.246	C	C	.	.			trans	-150.3	156.4	177.6	0	0	0	0	0	110.6	D169 H171 P340 W345	D169-A502 HydrophobicContact CB-CB 4.42Å; D169-A502 WeakPolarHBondContact O-CA 3.36Å; H171-A502 HydrophobicContact CB-CB 4.11Å; P340-A502 WeakPolarHBondContact CD-O 3.3Å; P340-A502 WeakPolarHBondContact CG-O 3.17Å; W345-A502 HydrophobicContact CH2-CB 3.99Å; W345-A502 HydrophobicContact CZ2-CB 4.33Å; W345-A502 WeakPolarHBondContact CZ3-O 3.45Å
503	I	94.7	Very high	89.7	Confident	5 Å²	5	49.9 Å²	49.9	3%	0.026	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	126.4	175	-64.4	162.2	0	0	0	108.4	D169 Y170 H171 L284 A335 L338 I339 I505	D169-I503 PolarHBondContact O-N 3.21Å; Y170-I503 CarbonylContact C-O 3.58Å; Y170-I503 VanDerWaalsContact CA-O 3.27Å; Y170-I503 WeakPolarHBondContact CA-O 3.25Å; Y170-I503 HydrophobicContact CD1-CB 3.66Å; Y170-I503 HydrophobicContact CD1-CD1 4.29Å; Y170-I503 HydrophobicContact CD1-CG2 3.91Å; Y170-I503 HydrophobicContact CE1-CB 3.91Å; Y170-I503 HydrophobicContact CE1-CD1 3.64Å; Y170-I503 HydrophobicContact CE1-CG1 4.36Å; Y170-I503 HydrophobicContact CE1-CG2 4.08Å; H171-I503 PolarHBondContact N-O 2.8Å; L284-I503 HydrophobicContact CD1-CG2 4.16Å; L284-I503 HydrophobicContact CD2-CG2 3.59Å; A335-I503 HydrophobicContact CB-CD1 4.35Å; L338-I503 HydrophobicContact CB-CD1 3.75Å; L338-I503 HydrophobicContact CB-CG1 4Å; I339-I503 HydrophobicContact CG1-CD1 4.19Å; I339-I503 HydrophobicContact CG1-CG1 4.31Å; I503-I505 HydrophobicContact CG2-CD1 4.46Å
504	V	94.5	Very high	89.4	Confident	34 Å²	34	43.5 Å²	43.5	21%	0.206	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	134.1	-177.7	-179.3	0	0	0	0	110.7	H171 F173 W345 T348 H506	H171-V504 WeakPolarHBondContact O-CA 3.36Å; F173-V504 HydrophobicContact CD2-CG1 3.62Å; F173-V504 HydrophobicContact CE2-CG1 3.52Å; W345-V504 HydrophobicContact CH2-CG2 4.48Å; W345-V504 HydrophobicContact CZ3-CG2 3.86Å; T348-V504 HydrophobicContact CG2-CG2 4.32Å; V504-H506 VanDerWaalsContact CG1-CE1 3.42Å; V504-H506 WeakPolarHBondContact CG1-CE1 3.5Å
505	I	95	Very high	89.2	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	130.8	177.9	-59.8	-65	0	0	0	109.4	Y170 H171 V172 F173 L238 T282 L284 I503 C518	Y170-I505 HydrophobicContact CD1-CD1 4.34Å; Y170-I505 HydrophobicContact CD1-CG1 4.21Å; H171-I505 PolarHBondContact O-N 3.34Å; V172-I505 HydrophobicContact CB-CB 4.42Å; V172-I505 HydrophobicContact CG1-CB 4.31Å; V172-I505 HydrophobicContact CG1-CG2 4.07Å; V172-I505 HydrophobicContact CG2-CB 4.13Å; V172-I505 HydrophobicContact CG2-CG1 4.45Å; V172-I505 HydrophobicContact CG2-CG2 4.39Å; F173-I505 PolarHBondContact N-O 3.34Å; L238-I505 HydrophobicContact CD1-CG1 4.42Å; L238-I505 HydrophobicContact CD2-CD1 3.75Å; L238-I505 HydrophobicContact CD2-CG1 3.84Å; L238-I505 HydrophobicContact CD2-CG2 4.28Å; T282-I505 HydrophobicContact CG2-CG2 4.36Å; L284-I505 HydrophobicContact CB-CD1 4.15Å; L284-I505 HydrophobicContact CD2-CD1 3.73Å; I503-I505 HydrophobicContact CG2-CD1 4.46Å; I505-C518 HydrophobicContact CG2-CB 4.19Å
506	H	94	Very high	89.2	Confident	16 Å²	16	49.7 Å²	49.7	7%	0.074	26%	0.263	C	S	.	.			trans	-116.8	107.3	172.6	-61.6	93.1	0	0	0	109.1	F173 P179 T282 Y352 V504 N508	F173-H506 AromaticContact CD2-CD2 3.69Å; F173-H506 AromaticContact CD2-CE1 3.99Å; F173-H506 AromaticContact CD2-NE2 3.32Å; F173-H506 VanDerWaalsContact CD2-NE2 3.32Å; F173-H506 WeakPolarHBondContact CD2-NE2 3.5Å; F173-H506 AromaticContact CE2-NE2 3.75Å; P179-H506 HydrophobicContact CB-CB 4.12Å; T282-H506 CarbonylContact C-O 3.58Å; T282-H506 VanDerWaalsContact CA-O 3.28Å; T282-H506 WeakPolarHBondContact CA-O 3.42Å; T282-H506 PolarHBondContact O-N 2.85Å; Y352-H506 AromaticContact CZ-NE2 3.94Å; Y352-H506 PolarHBondContact OH-CE1 2.93Å; Y352-H506 PolarHBondContact OH-NE2 2.77Å; V504-H506 VanDerWaalsContact CG1-CE1 3.42Å; V504-H506 WeakPolarHBondContact CG1-CE1 3.5Å; H506-N508 PolarHBondContact O-N 3.48Å
507	P	93.7	Very high	89.5	Confident	6 Å²	6	41.6 Å²	41.6	4%	0.039	23%	0.234	C	C	.	.			trans	-61.6	129.3	175.9	-16.7	28.7	0	0	0	110.3	V172 F173 R175 K509 F516 C518	V172-P507 HydrophobicContact CG1-CG 3.96Å; F173-P507 WeakPolarHBondContact O-CD 3.48Å; F173-P507 WeakPolarHBondContact O-CG 3.4Å; R175-P507 HydrophobicContact CB-CB 4.38Å; P507-K509 PolarHBondContact O-N 2.82Å; P507-F516 HydrophobicContact CB-CD1 4.1Å; P507-F516 HydrophobicContact CB-CE1 4.2Å; P507-C518 HydrophobicContact CB-CB 4.45Å; P507-C518 HydrophobicContact CG-CB 4.01Å
508	N	91.2	Very high	89.7	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.011	23%	0.23	C	C	.	.			trans	-66.6	105	178.1	-173.8	-11.8	0	0	0	110.5	L183 S185 G280 L281 H506 S510 A511	L183-N508 HydrophobicContact CD1-CB 4.42Å; L183-N508 HydrophobicContact CD2-CB 4.07Å; S185-N508 PolarHBondContact OG-ND2 2.79Å; G280-N508 VanDerWaalsContact O-CB 3.3Å; G280-N508 WeakPolarHBondContact O-CB 3.25Å; G280-N508 PolarHBondContact O-ND2 3.02Å; L281-N508 PolarHBondContact O-N 2.79Å; H506-N508 PolarHBondContact O-N 3.48Å; N508-S510 PolarHBondContact O-N 3.5Å; N508-S510 VanDerWaalsContact O-N 3.16Å; N508-S510 WeakPolarHBondContact OD1-CB 3.32Å; N508-S510 PolarHBondContact OD1-N 2.99Å; N508-A511 HydrophobicContact CB-CB 4Å; N508-A511 WeakPolarHBondContact O-CB 3.28Å; N508-A511 PolarHBondContact O-N 2.72Å; N508-A511 VanDerWaalsContact O-N 3.09Å
509	K	87.5	Confident	89.9	Confident	90 Å²	90	40.2 Å²	40.2	39%	0.391	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.6	-178.8	69.6	-177.4	177.5	-173.1	0	114.4	R175 D178 P507 G514	R175-K509 HydrophobicContact CB-CB 4.32Å; D178-K509 VanDerWaalsContact OD1-CE 3.22Å; D178-K509 WeakPolarHBondContact OD1-CE 3.38Å; D178-K509 IonicContact OD1-NZ 3.14Å; D178-K509 PolarHBondContact OD1-NZ 3.07Å; D178-K509 IonicContact OD2-NZ 3.46Å; D178-K509 PolarHBondContact OD2-NZ 2.94Å; P507-K509 PolarHBondContact O-N 2.82Å; K509-G514 CarbonylContact O-C 3.55Å; K509-G514 VanDerWaalsContact O-CA 3.24Å; K509-G514 WeakPolarHBondContact O-CA 3.36Å
510	S	86	Confident	90.1	Very high	59 Å²	59	38.5 Å²	38.5	41%	0.413	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-32.5	174.6	-54.9	0	0	0	0	112.5	N508 G514	N508-S510 PolarHBondContact O-N 3.5Å; N508-S510 VanDerWaalsContact O-N 3.16Å; N508-S510 WeakPolarHBondContact OD1-CB 3.32Å; N508-S510 PolarHBondContact OD1-N 2.99Å; S510-G514 PolarHBondContact O-N 2.85Å
511	A	85.8	Confident	90.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63	151.1	-170.3	0	0	0	0	0	113.8	L188 L281 N508 G513 G514 F516	L188-A511 HydrophobicContact CD1-CB 3.63Å; L281-A511 HydrophobicContact CD2-CB 3.95Å; N508-A511 HydrophobicContact CB-CB 4Å; N508-A511 WeakPolarHBondContact O-CB 3.28Å; N508-A511 PolarHBondContact O-N 2.72Å; N508-A511 VanDerWaalsContact O-N 3.09Å; A511-G513 VanDerWaalsContact C-N 3.28Å; A511-G513 PolarHBondContact O-N 2.99Å; A511-G514 PolarHBondContact O-N 2.86Å; A511-F516 HydrophobicContact CB-CB 3.95Å; A511-F516 HydrophobicContact CB-CD1 4.36Å; A511-F516 HydrophobicContact CB-CG 4.17Å; A511-F516 VanDerWaalsContact O-CB 3.28Å; A511-F516 WeakPolarHBondContact O-CB 3.44Å; A511-F516 PolarHBondContact O-N 2.7Å
512	K	81.7	Confident	90.5	Very high	32 Å²	32	32.6 Å²	32.6	14%	0.139	18%	0.177	C	C	.	.	H	α-helix	trans	45	47	179.7	-64.3	-147.7	174	-151.4	0	113.9	M248 A310 H537	M248-K512 HydrophobicContact SD-CD 4.14Å; A310-K512 PolarHBondContact O-NZ 3.48Å; K512-H537 PolarHBondContact NZ-NE2 3.41Å
513	G	78.5	Confident	90.5	Very high	42 Å²	42	32.2 Å²	32.2	43%	0.433	17%	0.173	S	C	.	.	H	α-helix	trans	77.5	41	173.2	0	0	0	0	0	114.2	A511 R515	A511-G513 VanDerWaalsContact C-N 3.28Å; A511-G513 PolarHBondContact O-N 2.99Å; G513-R515 VanDerWaalsContact C-N 3.32Å; G513-R515 PolarHBondContact O-N 2.82Å
514	G	82.4	Confident	90.5	Very high	45 Å²	45	35.1 Å²	35.1	46%	0.464	19%	0.186	S	C	.	.	H	α-helix	trans	75.4	12.6	172.9	0	0	0	0	0	115.8	K509 S510 A511	K509-G514 CarbonylContact O-C 3.55Å; K509-G514 VanDerWaalsContact O-CA 3.24Å; K509-G514 WeakPolarHBondContact O-CA 3.36Å; S510-G514 PolarHBondContact O-N 2.85Å; A511-G514 PolarHBondContact O-N 2.86Å
515	R	84.7	Confident	90.5	Very high	168 Å²	168	36.5 Å²	36.5	63%	0.634	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-131.4	4.6	-168.8	-66.3	-174.8	-174.5	-169.7	3.5	114.9	R242 G513	R242-R515 HydrophobicContact CG-CB 4.17Å; G513-R515 VanDerWaalsContact C-N 3.32Å; G513-R515 PolarHBondContact O-N 2.82Å
516	F	90	Very high	90.4	Very high	1 Å²	1	36.9 Å²	36.9	0%	0.004	20%	0.199	C	C	.	.			trans	-68.7	142.1	179.8	-177.7	-99.2	0	0	0	112.3	R175 M248 L250 L281 P507 A511 C518	R175-F516 WeakPolarHBondContact CD-O 3.4Å; M248-F516 HydrophobicContact SD-CE2 4.45Å; L250-F516 HydrophobicContact CD2-CE2 4.25Å; L250-F516 HydrophobicContact CD2-CZ 3.6Å; L281-F516 HydrophobicContact CB-CE1 4.03Å; L281-F516 HydrophobicContact CB-CZ 3.98Å; L281-F516 HydrophobicContact CD1-CE2 4.49Å; L281-F516 HydrophobicContact CD1-CZ 4.24Å; L281-F516 HydrophobicContact CD2-CD1 4.47Å; L281-F516 HydrophobicContact CD2-CD2 4.37Å; L281-F516 HydrophobicContact CD2-CE1 4.17Å; L281-F516 HydrophobicContact CD2-CE2 4.05Å; L281-F516 HydrophobicContact CD2-CZ 3.95Å; L281-F516 HydrophobicContact CG-CZ 4.27Å; L281-F516 VanDerWaalsContact O-CE1 3.25Å; L281-F516 WeakPolarHBondContact O-CE1 3.37Å; P507-F516 HydrophobicContact CB-CD1 4.1Å; P507-F516 HydrophobicContact CB-CE1 4.2Å; A511-F516 HydrophobicContact CB-CB 3.95Å; A511-F516 HydrophobicContact CB-CD1 4.36Å; A511-F516 HydrophobicContact CB-CG 4.17Å; A511-F516 VanDerWaalsContact O-CB 3.28Å; A511-F516 WeakPolarHBondContact O-CB 3.44Å; A511-F516 PolarHBondContact O-N 2.7Å; F516-C518 WeakPolarHBondContact CE1-SG 3.39Å; F516-C518 VanDerWaalsContact CZ-SG 3.51Å
517	D	92.5	Very high	90.3	Very high	16 Å²	16	37.6 Å²	37.6	9%	0.086	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	164.8	178.2	-152.4	-27.3	0	0	0	109	R175 G240 G241 H519	R175-D517 IonicContact NH1-OD2 3.81Å; R175-D517 PolarHBondContact NH1-OD2 3.39Å; R175-D517 VanDerWaalsContact NH1-OD2 3.08Å; G240-D517 WeakPolarHBondContact CA-O 3.18Å; G241-D517 PolarHBondContact N-O 3.44Å; G241-D517 PolarHBondContact O-N 2.85Å; D517-H519 IonicContact OD1-CE1 3.76Å; D517-H519 IonicContact OD2-CE1 3.57Å
518	C	94.6	Very high	90.1	Very high	3 Å²	3	42 Å²	42	2%	0.02	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	145.9	173.9	-67.8	0	0	0	0	111.1	V172 L238 V239 I505 P507 F516	V172-C518 HydrophobicContact CG1-CB 3.81Å; V172-C518 WeakPolarHBondContact CG1-O 3.35Å; L238-C518 HydrophobicContact CD1-CB 4.18Å; V239-C518 CarbonylContact O-C 3.52Å; V239-C518 WeakPolarHBondContact O-CA 3.5Å; I505-C518 HydrophobicContact CG2-CB 4.19Å; P507-C518 HydrophobicContact CB-CB 4.45Å; P507-C518 HydrophobicContact CG-CB 4.01Å; F516-C518 WeakPolarHBondContact CE1-SG 3.39Å; F516-C518 VanDerWaalsContact CZ-SG 3.51Å
519	H	94.1	Very high	89.8	Confident	18 Å²	18	44.3 Å²	44.3	8%	0.083	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	134.8	-172.1	-60.4	-28.6	0	0	0	110.7	V239 A243 K244 D517 V521	V239-H519 HydrophobicContact CG2-CB 4.31Å; V239-H519 WeakPolarHBondContact CG2-O 3.25Å; V239-H519 PolarHBondContact N-O 3.41Å; V239-H519 PolarHBondContact O-N 3.16Å; A243-H519 VanDerWaalsContact C-NE2 3.34Å; K244-H519 WeakPolarHBondContact CG-NE2 3.21Å; K244-H519 PolarHBondContact N-NE2 3.22Å; D517-H519 IonicContact OD1-CE1 3.76Å; D517-H519 IonicContact OD2-CE1 3.57Å; H519-V521 HydrophobicContact CB-CG2 3.93Å; H519-V521 PolarHBondContact O-N 2.96Å
520	R	93.6	Very high	89.1	Confident	103 Å²	103	45.9 Å²	45.9	39%	0.389	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	100.2	171.3	-162.6	-163	80	171.8	8.8	109	D169 H236 F237	D169-R520 VanDerWaalsContact OD1-CD 3.25Å; D169-R520 WeakPolarHBondContact OD1-CD 3.42Å; D169-R520 IonicContact OD1-CZ 2.69Å; D169-R520 IonicContact OD1-NE 3.74Å; D169-R520 IonicContact OD1-NH1 3.61Å; D169-R520 PolarHBondContact OD1-NH1 3.42Å; D169-R520 IonicContact OD2-NH1 3.71Å; D169-R520 PolarHBondContact OD2-NH1 3.34Å; H236-R520 HydrophobicContact CB-CG 3.93Å; H236-R520 PolarHBondContact CD2-NE 2.93Å; H236-R520 PolarHBondContact NE2-NH2 3.44Å; H236-R520 VanDerWaalsContact NE2-NH2 3.16Å; F237-R520 WeakPolarHBondContact O-CA 3.45Å
521	V	94.7	Very high	88.1	Confident	22 Å²	22	48.6 Å²	48.6	13%	0.133	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	138.6	-172.6	-175.5	0	0	0	0	110	H236 F237 V239 T247 H519 L526	H236-V521 CarbonylContact C-O 3.49Å; H236-V521 WeakPolarHBondContact CA-O 3.32Å; H236-V521 WeakPolarHBondContact CB-O 3.34Å; F237-V521 PolarHBondContact N-O 3.26Å; F237-V521 PolarHBondContact O-N 2.95Å; V239-V521 HydrophobicContact CG2-CB 4.21Å; V239-V521 HydrophobicContact CG2-CG2 3.59Å; T247-V521 HydrophobicContact CG2-CG2 4.39Å; H519-V521 HydrophobicContact CB-CG2 3.93Å; H519-V521 PolarHBondContact O-N 2.96Å; V521-L526 HydrophobicContact CB-CD2 4.03Å; V521-L526 HydrophobicContact CB-CG 4.35Å; V521-L526 HydrophobicContact CG1-CD2 3.58Å; V521-L526 HydrophobicContact CG1-CG 3.88Å
522	S	95.9	Very high	87.2	Confident	14 Å²	14	57.1 Å²	57.1	10%	0.098	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	150	179.8	76.4	0	0	0	0	111.7	I235 F524 S525 L526	I235-S522 WeakPolarHBondContact O-CA 3.32Å; S522-F524 PolarHBondContact O-N 3.19Å; S522-S525 WeakPolarHBondContact O-CA 3.48Å; S522-S525 WeakPolarHBondContact O-CB 3.32Å; S522-S525 PolarHBondContact O-N 2.93Å; S522-S525 PolarHBondContact OG-N 2.98Å; S522-S525 PolarHBondContact OG-OG 3.31Å; S522-L526 PolarHBondContact O-N 2.9Å
523	L	96.3	Very high	86.6	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-56.3	-39.8	175.8	176	62.1	0	0	0	110.9	D232 I235 F237 S525 L526 L527 A545 F548 H549 L552	D232-L523 HydrophobicContact CB-CB 4.34Å; D232-L523 HydrophobicContact CB-CD2 4.29Å; D232-L523 HydrophobicContact CB-CG 4.27Å; D232-L523 WeakPolarHBondContact O-CB 3.5Å; D232-L523 PolarHBondContact O-N 3.41Å; I235-L523 HydrophobicContact CB-CB 4.44Å; I235-L523 PolarHBondContact O-N 3.42Å; F237-L523 HydrophobicContact CE2-CD1 4.33Å; L523-S525 VanDerWaalsContact C-N 3.26Å; L523-S525 PolarHBondContact O-N 2.85Å; L523-L526 PolarHBondContact O-N 3.45Å; L523-L526 VanDerWaalsContact O-N 3.15Å; L523-L527 HydrophobicContact CD1-CD1 4.28Å; L523-L527 HydrophobicContact CD1-CG 4.31Å; L523-L527 HydrophobicContact CG-CD1 4.1Å; L523-L527 VanDerWaalsContact O-CG 3.29Å; L523-L527 WeakPolarHBondContact O-CG 3.49Å; L523-L527 PolarHBondContact O-N 3.33Å; L523-L527 VanDerWaalsContact O-N 3.12Å; L523-A545 HydrophobicContact CD1-CB 4.04Å; L523-F548 HydrophobicContact CD1-CD1 4.4Å; L523-F548 HydrophobicContact CD2-CD1 3.97Å; L523-F548 HydrophobicContact CD2-CE1 4.39Å; L523-H549 HydrophobicContact CD2-CB 4.37Å; L523-L552 HydrophobicContact CD2-CD1 4.37Å
524	F	94.5	Very high	86.3	Confident	66 Å²	66	61.9 Å²	61.9	29%	0.289	31%	0.312	S	S	.	.	H	α-helix	trans	-55.7	-38.8	173	180	-86.2	0	0	0	113	D232 K233 S522	D232-F524 HydrophobicContact CB-CB 4.04Å; D232-F524 PolarHBondContact O-N 3.15Å; K233-F524 HydrophobicContact CD-CD1 4.43Å; K233-F524 HydrophobicContact CD-CD2 4.29Å; K233-F524 HydrophobicContact CD-CG 4.16Å; K233-F524 VanDerWaalsContact CE-CE1 3.48Å; K233-F524 VanDerWaalsContact CE-CZ 3.45Å; K233-F524 HydrophobicContact CG-CB 3.55Å; K233-F524 HydrophobicContact CG-CD1 4.27Å; K233-F524 HydrophobicContact CG-CD2 4.03Å; K233-F524 HydrophobicContact CG-CG 3.68Å; K233-F524 VanDerWaalsContact NZ-CZ 3.32Å; S522-F524 PolarHBondContact O-N 3.19Å
525	S	93.3	Very high	86.5	Confident	63 Å²	63	63.8 Å²	63.8	44%	0.441	31%	0.307	S	S	.	.	H	α-helix	trans	-77.1	-30.8	178.5	-59.4	0	0	0	0	112.8	S522 L523 L527 D528	S522-S525 WeakPolarHBondContact O-CA 3.48Å; S522-S525 WeakPolarHBondContact O-CB 3.32Å; S522-S525 PolarHBondContact O-N 2.93Å; S522-S525 PolarHBondContact OG-N 2.98Å; S522-S525 PolarHBondContact OG-OG 3.31Å; L523-S525 VanDerWaalsContact C-N 3.26Å; L523-S525 PolarHBondContact O-N 2.85Å; S525-L527 PolarHBondContact O-N 2.91Å; S525-D528 PolarHBondContact O-N 2.87Å
526	L	93.3	Very high	86.8	Confident	8 Å²	8	56.8 Å²	56.8	4%	0.042	28%	0.281	C	S	.	.	H	α-helix	trans	-73.1	-14.1	173.5	-63.9	-177.7	0	0	0	112.9	M202 F237 T247 V521 S522 L523 Y529 V541 A545	M202-L526 HydrophobicContact CE-CD1 4.29Å; F237-L526 HydrophobicContact CB-CD1 4.15Å; F237-L526 HydrophobicContact CD2-CD1 4.05Å; F237-L526 HydrophobicContact CG-CD1 4.46Å; T247-L526 HydrophobicContact CG2-CD2 4.4Å; V521-L526 HydrophobicContact CB-CD2 4.03Å; V521-L526 HydrophobicContact CB-CG 4.35Å; V521-L526 HydrophobicContact CG1-CD2 3.58Å; V521-L526 HydrophobicContact CG1-CG 3.88Å; S522-L526 PolarHBondContact O-N 2.9Å; L523-L526 PolarHBondContact O-N 3.45Å; L523-L526 VanDerWaalsContact O-N 3.15Å; L526-Y529 WeakPolarHBondContact O-CE1 3.43Å; L526-V541 HydrophobicContact CD1-CG1 4.15Å; L526-V541 HydrophobicContact CD2-CG1 3.84Å; L526-V541 HydrophobicContact CG-CG1 4.48Å; L526-A545 HydrophobicContact CB-CB 3.74Å
527	L	92.6	Very high	86.8	Confident	31 Å²	31	57.7 Å²	57.7	16%	0.162	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	4.9	175.2	-66.1	168.4	0	0	0	113.4	L523 S525 Y529 A545 E546 H549	L523-L527 HydrophobicContact CD1-CD1 4.28Å; L523-L527 HydrophobicContact CD1-CG 4.31Å; L523-L527 HydrophobicContact CG-CD1 4.1Å; L523-L527 VanDerWaalsContact O-CG 3.29Å; L523-L527 WeakPolarHBondContact O-CG 3.49Å; L523-L527 PolarHBondContact O-N 3.33Å; L523-L527 VanDerWaalsContact O-N 3.12Å; S525-L527 PolarHBondContact O-N 2.91Å; L527-Y529 WeakPolarHBondContact CD2-OH 3.46Å; L527-A545 HydrophobicContact CD2-CB 3.9Å; L527-A545 HydrophobicContact CG-CB 4.32Å; L527-E546 HydrophobicContact CD2-CG 4.37Å; L527-H549 HydrophobicContact CD1-CB 4.09Å; L527-H549 HydrophobicContact CD2-CB 4.36Å
528	D	89	Confident	86.7	Confident	98 Å²	98	57.3 Å²	57.3	52%	0.524	28%	0.284	S	S	.	.			trans	-110.5	61.8	-172.3	-160.9	15.6	0	0	0	111.7	S525 H530	S525-D528 PolarHBondContact O-N 2.87Å; D528-H530 PolarHBondContact O-N 3.17Å; D528-H530 PolarHBondContact O-ND1 3.49Å; D528-H530 VanDerWaalsContact O-ND1 3.07Å
529	Y	83.9	Confident	86.6	Confident	51 Å²	51	57.4 Å²	57.4	20%	0.2	28%	0.284	C	S	.	.			trans	-65	128.8	-171.5	-32	-64.3	0	0	0	112.7	L526 L527 S542 E546	L526-Y529 WeakPolarHBondContact O-CE1 3.43Å; L527-Y529 WeakPolarHBondContact CD2-OH 3.46Å; Y529-S542 WeakPolarHBondContact CD1-OG 3.27Å; Y529-S542 WeakPolarHBondContact CE1-OG 3.3Å; Y529-E546 WeakPolarHBondContact CE2-OE1 3.46Å; Y529-E546 WeakPolarHBondContact OH-CG 3.31Å; Y529-E546 PolarHBondContact OH-OE1 3.5Å
530	H	73.1	Confident	86.7	Confident	123 Å²	123	56.6 Å²	56.6	57%	0.569	28%	0.28	S	S	*	.			trans	-90.3	133.5	171.5	-72.4	48.3	0	0	0	109.8	D528 E532 D533	D528-H530 PolarHBondContact O-N 3.17Å; D528-H530 PolarHBondContact O-ND1 3.49Å; D528-H530 VanDerWaalsContact O-ND1 3.07Å; H530-E532 PolarHBondContact O-N 3.03Å; H530-E532 VanDerWaalsContact O-N 3.16Å; H530-D533 PolarHBondContact O-N 3.03Å; H530-D533 VanDerWaalsContact O-N 3.16Å
531	T	65	Low	86.7	Confident	117 Å²	117	51.7 Å²	51.7	72%	0.718	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-14.3	-173.7	47.9	0	0	0	0	114.5	Q534	T531-Q534 PolarHBondContact O-NE2 3.25Å
532	E	67.2	Low	86.7	Confident	179 Å²	179	51.4 Å²	51.4	84%	0.836	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-18.7	177.3	-61.8	178.7	-173.6	0	0	112.3	H530 Q534	H530-E532 PolarHBondContact O-N 3.03Å; H530-E532 VanDerWaalsContact O-N 3.16Å; E532-Q534 VanDerWaalsContact C-N 3.3Å; E532-Q534 PolarHBondContact O-N 2.85Å
533	D	68.7	Low	86.7	Confident	53 Å²	53	50.7 Å²	50.7	28%	0.283	26%	0.256	S	S	.	.			trans	-80.9	69.3	-175.6	-89.2	-58.1	0	0	0	112.4	H530 K535 N538	H530-D533 PolarHBondContact O-N 3.03Å; H530-D533 VanDerWaalsContact O-N 3.16Å; D533-K535 PolarHBondContact O-N 3.22Å; D533-K535 VanDerWaalsContact O-N 3.13Å; D533-N538 WeakPolarHBondContact CB-ND2 3.49Å; D533-N538 PolarHBondContact OD1-ND2 2.9Å
534	Q	72.5	Confident	86.7	Confident	121 Å²	121	50.7 Å²	50.7	57%	0.565	26%	0.256	S	S	*	.			trans	-76.7	10.7	-173.2	-67.6	-66.3	-40.5	0	0	115.4	N140 T531 E532	N140-Q534 VanDerWaalsContact ND2-CD 3.27Å; N140-Q534 PolarHBondContact ND2-NE2 3.25Å; N140-Q534 PolarHBondContact ND2-OE1 3.34Å; N140-Q534 PolarHBondContact OD1-NE2 2.99Å; N140-Q534 VanDerWaalsContact OD1-NE2 3.14Å; N140-Q534 PolarHBondContact OD1-OE1 3.07Å; T531-Q534 PolarHBondContact O-NE2 3.25Å; E532-Q534 VanDerWaalsContact C-N 3.3Å; E532-Q534 PolarHBondContact O-N 2.85Å
535	K	86.2	Confident	86.8	Confident	84 Å²	84	47.6 Å²	47.6	37%	0.365	24%	0.242	S	C	.	.			trans	-82.7	136.1	-176.2	-74.2	-174.8	161	-173.5	0	112.6	E246 E316 D533 H537 N538 F539	E246-K535 HydrophobicContact CG-CD 4.36Å; E246-K535 WeakPolarHBondContact OE1-CD 3.43Å; E246-K535 IonicContact OE1-NZ 3.21Å; E246-K535 PolarHBondContact OE1-NZ 3.43Å; E246-K535 IonicContact OE2-NZ 2.7Å; E316-K535 IonicContact OE2-NZ 3.36Å; E316-K535 PolarHBondContact OE2-NZ 3.43Å; D533-K535 PolarHBondContact O-N 3.22Å; D533-K535 VanDerWaalsContact O-N 3.13Å; K535-H537 VanDerWaalsContact C-N 3.28Å; K535-H537 PolarHBondContact O-N 3.01Å; K535-N538 WeakPolarHBondContact O-CB 3.35Å; K535-N538 PolarHBondContact O-N 3.03Å; K535-F539 PolarHBondContact O-N 3.18Å
536	E	91.5	Very high	86.9	Confident	21 Å²	21	46 Å²	46	10%	0.098	23%	0.227	C	C	.	.	H	α-helix	trans	-57.1	-37.7	178.8	-177.4	169.8	98.1	0	0	112.8	S142 Y300 R302 P309 N538 F539 E540	S142-E536 WeakPolarHBondContact CB-OE2 3.25Å; S142-E536 PolarHBondContact OG-OE2 2.84Å; Y300-E536 VanDerWaalsContact CE1-CD 3.42Å; Y300-E536 HydrophobicContact CE1-CG 3.93Å; Y300-E536 WeakPolarHBondContact CE1-OE2 3.49Å; R302-E536 IonicContact CZ-OE1 3.71Å; R302-E536 IonicContact CZ-OE2 2.71Å; R302-E536 IonicContact NH1-OE1 3.28Å; R302-E536 PolarHBondContact NH1-OE1 2.93Å; R302-E536 IonicContact NH1-OE2 2.77Å; R302-E536 PolarHBondContact NH1-OE2 3.01Å; R302-E536 IonicContact NH2-OE1 2.78Å; R302-E536 PolarHBondContact NH2-OE1 3.45Å; R302-E536 IonicContact NH2-OE2 3.81Å; P309-E536 WeakPolarHBondContact CD-OE1 3.42Å; P309-E536 HydrophobicContact CG-CB 3.84Å; P309-E536 HydrophobicContact CG-CG 4.23Å; P309-E536 WeakPolarHBondContact CG-OE1 3.49Å; E536-N538 VanDerWaalsContact C-N 3.28Å; E536-N538 PolarHBondContact O-N 2.81Å; E536-F539 WeakPolarHBondContact O-CB 3.45Å; E536-F539 PolarHBondContact O-N 2.96Å; E536-F539 VanDerWaalsContact O-N 3.12Å; E536-E540 HydrophobicContact CG-CG 4.48Å; E536-E540 WeakPolarHBondContact O-CG 3.46Å; E536-E540 PolarHBondContact O-N 3.27Å
537	H	90.1	Very high	87	Confident	20 Å²	20	45.6 Å²	45.6	9%	0.093	23%	0.226	C	C	.	.	H	α-helix	trans	-60.3	-35.2	174.7	-70.4	-22.7	0	0	0	114.2	M248 P309 F311 K512 K535 E540 V541	M248-H537 HydrophobicContact CB-CB 3.76Å; P309-H537 VanDerWaalsContact CB-CE1 3.49Å; P309-H537 WeakPolarHBondContact CB-CE1 3.17Å; F311-H537 AromaticContact CE2-CE1 3.52Å; F311-H537 AromaticContact CE2-NE2 3.88Å; F311-H537 AromaticContact CZ-CE1 3.46Å; F311-H537 VanDerWaalsContact CZ-CE1 3.46Å; F311-H537 WeakPolarHBondContact CZ-CE1 3.4Å; F311-H537 AromaticContact CZ-NE2 3.69Å; K512-H537 PolarHBondContact NZ-NE2 3.41Å; K535-H537 VanDerWaalsContact C-N 3.28Å; K535-H537 PolarHBondContact O-N 3.01Å; H537-E540 WeakPolarHBondContact CA-OE2 3.49Å; H537-E540 IonicContact CE1-OE2 3.61Å; H537-E540 IonicContact CG-OE2 3.64Å; H537-E540 IonicContact ND1-OE2 2.88Å; H537-E540 PolarHBondContact ND1-OE2 3Å; H537-E540 PolarHBondContact O-N 2.61Å; H537-V541 WeakPolarHBondContact O-CG2 3.42Å; H537-V541 PolarHBondContact O-N 3.08Å
538	N	90.4	Very high	87.2	Confident	9 Å²	9	44.1 Å²	44.1	5%	0.048	22%	0.218	C	C	.	.	H	α-helix	trans	-70.9	-39.4	176.8	-62.2	2.4	0	0	0	109.5	T247 D533 K535 E536 V541 S542	T247-N538 PolarHBondContact O-OD1 2.76Å; D533-N538 WeakPolarHBondContact CB-ND2 3.49Å; D533-N538 PolarHBondContact OD1-ND2 2.9Å; K535-N538 WeakPolarHBondContact O-CB 3.35Å; K535-N538 PolarHBondContact O-N 3.03Å; E536-N538 VanDerWaalsContact C-N 3.28Å; E536-N538 PolarHBondContact O-N 2.81Å; N538-V541 PolarHBondContact O-N 2.91Å; N538-S542 WeakPolarHBondContact O-CB 3.45Å; N538-S542 PolarHBondContact O-N 2.91Å; N538-S542 PolarHBondContact O-OG 2.99Å
539	F	92.7	Very high	87.5	Confident	5 Å²	5	39.7 Å²	39.7	2%	0.022	19%	0.194	C	C	.	.	H	α-helix	trans	-59.1	-46.7	171.6	161.6	-116	0	0	0	112.6	L139 N140 I141 F145 L298 Y300 K535 E536 V541 S542 L543	L139-F539 HydrophobicContact CD1-CD2 4.14Å; L139-F539 HydrophobicContact CD2-CD2 4.32Å; L139-F539 HydrophobicContact CD2-CE2 4.06Å; L139-F539 HydrophobicContact CG-CD2 4.18Å; L139-F539 HydrophobicContact CG-CE2 4.36Å; N140-F539 WeakPolarHBondContact O-CB 3.37Å; N140-F539 WeakPolarHBondContact O-CD2 3.5Å; N140-F539 WeakPolarHBondContact O-CG 3.39Å; I141-F539 HydrophobicContact CB-CD2 4.49Å; I141-F539 HydrophobicContact CB-CE2 4.12Å; I141-F539 HydrophobicContact CG1-CD2 4.46Å; I141-F539 HydrophobicContact CG1-CE2 3.97Å; I141-F539 HydrophobicContact CG2-CE2 3.97Å; I141-F539 HydrophobicContact CG2-CZ 3.9Å; F145-F539 HydrophobicContact CB-CE1 3.99Å; F145-F539 HydrophobicContact CB-CZ 4.26Å; F145-F539 HydrophobicContact CD1-CZ 4.17Å; F145-F539 AromaticContact CD2-CE1 3.79Å; F145-F539 HydrophobicContact CD2-CE1 3.79Å; F145-F539 AromaticContact CD2-CZ 3.72Å; F145-F539 HydrophobicContact CD2-CZ 3.72Å; F145-F539 HydrophobicContact CE2-CZ 4.12Å; F145-F539 AromaticContact CG-CE1 3.9Å; F145-F539 HydrophobicContact CG-CE1 3.9Å; F145-F539 AromaticContact CG-CZ 3.75Å; F145-F539 HydrophobicContact CG-CZ 3.75Å; L298-F539 HydrophobicContact CD2-CE1 3.95Å; L298-F539 HydrophobicContact CD2-CZ 4.26Å; Y300-F539 HydrophobicContact CE1-CE1 4.25Å; Y300-F539 WeakPolarHBondContact OH-CE1 3.08Å; K535-F539 PolarHBondContact O-N 3.18Å; E536-F539 WeakPolarHBondContact O-CB 3.45Å; E536-F539 PolarHBondContact O-N 2.96Å; E536-F539 VanDerWaalsContact O-N 3.12Å; F539-V541 PolarHBondContact O-N 2.8Å; F539-S542 PolarHBondContact O-N 3.04Å; F539-L543 HydrophobicContact CE2-CB 4.2Å; F539-L543 HydrophobicContact CE2-CD2 4.08Å; F539-L543 HydrophobicContact CZ-CD2 3.98Å; F539-L543 PolarHBondContact O-N 3.48Å
540	E	95.2	Very high	88	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-56.1	-49.4	178.4	-69.3	172.3	135.2	0	0	111.8	R200 L298 Y300 V328 F330 E536 H537 F544	R200-E540 IonicContact CZ-OE1 2.99Å; R200-E540 IonicContact CZ-OE2 3.33Å; R200-E540 IonicContact NH1-OE1 3.65Å; R200-E540 IonicContact NH1-OE2 2.8Å; R200-E540 PolarHBondContact NH1-OE2 2.94Å; R200-E540 VanDerWaalsContact NH2-CD 3.33Å; R200-E540 IonicContact NH2-OE1 3.83Å; R200-E540 PolarHBondContact NH2-OE1 2.94Å; R200-E540 IonicContact NH2-OE2 3.52Å; R200-E540 PolarHBondContact NH2-OE2 2.78Å; R200-E540 VanDerWaalsContact NH2-OE2 3.15Å; L298-E540 HydrophobicContact CD2-CG 4.27Å; Y300-E540 WeakPolarHBondContact OH-CG 3.34Å; V328-E540 WeakPolarHBondContact CG2-OE1 3.43Å; F330-E540 HydrophobicContact CE2-CB 4.15Å; F330-E540 HydrophobicContact CZ-CB 3.95Å; E536-E540 HydrophobicContact CG-CG 4.48Å; E536-E540 WeakPolarHBondContact O-CG 3.46Å; E536-E540 PolarHBondContact O-N 3.27Å; H537-E540 WeakPolarHBondContact CA-OE2 3.49Å; H537-E540 IonicContact CE1-OE2 3.61Å; H537-E540 IonicContact CG-OE2 3.64Å; H537-E540 IonicContact ND1-OE2 2.88Å; H537-E540 PolarHBondContact ND1-OE2 3Å; H537-E540 PolarHBondContact O-N 2.61Å; E540-F544 PolarHBondContact O-N 2.91Å
541	V	94.8	Very high	89.1	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-67.3	-38.4	177.9	175.5	0	0	0	0	111.7	M202 V239 A249 L526 H537 N538 F539 F544 A545	M202-V541 HydrophobicContact CE-CG1 4.27Å; V239-V541 HydrophobicContact CG1-CG1 4.36Å; A249-V541 HydrophobicContact CB-CG2 3.96Å; L526-V541 HydrophobicContact CD1-CG1 4.15Å; L526-V541 HydrophobicContact CD2-CG1 3.84Å; L526-V541 HydrophobicContact CG-CG1 4.48Å; H537-V541 WeakPolarHBondContact O-CG2 3.42Å; H537-V541 PolarHBondContact O-N 3.08Å; N538-V541 PolarHBondContact O-N 2.91Å; F539-V541 PolarHBondContact O-N 2.8Å; V541-F544 PolarHBondContact O-N 2.98Å; V541-A545 WeakPolarHBondContact O-CB 3.44Å; V541-A545 PolarHBondContact O-N 2.94Å
542	S	94.4	Very high	90.6	Very high	15 Å²	15	26.7 Å²	26.7	11%	0.105	13%	0.127	C	C	.	.	H	α-helix	trans	-65.4	-44.5	-179.9	-63.4	0	0	0	0	112.2	Y529 N538 F539 A545 E546	Y529-S542 WeakPolarHBondContact CD1-OG 3.27Å; Y529-S542 WeakPolarHBondContact CE1-OG 3.3Å; N538-S542 WeakPolarHBondContact O-CB 3.45Å; N538-S542 PolarHBondContact O-N 2.91Å; N538-S542 PolarHBondContact O-OG 2.99Å; F539-S542 PolarHBondContact O-N 3.04Å; S542-A545 WeakPolarHBondContact O-CB 3.44Å; S542-A545 PolarHBondContact O-N 2.96Å; S542-E546 PolarHBondContact O-N 3.26Å
543	L	95.7	Very high	91.9	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-68.6	-35.3	177.2	-177	59.3	0	0	0	111.9	L132 Y136 L139 C148 M296 L298 F539 A545 Q547	L132-L543 HydrophobicContact CD1-CD1 3.97Å; L132-L543 HydrophobicContact CD1-CD2 3.74Å; L132-L543 HydrophobicContact CD2-CD1 3.78Å; Y136-L543 HydrophobicContact CD2-CD1 4.17Å; Y136-L543 HydrophobicContact CE2-CD1 3.79Å; L139-L543 HydrophobicContact CD2-CB 4.26Å; L139-L543 HydrophobicContact CD2-CD1 3.91Å; C148-L543 HydrophobicContact CB-CD2 4.05Å; M296-L543 HydrophobicContact CE-CB 4.27Å; M296-L543 HydrophobicContact CE-CD2 3.83Å; M296-L543 HydrophobicContact CE-CG 3.69Å; L298-L543 HydrophobicContact CD2-CD2 3.94Å; L298-L543 HydrophobicContact CG-CD2 4.44Å; F539-L543 HydrophobicContact CE2-CB 4.2Å; F539-L543 HydrophobicContact CE2-CD2 4.08Å; F539-L543 HydrophobicContact CZ-CD2 3.98Å; F539-L543 PolarHBondContact O-N 3.48Å; L543-A545 VanDerWaalsContact C-N 3.35Å; L543-Q547 PolarHBondContact O-N 3.15Å; L543-Q547 VanDerWaalsContact O-N 3.11Å
544	F	97.2	Very high	93.2	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-60.6	-43.6	169.5	173.1	-86.2	0	0	0	111.7	M202 F237 F295 M296 F330 I332 E540 V541 Q547 F548	M202-F544 HydrophobicContact CB-CD1 4.45Å; M202-F544 HydrophobicContact CB-CE1 3.72Å; M202-F544 HydrophobicContact CB-CE2 3.85Å; M202-F544 HydrophobicContact CB-CZ 3.38Å; M202-F544 HydrophobicContact CE-CD1 3.56Å; M202-F544 HydrophobicContact CE-CE1 3.61Å; M202-F544 HydrophobicContact CE-CG 4.41Å; M202-F544 HydrophobicContact CE-CZ 4.48Å; M202-F544 HydrophobicContact CG-CD1 3.95Å; M202-F544 HydrophobicContact CG-CD2 4.06Å; M202-F544 HydrophobicContact CG-CE1 3.73Å; M202-F544 HydrophobicContact CG-CE2 3.83Å; M202-F544 HydrophobicContact CG-CG 4.12Å; M202-F544 HydrophobicContact CG-CZ 3.67Å; F237-F544 HydrophobicContact CD1-CE1 4.08Å; F237-F544 HydrophobicContact CD1-CZ 4.42Å; F237-F544 HydrophobicContact CD2-CE1 4.44Å; F237-F544 AromaticContact CE1-CE1 3.7Å; F237-F544 HydrophobicContact CE1-CE1 3.7Å; F237-F544 AromaticContact CE1-CZ 3.8Å; F237-F544 HydrophobicContact CE1-CZ 3.8Å; F237-F544 HydrophobicContact CE2-CE1 4.1Å; F237-F544 HydrophobicContact CG-CE1 4.43Å; F237-F544 AromaticContact CZ-CE1 3.71Å; F237-F544 HydrophobicContact CZ-CE1 3.71Å; F237-F544 HydrophobicContact CZ-CZ 4.04Å; F295-F544 HydrophobicContact CB-CE2 4.42Å; F295-F544 AromaticContact CD1-CD2 3.53Å; F295-F544 HydrophobicContact CD1-CD2 3.53Å; F295-F544 AromaticContact CD1-CE2 3.45Å; F295-F544 HydrophobicContact CD1-CE2 3.45Å; F295-F544 VanDerWaalsContact CD1-CE2 3.45Å; F295-F544 AromaticContact CE1-CD2 3.81Å; F295-F544 HydrophobicContact CE1-CD2 3.81Å; F295-F544 AromaticContact CE1-CE2 3.83Å; F295-F544 HydrophobicContact CE1-CE2 3.83Å; F295-F544 HydrophobicContact CG-CD2 4.4Å; F295-F544 AromaticContact CG-CE2 3.9Å; F295-F544 HydrophobicContact CG-CE2 3.9Å; M296-F544 VanDerWaalsContact SD-CA 3.55Å; M296-F544 HydrophobicContact SD-CB 3.77Å; M296-F544 HydrophobicContact SD-CD2 3.97Å; M296-F544 HydrophobicContact SD-CG 4.36Å; F330-F544 HydrophobicContact CB-CD2 4.37Å; F330-F544 HydrophobicContact CD1-CB 4.13Å; F330-F544 AromaticContact CD1-CD2 3.42Å; F330-F544 HydrophobicContact CD1-CD2 3.42Å; F330-F544 VanDerWaalsContact CD1-CD2 3.42Å; F330-F544 HydrophobicContact CD1-CE2 4.08Å; F330-F544 AromaticContact CD1-CG 3.92Å; F330-F544 HydrophobicContact CD1-CG 3.92Å; F330-F544 HydrophobicContact CE1-CB 3.86Å; F330-F544 AromaticContact CE1-CD2 3.97Å; F330-F544 HydrophobicContact CE1-CD2 3.97Å; F330-F544 AromaticContact CE1-CG 3.98Å; F330-F544 HydrophobicContact CE1-CG 3.98Å; F330-F544 HydrophobicContact CG-CD2 4.14Å; F330-F544 HydrophobicContact CZ-CB 4.44Å; I332-F544 HydrophobicContact CD1-CE2 3.92Å; I332-F544 HydrophobicContact CD1-CZ 3.77Å; I332-F544 HydrophobicContact CG1-CE2 4.03Å; I332-F544 HydrophobicContact CG1-CZ 4.05Å; E540-F544 PolarHBondContact O-N 2.91Å; V541-F544 PolarHBondContact O-N 2.98Å; F544-Q547 PolarHBondContact O-N 3.28Å; F544-F548 HydrophobicContact CE1-CB 4.33Å; F544-F548 HydrophobicContact CZ-CD2 4.25Å; F544-F548 VanDerWaalsContact O-CB 3.31Å; F544-F548 WeakPolarHBondContact O-CB 3.41Å; F544-F548 PolarHBondContact O-N 3.02Å
545	A	96.3	Very high	94.3	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-62.8	-44.4	179.3	0	0	0	0	0	112.3	L523 L526 L527 V541 S542 L543 H549	L523-A545 HydrophobicContact CD1-CB 4.04Å; L526-A545 HydrophobicContact CB-CB 3.74Å; L527-A545 HydrophobicContact CD2-CB 3.9Å; L527-A545 HydrophobicContact CG-CB 4.32Å; V541-A545 WeakPolarHBondContact O-CB 3.44Å; V541-A545 PolarHBondContact O-N 2.94Å; S542-A545 WeakPolarHBondContact O-CB 3.44Å; S542-A545 PolarHBondContact O-N 2.96Å; L543-A545 VanDerWaalsContact C-N 3.35Å; A545-H549 VanDerWaalsContact O-CB 3.31Å; A545-H549 WeakPolarHBondContact O-CB 3.27Å; A545-H549 PolarHBondContact O-N 3.35Å
546	E	95.1	Very high	94.8	Very high	29 Å²	29	7 Å²	7	14%	0.136	4%	0.036	C	C	.	.	H	α-helix	trans	-59	-52.2	173.2	-69.5	-67.3	-175.7	0	0	111.5	Y136 L527 Y529 S542 F548 H549 E550	Y136-E546 HydrophobicContact CD1-CB 4.06Å; Y136-E546 VanDerWaalsContact CD1-CD 3.41Å; Y136-E546 HydrophobicContact CD1-CG 3.57Å; Y136-E546 HydrophobicContact CD2-CB 4.46Å; Y136-E546 HydrophobicContact CD2-CG 4.18Å; Y136-E546 HydrophobicContact CE1-CB 3.56Å; Y136-E546 HydrophobicContact CE1-CG 3.63Å; Y136-E546 HydrophobicContact CE2-CB 3.97Å; Y136-E546 HydrophobicContact CE2-CG 4.2Å; Y136-E546 HydrophobicContact CG-CB 4.49Å; Y136-E546 HydrophobicContact CG-CG 3.87Å; Y136-E546 VanDerWaalsContact CZ-CB 3.49Å; L527-E546 HydrophobicContact CD2-CG 4.37Å; Y529-E546 WeakPolarHBondContact CE2-OE1 3.46Å; Y529-E546 WeakPolarHBondContact OH-CG 3.31Å; Y529-E546 PolarHBondContact OH-OE1 3.5Å; S542-E546 PolarHBondContact O-N 3.26Å; E546-F548 VanDerWaalsContact C-N 3.33Å; E546-F548 PolarHBondContact O-N 3.03Å; E546-H549 CarbonylContact O-C 3.58Å; E546-H549 WeakPolarHBondContact O-CA 3.42Å; E546-H549 WeakPolarHBondContact O-CB 3.35Å; E546-H549 PolarHBondContact O-N 3.07Å; E546-H549 VanDerWaalsContact O-N 3.07Å; E546-E550 PolarHBondContact O-N 3.35Å
547	Q	95.4	Very high	95.1	Very high	1 Å²	1	6 Å²	6	1%	0.005	3%	0.032	C	C	.	.	H	α-helix	trans	-63.2	-38.5	-177	-74.1	-163.3	28.6	0	0	112.8	C148 F295 L543 F544 H549 E550 M551	C148-Q547 PolarHBondContact SG-NE2 2.89Å; F295-Q547 HydrophobicContact CE1-CB 3.9Å; F295-Q547 HydrophobicContact CZ-CB 4.22Å; L543-Q547 PolarHBondContact O-N 3.15Å; L543-Q547 VanDerWaalsContact O-N 3.11Å; F544-Q547 PolarHBondContact O-N 3.28Å; Q547-H549 VanDerWaalsContact C-N 3.32Å; Q547-E550 PolarHBondContact O-N 3.2Å; Q547-M551 WeakPolarHBondContact O-CB 3.42Å; Q547-M551 PolarHBondContact O-N 3.24Å
548	F	96.6	Very high	95.4	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-67.1	-34.4	174.7	-169.1	-89.7	0	0	0	111.8	F162 M204 I235 F237 F295 I332 L523 F544 E546 M551 L552	F162-F548 HydrophobicContact CD1-CZ 4.27Å; F162-F548 HydrophobicContact CE1-CE2 4.06Å; F162-F548 AromaticContact CE1-CZ 3.74Å; F162-F548 HydrophobicContact CE1-CZ 3.74Å; F162-F548 HydrophobicContact CZ-CE2 4.15Å; F162-F548 HydrophobicContact CZ-CZ 4.21Å; M204-F548 HydrophobicContact SD-CZ 3.85Å; I235-F548 HydrophobicContact CG2-CE1 4.14Å; F237-F548 AromaticContact CE2-CD1 3.92Å; F237-F548 HydrophobicContact CE2-CD1 3.92Å; F237-F548 HydrophobicContact CE2-CE1 4.02Å; F237-F548 HydrophobicContact CE2-CG 4.36Å; F237-F548 AromaticContact CZ-CD1 3.7Å; F237-F548 HydrophobicContact CZ-CD1 3.7Å; F237-F548 AromaticContact CZ-CD2 3.95Å; F237-F548 HydrophobicContact CZ-CD2 3.95Å; F237-F548 AromaticContact CZ-CE1 3.62Å; F237-F548 HydrophobicContact CZ-CE1 3.62Å; F237-F548 AromaticContact CZ-CE2 3.9Å; F237-F548 HydrophobicContact CZ-CE2 3.9Å; F237-F548 AromaticContact CZ-CG 3.86Å; F237-F548 HydrophobicContact CZ-CG 3.86Å; F237-F548 AromaticContact CZ-CZ 3.74Å; F237-F548 HydrophobicContact CZ-CZ 3.74Å; F295-F548 HydrophobicContact CE1-CB 4.46Å; F295-F548 AromaticContact CE2-CD2 3.9Å; F295-F548 HydrophobicContact CE2-CD2 3.9Å; F295-F548 HydrophobicContact CZ-CB 3.94Å; F295-F548 HydrophobicContact CZ-CD2 4.03Å; F295-F548 HydrophobicContact CZ-CG 4.48Å; I332-F548 HydrophobicContact CD1-CD2 3.94Å; I332-F548 HydrophobicContact CD1-CE2 3.91Å; L523-F548 HydrophobicContact CD1-CD1 4.4Å; L523-F548 HydrophobicContact CD2-CD1 3.97Å; L523-F548 HydrophobicContact CD2-CE1 4.39Å; F544-F548 HydrophobicContact CE1-CB 4.33Å; F544-F548 HydrophobicContact CZ-CD2 4.25Å; F544-F548 VanDerWaalsContact O-CB 3.31Å; F544-F548 WeakPolarHBondContact O-CB 3.41Å; F544-F548 PolarHBondContact O-N 3.02Å; E546-F548 VanDerWaalsContact C-N 3.33Å; E546-F548 PolarHBondContact O-N 3.03Å; F548-M551 HydrophobicContact CD2-CE 3.66Å; F548-M551 HydrophobicContact CE2-CE 3.52Å; F548-M551 HydrophobicContact CG-CE 4.36Å; F548-M551 HydrophobicContact CZ-CE 4.12Å; F548-L552 HydrophobicContact CD1-CD1 3.98Å; F548-L552 HydrophobicContact CE1-CD1 3.56Å; F548-L552 HydrophobicContact CE1-CG 4.25Å; F548-L552 HydrophobicContact CZ-CD1 4.36Å; F548-L552 WeakPolarHBondContact O-CG 3.36Å; F548-L552 PolarHBondContact O-N 3.34Å
549	H	95.6	Very high	95.6	Very high	5 Å²	5	7.7 Å²	7.7	2%	0.023	4%	0.043	C	C	.	.	H	α-helix	trans	-72.2	-40.5	173.7	-168.3	77.3	0	0	0	112.3	K116 D232 L523 L527 A545 E546 Q547 L552 Q553	K116-H549 PolarHBondContact NZ-NE2 2.79Å; D232-H549 IonicContact OD2-CE1 3.28Å; L523-H549 HydrophobicContact CD2-CB 4.37Å; L527-H549 HydrophobicContact CD1-CB 4.09Å; L527-H549 HydrophobicContact CD2-CB 4.36Å; A545-H549 VanDerWaalsContact O-CB 3.31Å; A545-H549 WeakPolarHBondContact O-CB 3.27Å; A545-H549 PolarHBondContact O-N 3.35Å; E546-H549 CarbonylContact O-C 3.58Å; E546-H549 WeakPolarHBondContact O-CA 3.42Å; E546-H549 WeakPolarHBondContact O-CB 3.35Å; E546-H549 PolarHBondContact O-N 3.07Å; E546-H549 VanDerWaalsContact O-N 3.07Å; Q547-H549 VanDerWaalsContact C-N 3.32Å; H549-L552 PolarHBondContact O-N 3.08Å; H549-Q553 PolarHBondContact CD2-NE2 2.64Å; H549-Q553 PolarHBondContact NE2-NE2 3.1Å; H549-Q553 WeakPolarHBondContact O-CG 3.33Å; H549-Q553 PolarHBondContact O-N 3.16Å
550	E	94.8	Very high	95.8	Very high	10 Å²	10	7.4 Å²	7.4	5%	0.047	4%	0.042	C	C	.	.	H	α-helix	trans	-61.7	-40.9	173.8	-75.7	-162	151.3	0	0	111.8	F122 Y136 E546 Q547 L552 Q553 R554	F122-E550 HydrophobicContact CD1-CB 4.29Å; F122-E550 WeakPolarHBondContact CD1-O 3.24Å; Y136-E550 PolarHBondContact OH-OE1 3.23Å; Y136-E550 PolarHBondContact OH-OE2 3.47Å; Y136-E550 VanDerWaalsContact OH-OE2 3.05Å; E546-E550 PolarHBondContact O-N 3.35Å; Q547-E550 PolarHBondContact O-N 3.2Å; E550-L552 PolarHBondContact O-N 2.98Å; E550-Q553 PolarHBondContact O-N 3.25Å; E550-R554 WeakPolarHBondContact O-CB 3.37Å; E550-R554 PolarHBondContact O-N 3.31Å
551	M	95.6	Very high	95.9	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-57.2	-47.3	173.6	-178.7	-176.7	69.4	0	0	111.8	W152 F156 F162 F295 Q547 F548 R554 D555	W152-M551 HydrophobicContact CB-SD 4.3Å; W152-M551 HydrophobicContact CD2-CB 4.11Å; W152-M551 HydrophobicContact CD2-CG 4.33Å; W152-M551 HydrophobicContact CD2-SD 4.45Å; W152-M551 HydrophobicContact CE3-CB 3.65Å; W152-M551 HydrophobicContact CE3-CG 3.57Å; W152-M551 HydrophobicContact CE3-SD 4.06Å; W152-M551 HydrophobicContact CH2-CB 4.06Å; W152-M551 HydrophobicContact CZ2-CB 4.49Å; W152-M551 HydrophobicContact CZ3-CB 3.62Å; W152-M551 HydrophobicContact CZ3-CG 3.8Å; F156-M551 HydrophobicContact CD2-SD 3.48Å; F156-M551 WeakPolarHBondContact CD2-SD 3.32Å; F156-M551 HydrophobicContact CE2-SD 3.93Å; F156-M551 HydrophobicContact CG-SD 4.31Å; F162-M551 HydrophobicContact CB-CE 3.65Å; F162-M551 HydrophobicContact CB-SD 3.96Å; F162-M551 HydrophobicContact CD1-CE 3.87Å; F162-M551 HydrophobicContact CD2-CE 4Å; F162-M551 HydrophobicContact CG-CE 3.55Å; F162-M551 HydrophobicContact CG-SD 4.34Å; F295-M551 HydrophobicContact CE2-CE 4.11Å; F295-M551 HydrophobicContact CE2-SD 3.9Å; Q547-M551 WeakPolarHBondContact O-CB 3.42Å; Q547-M551 PolarHBondContact O-N 3.24Å; F548-M551 HydrophobicContact CD2-CE 3.66Å; F548-M551 HydrophobicContact CE2-CE 3.52Å; F548-M551 HydrophobicContact CG-CE 4.36Å; F548-M551 HydrophobicContact CZ-CE 4.12Å; M551-R554 WeakPolarHBondContact O-CB 3.49Å; M551-R554 PolarHBondContact O-N 3.15Å; M551-D555 VanDerWaalsContact O-CG 3.31Å; M551-D555 PolarHBondContact O-N 3.17Å; M551-D555 VanDerWaalsContact O-N 3.08Å
552	L	95.8	Very high	95.8	Very high	7 Å²	7	8.8 Å²	8.8	4%	0.037	5%	0.047	C	C	.	.	H	α-helix	trans	-69.4	-36.2	179	-66.2	177.4	0	0	0	112.7	F162 L164 I235 L523 F548 H549 E550 D555 A556 Y628	F162-L552 HydrophobicContact CD1-CD2 4.1Å; L164-L552 HydrophobicContact CD1-CD1 4.46Å; L164-L552 HydrophobicContact CD1-CD2 3.79Å; L164-L552 HydrophobicContact CD2-CD2 4.29Å; L164-L552 HydrophobicContact CG-CD2 4.03Å; I235-L552 HydrophobicContact CD1-CD1 3.53Å; L523-L552 HydrophobicContact CD2-CD1 4.37Å; F548-L552 HydrophobicContact CD1-CD1 3.98Å; F548-L552 HydrophobicContact CE1-CD1 3.56Å; F548-L552 HydrophobicContact CE1-CG 4.25Å; F548-L552 HydrophobicContact CZ-CD1 4.36Å; F548-L552 WeakPolarHBondContact O-CG 3.36Å; F548-L552 PolarHBondContact O-N 3.34Å; H549-L552 PolarHBondContact O-N 3.08Å; E550-L552 PolarHBondContact O-N 2.98Å; L552-D555 PolarHBondContact O-N 3.23Å; L552-A556 VanDerWaalsContact O-CB 3.31Å; L552-A556 WeakPolarHBondContact O-CB 3.48Å; L552-A556 PolarHBondContact O-N 2.98Å; L552-Y628 HydrophobicContact CB-CE1 3.87Å; L552-Y628 HydrophobicContact CD1-CE1 4.44Å
553	Q	95.8	Very high	95.8	Very high	5 Å²	5	9.3 Å²	9.3	2%	0.023	5%	0.053	C	C	.	.	H	α-helix	trans	-65.2	-39.4	173	-73.7	176.5	-6.8	0	0	112	F122 H549 E550 A557 Y628 F629	F122-Q553 HydrophobicContact CD1-CB 4.39Å; F122-Q553 HydrophobicContact CE1-CB 3.53Å; F122-Q553 HydrophobicContact CZ-CB 3.86Å; H549-Q553 PolarHBondContact CD2-NE2 2.64Å; H549-Q553 PolarHBondContact NE2-NE2 3.1Å; H549-Q553 WeakPolarHBondContact O-CG 3.33Å; H549-Q553 PolarHBondContact O-N 3.16Å; E550-Q553 PolarHBondContact O-N 3.25Å; Q553-A557 VanDerWaalsContact O-CB 3.31Å; Q553-A557 WeakPolarHBondContact O-CB 3.44Å; Q553-A557 PolarHBondContact O-N 2.96Å; Q553-Y628 HydrophobicContact CG-CD1 4.39Å; Q553-F629 HydrophobicContact CB-CE1 4.41Å; Q553-F629 HydrophobicContact CB-CZ 4.33Å; Q553-F629 WeakPolarHBondContact O-CZ 3.4Å
554	R	96.1	Very high	95.8	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-59.1	-50.2	173.6	-175.4	-161.4	66.5	177.7	-2.5	111.2	F122 N123 F156 M158 E550 M551 A556 A557 F558 L649	F122-R554 HydrophobicContact CB-CB 3.68Å; F122-R554 HydrophobicContact CB-CG 3.75Å; F122-R554 HydrophobicContact CD1-CB 4.19Å; F122-R554 HydrophobicContact CD2-CB 3.89Å; F122-R554 HydrophobicContact CD2-CG 4.07Å; F122-R554 HydrophobicContact CG-CB 3.68Å; F122-R554 HydrophobicContact CG-CG 4.08Å; N123-R554 WeakPolarHBondContact OD1-CD 3Å; N123-R554 PolarHBondContact OD1-NH1 3.34Å; F156-R554 PolarHBondContact O-NH1 3.5Å; F156-R554 PolarHBondContact O-NH2 2.84Å; M158-R554 HydrophobicContact CG-CG 4.08Å; M158-R554 HydrophobicContact SD-CG 4.21Å; E550-R554 WeakPolarHBondContact O-CB 3.37Å; E550-R554 PolarHBondContact O-N 3.31Å; M551-R554 WeakPolarHBondContact O-CB 3.49Å; M551-R554 PolarHBondContact O-N 3.15Å; R554-A556 VanDerWaalsContact C-N 3.32Å; R554-A556 PolarHBondContact O-N 2.61Å; R554-A557 PolarHBondContact O-N 3.5Å; R554-A557 VanDerWaalsContact O-N 3.16Å; R554-F558 PolarHBondContact O-N 2.91Å; R554-L649 HydrophobicContact CG-CD2 4.03Å; R554-L649 WeakPolarHBondContact O-CD2 3.5Å
555	D	95.6	Very high	95.5	Very high	13 Å²	13	12.3 Å²	12.3	7%	0.07	7%	0.067	C	C	.	.	H	α-helix	trans	-67.8	-36.5	-175.5	-66.8	-4.6	0	0	0	110.7	P161 F162 M551 L552 T559	P161-D555 WeakPolarHBondContact CA-OD2 3.5Å; P161-D555 HydrophobicContact CB-CB 3.88Å; P161-D555 WeakPolarHBondContact CB-OD2 3.07Å; F162-D555 PolarHBondContact N-OD2 2.79Å; M551-D555 VanDerWaalsContact O-CG 3.31Å; M551-D555 PolarHBondContact O-N 3.17Å; M551-D555 VanDerWaalsContact O-N 3.08Å; L552-D555 PolarHBondContact O-N 3.23Å; D555-T559 WeakPolarHBondContact O-CB 3.42Å; D555-T559 PolarHBondContact O-N 3.09Å; D555-T559 PolarHBondContact O-OG1 3.26Å
556	A	96	Very high	95.2	Very high	6 Å²	6	16.9 Å²	16.9	5%	0.05	9%	0.091	C	C	.	.	H	α-helix	trans	-61.7	-49	167.9	0	0	0	0	0	112.6	L552 R554 F558 T559 I560 A625 Y628 F629	L552-A556 VanDerWaalsContact O-CB 3.31Å; L552-A556 WeakPolarHBondContact O-CB 3.48Å; L552-A556 PolarHBondContact O-N 2.98Å; R554-A556 VanDerWaalsContact C-N 3.32Å; R554-A556 PolarHBondContact O-N 2.61Å; A556-F558 VanDerWaalsContact C-N 3.32Å; A556-F558 PolarHBondContact O-N 2.84Å; A556-T559 WeakPolarHBondContact O-CB 3.45Å; A556-T559 PolarHBondContact O-N 3.25Å; A556-I560 WeakPolarHBondContact O-CG1 3.43Å; A556-I560 PolarHBondContact O-N 3.08Å; A556-A625 HydrophobicContact CB-CB 3.87Å; A556-Y628 HydrophobicContact CB-CD2 3.85Å; A556-Y628 HydrophobicContact CB-CG 4.26Å; A556-F629 HydrophobicContact CB-CE2 4Å; A556-F629 HydrophobicContact CB-CZ 4.48Å
557	A	97.3	Very high	94.9	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-62.8	-36.6	178.7	0	0	0	0	0	112.3	F122 Q553 R554 I560 F561 F629 I645 L646 L649	F122-A557 HydrophobicContact CE2-CB 4.01Å; Q553-A557 VanDerWaalsContact O-CB 3.31Å; Q553-A557 WeakPolarHBondContact O-CB 3.44Å; Q553-A557 PolarHBondContact O-N 2.96Å; R554-A557 PolarHBondContact O-N 3.5Å; R554-A557 VanDerWaalsContact O-N 3.16Å; A557-I560 PolarHBondContact O-N 2.93Å; A557-F561 WeakPolarHBondContact O-CB 3.38Å; A557-F561 PolarHBondContact O-N 2.83Å; A557-F629 HydrophobicContact CB-CE2 4.35Å; A557-F629 HydrophobicContact CB-CZ 3.97Å; A557-I645 HydrophobicContact CB-CG2 4.02Å; A557-L646 VanDerWaalsContact O-CD2 3.29Å; A557-L646 WeakPolarHBondContact O-CD2 3.28Å; A557-L649 HydrophobicContact CB-CD1 4.34Å; A557-L649 HydrophobicContact CB-CD2 3.78Å; A557-L649 HydrophobicContact CB-CG 4.12Å
558	F	96.3	Very high	94.3	Very high	11 Å²	11	21.5 Å²	21.5	5%	0.048	13%	0.125	C	C	.	.	H	α-helix	trans	-72.8	-36.4	176.4	-172	-110.9	0	0	0	112.3	M158 R554 A556 I560 F561 K562 L649 L651 T704 L707 A708	M158-F558 HydrophobicContact CB-CD1 4.06Å; M158-F558 HydrophobicContact CB-CD2 4.31Å; M158-F558 HydrophobicContact CB-CE1 4.3Å; M158-F558 HydrophobicContact CB-CG 4.07Å; M158-F558 WeakPolarHBondContact O-CD1 3.16Å; M158-F558 WeakPolarHBondContact O-CE1 3.26Å; M158-F558 HydrophobicContact SD-CD2 4.34Å; R554-F558 PolarHBondContact O-N 2.91Å; A556-F558 VanDerWaalsContact C-N 3.32Å; A556-F558 PolarHBondContact O-N 2.84Å; F558-I560 VanDerWaalsContact C-N 3.3Å; F558-I560 PolarHBondContact O-N 3.23Å; F558-F561 HydrophobicContact CD2-CB 4.48Å; F558-F561 HydrophobicContact CD2-CD1 4.12Å; F558-F561 AromaticContact CE2-CD1 3.97Å; F558-F561 HydrophobicContact CE2-CD1 3.97Å; F558-F561 WeakPolarHBondContact O-CB 3.21Å; F558-F561 PolarHBondContact O-N 2.98Å; F558-K562 PolarHBondContact O-N 2.91Å; F558-L649 HydrophobicContact CB-CD2 4.02Å; F558-L649 HydrophobicContact CD2-CD1 4.47Å; F558-L651 HydrophobicContact CD2-CD1 4.46Å; F558-T704 HydrophobicContact CE1-CG2 3.94Å; F558-T704 HydrophobicContact CZ-CG2 4.37Å; F558-L707 HydrophobicContact CZ-CB 4.16Å; F558-A708 HydrophobicContact CE2-CB 4.17Å; F558-A708 HydrophobicContact CZ-CB 3.81Å
559	T	95.5	Very high	93.2	Very high	53 Å²	53	28.2 Å²	28.2	33%	0.325	16%	0.156	S	C	.	.	H	α-helix	trans	-58.8	-42.4	170.8	-58.5	0	0	0	0	111.1	D555 A556 A563 L622 A625	D555-T559 WeakPolarHBondContact O-CB 3.42Å; D555-T559 PolarHBondContact O-N 3.09Å; D555-T559 PolarHBondContact O-OG1 3.26Å; A556-T559 WeakPolarHBondContact O-CB 3.45Å; A556-T559 PolarHBondContact O-N 3.25Å; T559-A563 PolarHBondContact O-N 3.24Å; T559-L622 HydrophobicContact CG2-CD1 4.26Å; T559-A625 HydrophobicContact CG2-CB 4.08Å
560	I	96.6	Very high	91.9	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-69.2	-41.4	175.1	-63.2	161.7	0	0	0	111.1	A556 A557 F558 K562 A563 I564 L622 A625 F626 F629 L642 L646	A556-I560 WeakPolarHBondContact O-CG1 3.43Å; A556-I560 PolarHBondContact O-N 3.08Å; A557-I560 PolarHBondContact O-N 2.93Å; F558-I560 VanDerWaalsContact C-N 3.3Å; F558-I560 PolarHBondContact O-N 3.23Å; I560-K562 PolarHBondContact O-N 2.69Å; I560-A563 PolarHBondContact O-N 3.46Å; I560-I564 HydrophobicContact CG2-CD1 3.67Å; I560-I564 HydrophobicContact CG2-CG1 4.39Å; I560-I564 VanDerWaalsContact O-CG1 3.29Å; I560-I564 WeakPolarHBondContact O-CG1 3.49Å; I560-I564 PolarHBondContact O-N 3.34Å; I560-I564 VanDerWaalsContact O-N 3.09Å; I560-L622 HydrophobicContact CB-CD1 4.47Å; I560-L622 HydrophobicContact CG1-CD1 4Å; I560-A625 HydrophobicContact CD1-CB 4.16Å; I560-A625 HydrophobicContact CG1-CB 3.93Å; I560-F626 HydrophobicContact CB-CZ 4.42Å; I560-F626 HydrophobicContact CD1-CD1 3.78Å; I560-F626 HydrophobicContact CD1-CD2 4.43Å; I560-F626 HydrophobicContact CD1-CE1 3.96Å; I560-F626 HydrophobicContact CD1-CG 4.04Å; I560-F626 HydrophobicContact CD1-CZ 4.36Å; I560-F626 HydrophobicContact CG1-CD1 4.25Å; I560-F626 HydrophobicContact CG1-CD2 4.19Å; I560-F626 HydrophobicContact CG1-CE1 4.09Å; I560-F626 HydrophobicContact CG1-CE2 4.03Å; I560-F626 HydrophobicContact CG1-CG 4.3Å; I560-F626 HydrophobicContact CG1-CZ 3.98Å; I560-F626 HydrophobicContact CG2-CE1 3.8Å; I560-F626 HydrophobicContact CG2-CE2 4.38Å; I560-F626 HydrophobicContact CG2-CZ 3.61Å; I560-F629 HydrophobicContact CD1-CD2 4.02Å; I560-F629 HydrophobicContact CD1-CE2 3.97Å; I560-L642 HydrophobicContact CG2-CD1 3.93Å; I560-L646 HydrophobicContact CG2-CD2 4.38Å
561	F	96.3	Very high	89.8	Confident	3 Å²	3	40.5 Å²	40.5	1%	0.013	21%	0.212	C	C	.	.	H	α-helix	trans	-55.5	-50.5	175.6	177.6	-102.9	0	0	0	111.5	A557 F558 I564 H565 L646 L649 L651 Y653 L661	A557-F561 WeakPolarHBondContact O-CB 3.38Å; A557-F561 PolarHBondContact O-N 2.83Å; F558-F561 HydrophobicContact CD2-CB 4.48Å; F558-F561 HydrophobicContact CD2-CD1 4.12Å; F558-F561 AromaticContact CE2-CD1 3.97Å; F558-F561 HydrophobicContact CE2-CD1 3.97Å; F558-F561 WeakPolarHBondContact O-CB 3.21Å; F558-F561 PolarHBondContact O-N 2.98Å; F561-I564 PolarHBondContact O-N 3.37Å; F561-H565 WeakPolarHBondContact O-CB 3.22Å; F561-H565 PolarHBondContact O-N 3.31Å; F561-L646 HydrophobicContact CB-CD2 3.97Å; F561-L649 HydrophobicContact CB-CD1 3.91Å; F561-L649 HydrophobicContact CG-CD1 4.34Å; F561-L651 HydrophobicContact CD1-CD1 3.84Å; F561-L651 HydrophobicContact CD2-CD1 4.12Å; F561-L651 HydrophobicContact CE1-CD1 3.79Å; F561-L651 HydrophobicContact CE2-CD1 4.07Å; F561-L651 HydrophobicContact CG-CD1 4.02Å; F561-L651 HydrophobicContact CZ-CD1 3.92Å; F561-Y653 HydrophobicContact CE1-CE2 4.49Å; F561-Y653 HydrophobicContact CE2-CD2 4.17Å; F561-Y653 AromaticContact CE2-CE2 3.83Å; F561-Y653 HydrophobicContact CE2-CE2 3.83Å; F561-Y653 HydrophobicContact CZ-CD2 4.26Å; F561-Y653 AromaticContact CZ-CE2 3.46Å; F561-Y653 HydrophobicContact CZ-CE2 3.46Å; F561-Y653 VanDerWaalsContact CZ-CE2 3.46Å; F561-Y653 AromaticContact CZ-CZ 3.92Å; F561-L661 HydrophobicContact CE2-CD1 4.02Å
562	K	94.4	Very high	87.6	Confident	26 Å²	26	47.7 Å²	47.7	11%	0.113	25%	0.249	C	C	.	.	H	α-helix	trans	-58.4	-49.9	179	-175.7	169.8	178.6	171.5	0	111.6	F558 I560 I564 H565 D566 E699 T704 L707	F558-K562 PolarHBondContact O-N 2.91Å; I560-K562 PolarHBondContact O-N 2.69Å; K562-I564 PolarHBondContact O-N 2.99Å; K562-I564 VanDerWaalsContact O-N 3.17Å; K562-H565 WeakPolarHBondContact O-CB 3.38Å; K562-H565 PolarHBondContact O-N 3.08Å; K562-H565 VanDerWaalsContact O-N 3.14Å; K562-D566 WeakPolarHBondContact CG-OD2 3.42Å; K562-D566 WeakPolarHBondContact O-CB 3.45Å; K562-D566 VanDerWaalsContact O-CG 3.31Å; K562-D566 PolarHBondContact O-N 3.28Å; K562-E699 WeakPolarHBondContact CE-OE1 3.3Å; K562-E699 IonicContact NZ-OE1 3.81Å; K562-E699 PolarHBondContact NZ-OE1 3.37Å; K562-E699 IonicContact NZ-OE2 3.42Å; K562-E699 PolarHBondContact NZ-OE2 2.78Å; K562-T704 PolarHBondContact NZ-OG1 3.19Å; K562-L707 HydrophobicContact CG-CD1 4.38Å
563	A	93.9	Very high	84.7	Confident	26 Å²	26	55 Å²	55	22%	0.215	28%	0.28	C	S	.	.	H	α-helix	trans	-62	-24.2	177.9	0	0	0	0	0	114.7	T559 I560 L622	T559-A563 PolarHBondContact O-N 3.24Å; I560-A563 PolarHBondContact O-N 3.46Å; A563-L622 HydrophobicContact CB-CD1 3.61Å; A563-L622 HydrophobicContact CB-CD2 3.54Å; A563-L622 HydrophobicContact CB-CG 4.21Å
564	I	94.5	Very high	81.9	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.01	31%	0.314	C	S	.	.	H	α-helix	trans	-88.3	-34.7	175.3	-67	174.6	0	0	0	111.6	I560 F561 K562 A567 L642 L646 L661 V665	I560-I564 HydrophobicContact CG2-CD1 3.67Å; I560-I564 HydrophobicContact CG2-CG1 4.39Å; I560-I564 VanDerWaalsContact O-CG1 3.29Å; I560-I564 WeakPolarHBondContact O-CG1 3.49Å; I560-I564 PolarHBondContact O-N 3.34Å; I560-I564 VanDerWaalsContact O-N 3.09Å; F561-I564 PolarHBondContact O-N 3.37Å; K562-I564 PolarHBondContact O-N 2.99Å; K562-I564 VanDerWaalsContact O-N 3.17Å; I564-A567 PolarHBondContact O-N 3.2Å; I564-L642 HydrophobicContact CD1-CD2 3.89Å; I564-L646 HydrophobicContact CD1-CD1 4.13Å; I564-L661 HydrophobicContact CG2-CB 4.24Å; I564-L661 WeakPolarHBondContact CG2-O 3.45Å; I564-V665 HydrophobicContact CD1-CG2 3.98Å; I564-V665 HydrophobicContact CG1-CG1 4.21Å; I564-V665 HydrophobicContact CG1-CG2 3.8Å; I564-V665 HydrophobicContact CG2-CG2 4.16Å
565	H	92.6	Very high	79.2	Confident	62 Å²	62	68.3 Å²	68.3	29%	0.287	35%	0.352	S	S	.	.	H	α-helix	trans	-62.7	-44.3	174.1	178.9	-84.2	0	0	0	111.2	F561 K562 A567 R664	F561-H565 WeakPolarHBondContact O-CB 3.22Å; F561-H565 PolarHBondContact O-N 3.31Å; K562-H565 WeakPolarHBondContact O-CB 3.38Å; K562-H565 PolarHBondContact O-N 3.08Å; K562-H565 VanDerWaalsContact O-N 3.14Å; H565-A567 VanDerWaalsContact C-N 3.3Å; H565-A567 PolarHBondContact O-N 2.93Å; H565-R664 PolarHBondContact O-NH1 2.82Å
566	D	89.8	Confident	76.5	Confident	96 Å²	96	76.5 Å²	76.5	51%	0.513	39%	0.39	S	S	.	.	S	Bend	trans	-85.8	-3.4	-175.9	-56.3	-19	0	0	0	112.7	K562	K562-D566 WeakPolarHBondContact CG-OD2 3.42Å; K562-D566 WeakPolarHBondContact O-CB 3.45Å; K562-D566 VanDerWaalsContact O-CG 3.31Å; K562-D566 PolarHBondContact O-N 3.28Å
567	A	88.7	Confident	73.6	Confident	13 Å²	13	84.4 Å²	84.4	11%	0.107	43%	0.431	C	S	.	.	S	Bend	trans	-69.7	137.8	174	0	0	0	0	0	111.4	I564 H565 V665	I564-A567 PolarHBondContact O-N 3.2Å; H565-A567 VanDerWaalsContact C-N 3.3Å; H565-A567 PolarHBondContact O-N 2.93Å; A567-V665 HydrophobicContact CB-CG1 3.58Å
568	P	82.9	Confident	70.8	Confident	113 Å²	113	87.4 Å²	87.4	73%	0.734	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-62.3	143.9	-178.4	26.4	-35.1	0	0	0	111.7	K570	P568-K570 PolarHBondContact O-N 2.88Å
569	E	73.7	Confident	67.9	Low	142 Å²	142	95.7 Å²	95.7	66%	0.664	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-67.4	126.6	176.3	-57.2	-142.3	120.7	0	0	110.3	E571 R664	E569-E571 PolarHBondContact O-N 2.7Å; E569-R664 IonicContact OE1-CZ 2.69Å; E569-R664 IonicContact OE1-NE 2.69Å; E569-R664 PolarHBondContact OE1-NE 2.94Å; E569-R664 IonicContact OE1-NH2 3.01Å; E569-R664 PolarHBondContact OE1-NH2 2.86Å
570	K	67.7	Low	65.3	Low	105 Å²	105	101.4 Å²	101.4	46%	0.457	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-68	119.9	167.2	-73.6	173.9	177.1	136.4	0	108.4	P568 I572 R664 V665 A666	P568-K570 PolarHBondContact O-N 2.88Å; K570-I572 VanDerWaalsContact C-N 3.33Å; K570-I572 PolarHBondContact O-N 3.33Å; K570-R664 WeakPolarHBondContact CD-O 3.15Å; K570-R664 WeakPolarHBondContact CE-O 3.25Å; K570-R664 PolarHBondContact NZ-O 3.17Å; K570-V665 PolarHBondContact NZ-O 2.91Å; K570-A666 PolarHBondContact NZ-O 2.93Å
571	E	50.8	Low	62.4	Low	167 Å²	167	108.9 Å²	108.9	78%	0.78	56%	0.561	S	S	*	*			trans	-59.5	98.1	162.5	-73.1	-170.6	172.3	0	0	109.2	E569 K573	E569-E571 PolarHBondContact O-N 2.7Å; E571-K573 PolarHBondContact O-N 3.17Å
572	I	48.7	Very low	59.6	Low	152 Å²	152	116.4 Å²	116.4	78%	0.779	60%	0.602	S	S	*	*			trans	-71.8	85.1	166.6	-54.3	177.4	0	0	0	106.4	K570 P574	K570-I572 VanDerWaalsContact C-N 3.33Å; K570-I572 PolarHBondContact O-N 3.33Å; I572-P574 WeakPolarHBondContact O-CD 3.41Å
573	K	34.2	Very low	56.8	Low	161 Å²	161	118.8 Å²	118.8	70%	0.7	63%	0.633	S	S	*	*			trans	-53.6	122	162.1	-70.3	-174.6	178.4	-179	0	106.5	E571 E575	E571-K573 PolarHBondContact O-N 3.17Å; K573-E575 PolarHBondContact O-N 2.81Å
574	P	37.9	Very low	54.2	Low	111 Å²	111	127.8 Å²	127.8	72%	0.721	67%	0.668	S	S	*	*			trans	-63.7	113.7	179.2	25.4	-32.5	0	0	0	107.9	I572 Q576	I572-P574 WeakPolarHBondContact O-CD 3.41Å; P574-Q576 PolarHBondContact O-N 2.98Å; P574-Q576 VanDerWaalsContact O-N 3.13Å
575	E	39	Very low	51.5	Low	173 Å²	173	135 Å²	135	81%	0.808	71%	0.706	S	S	*	*			trans	-60	117.2	163.6	-68.1	-171.6	157.6	0	0	106	K573 D577	K573-E575 PolarHBondContact O-N 2.81Å; E575-D577 PolarHBondContact O-N 2.91Å
576	Q	39.5	Very low	49.1	Very low	185 Å²	185	137.4 Å²	137.4	86%	0.864	73%	0.73	S	S	*	*			trans	-65.6	128.7	-179.3	-72.5	-179.3	-26.4	0	0	108.5	P574 G578	P574-Q576 PolarHBondContact O-N 2.98Å; P574-Q576 VanDerWaalsContact O-N 3.13Å; Q576-G578 PolarHBondContact O-N 3.25Å
577	D	35.3	Very low	46.7	Very low	171 Å²	171	139.8 Å²	139.8	91%	0.914	74%	0.743	S	S	*	*			trans	-66.4	64.5	166	-84.9	-51.3	0	0	0	110.4	E575 K579	E575-D577 PolarHBondContact O-N 2.91Å; D577-K579 VanDerWaalsContact C-N 3.34Å; D577-K579 PolarHBondContact O-N 3.35Å
578	G	37.6	Very low	44.6	Very low	64 Å²	64	148.1 Å²	148.1	66%	0.66	78%	0.78	S	S	*	*			trans	-78.6	77.7	-177.5	0	0	0	0	0	111.1	Q576 L580	Q576-G578 PolarHBondContact O-N 3.25Å; G578-L580 PolarHBondContact O-N 3.24Å
579	K	35.5	Very low	42.7	Very low	184 Å²	184	148.5 Å²	148.5	80%	0.8	78%	0.782	S	S	*	*			trans	-52.2	113.2	167.5	-80.6	-173.1	171.6	-169.5	0	110.8	D577	D577-K579 VanDerWaalsContact C-N 3.34Å; D577-K579 PolarHBondContact O-N 3.35Å
580	L	40.7	Very low	41.2	Very low	173 Å²	173	148.2 Å²	148.2	91%	0.906	79%	0.785	S	S	*	*			trans	-132.2	105.4	153.1	-74.8	178.3	0	0	0	108.8	G578	G578-L580 PolarHBondContact O-N 3.24Å
581	E	37.4	Very low	40	Very low	158 Å²	158	147.3 Å²	147.3	74%	0.738	79%	0.792	S	S	*	*			trans	-80.4	163.9	168.5	-66.2	174	110.6	0	0	110.5
582	N	37	Very low	39.6	Very low	161 Å²	161	146.8 Å²	146.8	86%	0.861	79%	0.788	S	S	*	*			trans	71.9	120.2	173	-47.3	-58.3	0	0	0	115
583	G	35.4	Very low	39.4	Very low	76 Å²	76	151 Å²	151	78%	0.784	79%	0.794	S	S	*	*			trans	-112.3	-173.5	172.2	0	0	0	0	0	112
584	F	39	Very low	39.8	Very low	215 Å²	215	154.8 Å²	154.8	94%	0.943	80%	0.804	S	S	*	*			trans	-150	145.6	163	-142.9	-100.2	0	0	0	110.6
585	D	37.6	Very low	39.9	Very low	152 Å²	152	160.1 Å²	160.1	81%	0.813	81%	0.809	S	S	*	*			trans	-82	142.1	174.9	-112	-31.7	0	0	0	110.7
586	S	42.5	Very low	39.8	Very low	113 Å²	113	158 Å²	158	79%	0.79	80%	0.803	S	S	*	*			trans	-166.7	129.8	149.9	-167	0	0	0	0	111.5
587	D	39.9	Very low	40	Very low	146 Å²	146	155.8 Å²	155.8	78%	0.781	80%	0.798	S	S	*	*			trans	-69.9	147.8	164.4	-58.9	-84.7	0	0	0	111.7
588	E	44.3	Very low	40.3	Very low	189 Å²	189	151.7 Å²	151.7	88%	0.883	78%	0.782	S	S	*	*				178.8	149.7	103.4	-99.3	-156	137	0	0	113.1
589	P	43.2	Very low	40.7	Very low	120 Å²	120	158 Å²	158	78%	0.779	80%	0.795	S	S	*	*			trans	-119.5	135.6	169.2	37.6	-25.8	0	0	0	114.4
590	D	42.6	Very low	40.7	Very low	136 Å²	136	157 Å²	157	73%	0.727	80%	0.798	S	S	*	*			trans	-145.4	173.9	156.4	-163.8	17.2	0	0	0	112.3	K592	D590-K592 IonicContact OD1-NZ 2.79Å; D590-K592 PolarHBondContact OD1-NZ 2.93Å; D590-K592 IonicContact OD2-NZ 2.76Å; D590-K592 PolarHBondContact OD2-NZ 3.43Å
591	S	42	Very low	40.6	Very low	87 Å²	87	152.1 Å²	152.1	61%	0.608	79%	0.789	S	S	*	*			trans	-118.6	175.9	-162.1	-54.5	0	0	0	0	112.7
592	K	42.9	Very low	40.8	Very low	156 Å²	156	153.3 Å²	153.3	68%	0.678	79%	0.794	S	S	*	*			trans	84.6	108.4	161.4	-40.1	133.7	-163	133.4	0	117.4	D590	D590-K592 IonicContact OD1-NZ 2.79Å; D590-K592 PolarHBondContact OD1-NZ 2.93Å; D590-K592 IonicContact OD2-NZ 2.76Å; D590-K592 PolarHBondContact OD2-NZ 3.43Å
593	R	43.7	Very low	40.7	Very low	240 Å²	240	149.9 Å²	149.9	91%	0.906	78%	0.782	S	S	*	*				-161.8	115	128.7	-89.1	135.8	-165.2	-123.7	7.1	104.7
594	R	42.2	Very low	40.9	Very low	241 Å²	241	153 Å²	153	91%	0.909	78%	0.781	S	S	*	*				54.5	136.7	68.1	-69.4	-170.7	172.5	-161.4	-0.2	113.2
595	R	40	Very low	40.9	Very low	223 Å²	223	152.2 Å²	152.2	84%	0.842	78%	0.78	S	S	*	*			cis	172	132.5	-29.7	171.6	178.4	-162.5	-168.1	7.9	104.5
596	N	38.1	Very low	41.2	Very low	127 Å²	127	152.4 Å²	152.4	68%	0.679	78%	0.776	S	S	*	*			trans	66.7	157.5	-171.1	-69.3	39.1	0	0	0	113.5
597	D	42.7	Very low	41.2	Very low	140 Å²	140	154.2 Å²	154.2	75%	0.749	78%	0.777	S	S	*	*			cis	-120.1	148.5	6.1	-91.2	-53.1	0	0	0	110.6
598	S	41.9	Very low	41.6	Very low	85 Å²	85	155 Å²	155	59%	0.594	78%	0.776	S	S	*	*				96.5	101.8	52.8	-57	0	0	0	0	113.7
599	Q	45.5	Very low	42.1	Very low	197 Å²	197	153.3 Å²	153.3	92%	0.921	77%	0.771	S	S	*	*			trans	61.8	141.9	163.5	-57.2	175.8	-20.4	0	0	116.2
600	N	37.2	Very low	42.8	Very low	163 Å²	163	157 Å²	157	87%	0.872	78%	0.775	S	S	*	*			cis	-164	150.6	29.3	-170.9	14.9	0	0	0	111.4
601	G	37.4	Very low	43.8	Very low	69 Å²	69	154.5 Å²	154.5	71%	0.711	76%	0.764	S	S	*	*			trans	72.5	159.7	174.6	0	0	0	0	0	115.8
602	H	40.8	Very low	44.9	Very low	183 Å²	183	158.7 Å²	158.7	85%	0.847	77%	0.767	S	S	*	*			cis	-146.5	165	-6.1	-179.8	60.7	0	0	0	109.4
603	C	35.3	Very low	46.3	Very low	89 Å²	89	160 Å²	160	60%	0.601	77%	0.768	S	S	*	*			trans	-48.1	143	-169.1	-51.2	0	0	0	0	117
604	D	41.2	Very low	47.9	Very low	142 Å²	142	150.5 Å²	150.5	76%	0.759	74%	0.735	S	S	*	*				-171.3	83.7	121.9	-98.9	-20.4	0	0	0	110.8	Q606	D604-Q606 PolarHBondContact O-N 3.27Å
605	E	37.6	Very low	49.9	Very low	198 Å²	198	144.1 Å²	144.1	93%	0.925	71%	0.71	S	S	*	*			trans	-84.2	84.2	167.4	-75.8	-177.5	137	0	0	109.8
606	Q	43.2	Very low	52	Low	156 Å²	156	135.3 Å²	135.3	73%	0.729	68%	0.677	S	S	*	*			trans	-95.8	84.1	162.7	-67.9	-170.7	20.6	0	0	109.6	D604 E608	D604-Q606 PolarHBondContact O-N 3.27Å; Q606-E608 PolarHBondContact O-N 2.71Å
607	D	44.4	Very low	54.4	Low	152 Å²	152	129.4 Å²	129.4	81%	0.813	65%	0.646	S	S	*	*			trans	-68.2	84.9	161.8	-103.6	-31.5	0	0	0	108.5	I609	D607-I609 PolarHBondContact O-N 3Å
608	E	47.7	Very low	56.6	Low	161 Å²	161	126 Å²	126	75%	0.752	63%	0.63	S	S	*	*			trans	-54.2	116.1	167.3	-80	-165.2	138.3	0	0	108.8	Q606 K610	Q606-E608 PolarHBondContact O-N 2.71Å; E608-K610 PolarHBondContact O-N 3.48Å
609	I	54.6	Low	58.9	Low	155 Å²	155	125 Å²	125	80%	0.795	62%	0.618	S	S	*	*			trans	-54.4	111	170.9	-61.8	171.2	0	0	0	107.1	D607 V611	D607-I609 PolarHBondContact O-N 3Å; I609-V611 WeakPolarHBondContact O-CG2 3.21Å; I609-V611 PolarHBondContact O-N 2.86Å
610	K	58.7	Low	61	Low	196 Å²	196	116.4 Å²	116.4	85%	0.852	58%	0.579	S	S	*	*			trans	-73.7	76.3	-176.1	-76	177.8	-179.5	161.7	0	110.8	E608 R612	E608-K610 PolarHBondContact O-N 3.48Å; K610-R612 PolarHBondContact O-N 3.14Å; K610-R612 VanDerWaalsContact O-N 3.1Å
611	V	62.4	Low	63.6	Low	84 Å²	84	110.5 Å²	110.5	51%	0.509	55%	0.553	S	S	.	*			trans	-48.1	117.2	175.9	-178.2	0	0	0	0	109	I609 R613 V683	I609-V611 WeakPolarHBondContact O-CG2 3.21Å; I609-V611 PolarHBondContact O-N 2.86Å; V611-R613 PolarHBondContact O-N 3.28Å; V611-V683 HydrophobicContact CG1-CB 4.23Å; V611-V683 HydrophobicContact CG1-CG1 3.47Å; V611-V683 VanDerWaalsContact CG1-CG1 3.47Å; V611-V683 HydrophobicContact CG1-CG2 3.84Å
612	R	65.2	Low	66.3	Low	176 Å²	176	107.3 Å²	107.3	66%	0.664	52%	0.52	S	S	*	.			trans	-65.7	107.4	-174.4	-176	179.3	177.9	171.1	-4.1	109.7	K610 L614	K610-R612 PolarHBondContact O-N 3.14Å; K610-R612 VanDerWaalsContact O-N 3.1Å; R612-L614 HydrophobicContact CG-CD1 4.04Å
613	R	73.1	Confident	68.9	Low	184 Å²	184	98.7 Å²	98.7	69%	0.694	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	132.4	169.7	-58.1	-175.8	-170	179.2	2.7	109.5	V611 D681 I682 V683	V611-R613 PolarHBondContact O-N 3.28Å; R613-D681 HydrophobicContact CB-CB 4.44Å; R613-I682 CarbonylContact C-O 3.57Å; R613-I682 VanDerWaalsContact CA-O 3.23Å; R613-I682 WeakPolarHBondContact CA-O 3.14Å; R613-V683 HydrophobicContact CG-CG2 4.3Å
614	L	76.5	Confident	71.7	Confident	40 Å²	40	95.3 Å²	95.3	21%	0.209	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	130.9	172	-69.2	87.9	0	0	0	108.2	R612 R616 I682 E684	R612-L614 HydrophobicContact CG-CD1 4.04Å; L614-R616 HydrophobicContact CB-CG 4.46Å; L614-R616 PolarHBondContact O-N 2.89Å; L614-I682 PolarHBondContact N-O 3.05Å; L614-I682 PolarHBondContact O-N 2.95Å; L614-E684 HydrophobicContact CD1-CB 3.86Å; L614-E684 HydrophobicContact CD1-CG 4.07Å
615	R	83.4	Confident	74.3	Confident	106 Å²	106	88.7 Å²	88.7	40%	0.4	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	109.8	175.1	-172.4	-177.2	-175.2	106	-6.4	109	A220 H675 D679 S680 D681	A220-R615 HydrophobicContact CB-CG 4.19Å; A220-R615 WeakPolarHBondContact CB-O 3.5Å; R615-H675 PolarHBondContact NH2-O 3.01Å; R615-D679 HydrophobicContact CG-CB 4.17Å; R615-D679 IonicContact NE-OD2 3.94Å; R615-S680 CarbonylContact C-O 3.42Å; R615-S680 WeakPolarHBondContact CA-O 3.48Å; R615-D681 WeakPolarHBondContact CB-OD1 3.37Å; R615-D681 WeakPolarHBondContact CG-OD1 3.36Å; R615-D681 IonicContact NH1-OD1 3.81Å
616	R	85.5	Confident	77	Confident	39 Å²	39	79.2 Å²	79.2	15%	0.147	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	153.4	-179.7	-52.8	-136.3	168.8	141.8	21.6	112	D221 L614 V618 D679 S680 I682 D689	D221-R616 WeakPolarHBondContact OD1-CD 3.47Å; D221-R616 WeakPolarHBondContact OD1-CG 3.47Å; D221-R616 IonicContact OD1-NE 3.18Å; D221-R616 PolarHBondContact OD1-NE 3.47Å; D221-R616 WeakPolarHBondContact OD2-CA 3.43Å; D221-R616 WeakPolarHBondContact OD2-CB 3.15Å; L614-R616 HydrophobicContact CB-CG 4.46Å; L614-R616 PolarHBondContact O-N 2.89Å; R616-V618 PolarHBondContact O-N 3.25Å; R616-D679 CarbonylContact O-C 3.6Å; R616-D679 WeakPolarHBondContact O-CA 3.24Å; R616-D679 WeakPolarHBondContact O-CB 3.36Å; R616-S680 PolarHBondContact N-O 2.9Å; R616-S680 PolarHBondContact O-N 3.34Å; R616-I682 HydrophobicContact CB-CD1 3.72Å; R616-I682 HydrophobicContact CB-CG1 4.25Å; R616-I682 HydrophobicContact CG-CB 4.49Å; R616-I682 HydrophobicContact CG-CD1 4.03Å; R616-I682 HydrophobicContact CG-CG1 4.32Å; R616-D689 IonicContact CZ-OD1 3.72Å; R616-D689 IonicContact CZ-OD2 3.93Å; R616-D689 IonicContact NE-OD1 3.5Å; R616-D689 PolarHBondContact NH1-O 3.3Å; R616-D689 IonicContact NH1-OD1 2.71Å; R616-D689 PolarHBondContact NH1-OD1 3.27Å; R616-D689 IonicContact NH1-OD2 2.88Å; R616-D689 PolarHBondContact NH1-OD2 3.21Å; R616-D689 IonicContact NH2-OD1 3.17Å; R616-D689 PolarHBondContact NH2-OD1 3.25Å; R616-D689 IonicContact NH2-OD2 3.33Å; R616-D689 PolarHBondContact NH2-OD2 3.49Å
617	T	88.9	Confident	79.4	Confident	3 Å²	3	72.1 Å²	72.1	2%	0.018	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	110.6	170.7	-63	0	0	0	0	109.8	M219 A220 P620 L623 T678 D679	M219-T617 HydrophobicContact SD-CG2 3.82Å; A220-T617 PolarHBondContact N-OG1 3.4Å; T617-P620 HydrophobicContact CG2-CB 4.41Å; T617-L623 HydrophobicContact CG2-CB 4.45Å; T617-L623 HydrophobicContact CG2-CD2 3.76Å; T617-T678 CarbonylContact C-O 3.55Å; T617-D679 WeakPolarHBondContact CB-OD1 3.13Å; T617-D679 PolarHBondContact OG1-OD1 3.02Å
618	V	87.6	Confident	81.7	Confident	68 Å²	68	65.4 Å²	65.4	41%	0.412	31%	0.306	S	S	.	.	S	Bend	trans	-90.6	-32.5	-176.6	-176.3	0	0	0	0	112	R616 P620 T678 I682	R616-V618 PolarHBondContact O-N 3.25Å; V618-P620 VanDerWaalsContact C-CD 3.49Å; V618-P620 VanDerWaalsContact O-CD 3.23Å; V618-P620 WeakPolarHBondContact O-CD 3.37Å; V618-T678 PolarHBondContact N-O 3.39Å; V618-I682 HydrophobicContact CG2-CD1 3.76Å
619	N	89.6	Confident	84	Confident	64 Å²	64	57.8 Å²	57.8	34%	0.342	27%	0.27	S	S	.	.			trans	-115.2	80.3	176.8	-167.2	-18.9	0	0	0	111.4	A621 L622 L623 T678	N619-A621 VanDerWaalsContact C-N 3.28Å; N619-A621 PolarHBondContact O-N 3.38Å; N619-A621 PolarHBondContact OD1-N 3.43Å; N619-L622 HydrophobicContact CB-CB 4.19Å; N619-L622 VanDerWaalsContact CG-CB 3.42Å; N619-L622 WeakPolarHBondContact OD1-CB 3.28Å; N619-L622 PolarHBondContact OD1-N 2.84Å; N619-L623 PolarHBondContact O-N 2.72Å; N619-T678 PolarHBondContact N-O 3.35Å
620	P	91.3	Very high	85.8	Confident	16 Å²	16	50.4 Å²	50.4	10%	0.104	23%	0.233	C	C	.	.	H	α-helix	trans	-71.3	-22.3	-179.8	30.9	-36.8	0	0	0	113	Y213 M219 T617 V618 L623 F624 M693	Y213-P620 HydrophobicContact CD2-CB 3.64Å; Y213-P620 HydrophobicContact CD2-CG 3.93Å; Y213-P620 HydrophobicContact CE2-CB 3.98Å; Y213-P620 HydrophobicContact CE2-CG 3.93Å; Y213-P620 HydrophobicContact CG-CB 4.37Å; M219-P620 HydrophobicContact CE-CB 3.69Å; M219-P620 HydrophobicContact SD-CB 4.37Å; T617-P620 HydrophobicContact CG2-CB 4.41Å; V618-P620 VanDerWaalsContact C-CD 3.49Å; V618-P620 VanDerWaalsContact O-CD 3.23Å; V618-P620 WeakPolarHBondContact O-CD 3.37Å; P620-L623 PolarHBondContact O-N 2.86Å; P620-F624 VanDerWaalsContact O-CB 3.31Å; P620-F624 WeakPolarHBondContact O-CB 3.25Å; P620-F624 PolarHBondContact O-N 3.05Å; P620-M693 HydrophobicContact CG-SD 4.49Å
621	A	91.4	Very high	87.2	Confident	39 Å²	39	44.1 Å²	44.1	32%	0.322	21%	0.207	S	C	.	.	H	α-helix	trans	-69.6	-45.7	176	0	0	0	0	0	111.8	Y213 N619 L623 F624 A625	Y213-A621 WeakPolarHBondContact OH-CA 3.45Å; Y213-A621 WeakPolarHBondContact OH-CB 3.16Å; N619-A621 VanDerWaalsContact C-N 3.28Å; N619-A621 PolarHBondContact O-N 3.38Å; N619-A621 PolarHBondContact OD1-N 3.43Å; A621-L623 VanDerWaalsContact C-N 3.34Å; A621-F624 WeakPolarHBondContact O-CB 3.16Å; A621-F624 PolarHBondContact O-N 2.83Å; A621-A625 PolarHBondContact O-N 2.83Å
622	L	94.7	Very high	88.4	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.016	19%	0.188	C	C	.	.	H	α-helix	trans	-63.4	-40.6	172	178.6	62.6	0	0	0	111.4	T559 I560 A563 N619 F624 A625 F626 L677 T678	T559-L622 HydrophobicContact CG2-CD1 4.26Å; I560-L622 HydrophobicContact CB-CD1 4.47Å; I560-L622 HydrophobicContact CG1-CD1 4Å; A563-L622 HydrophobicContact CB-CD1 3.61Å; A563-L622 HydrophobicContact CB-CD2 3.54Å; A563-L622 HydrophobicContact CB-CG 4.21Å; N619-L622 HydrophobicContact CB-CB 4.19Å; N619-L622 VanDerWaalsContact CG-CB 3.42Å; N619-L622 WeakPolarHBondContact OD1-CB 3.28Å; N619-L622 PolarHBondContact OD1-N 2.84Å; L622-F624 VanDerWaalsContact C-N 3.32Å; L622-F624 PolarHBondContact O-N 3.14Å; L622-A625 WeakPolarHBondContact O-CB 3.06Å; L622-A625 PolarHBondContact O-N 3.25Å; L622-F626 HydrophobicContact CD1-CD2 4.2Å; L622-F626 HydrophobicContact CD1-CE2 3.7Å; L622-F626 HydrophobicContact CD2-CE2 4.48Å; L622-F626 HydrophobicContact CG-CD2 4.23Å; L622-F626 HydrophobicContact CG-CE2 3.88Å; L622-F626 VanDerWaalsContact O-CD2 3.25Å; L622-F626 WeakPolarHBondContact O-CD2 3.48Å; L622-F626 PolarHBondContact O-N 2.85Å; L622-L677 HydrophobicContact CD2-CB 3.88Å; L622-T678 HydrophobicContact CB-CG2 4.17Å; L622-T678 HydrophobicContact CD2-CG2 4.1Å; L622-T678 HydrophobicContact CG-CG2 3.97Å
623	L	94.3	Very high	89.4	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-60.1	-44	175.3	-174.8	58.8	0	0	0	111.4	C217 M219 T617 N619 P620 A621 A625 F626 T627 Y674 T678	C217-L623 HydrophobicContact CB-CD2 3.84Å; C217-L623 HydrophobicContact CB-CG 4.07Å; M219-L623 HydrophobicContact SD-CD2 3.74Å; T617-L623 HydrophobicContact CG2-CB 4.45Å; T617-L623 HydrophobicContact CG2-CD2 3.76Å; N619-L623 PolarHBondContact O-N 2.72Å; P620-L623 PolarHBondContact O-N 2.86Å; A621-L623 VanDerWaalsContact C-N 3.34Å; L623-A625 PolarHBondContact O-N 3.38Å; L623-F626 PolarHBondContact O-N 3.41Å; L623-T627 PolarHBondContact O-N 3.13Å; L623-Y674 HydrophobicContact CD1-CD2 3.41Å; L623-Y674 VanDerWaalsContact CD1-CD2 3.41Å; L623-Y674 HydrophobicContact CD1-CE2 3.45Å; L623-Y674 VanDerWaalsContact CD1-CE2 3.45Å; L623-T678 HydrophobicContact CB-CG2 3.67Å; L623-T678 HydrophobicContact CD1-CG2 4.17Å; L623-T678 HydrophobicContact CG-CG2 4.48Å
624	F	94.3	Very high	90.1	Very high	17 Å²	17	27.2 Å²	27.2	8%	0.075	14%	0.143	C	C	.	.	H	α-helix	trans	-60.7	-42.5	175.6	178.9	-116.6	0	0	0	112.2	L164 L212 Y213 T216 C217 P231 P620 A621 L622 F626 T627 Y628	L164-F624 HydrophobicContact CD1-CE1 3.93Å; L164-F624 HydrophobicContact CD1-CZ 4.13Å; L212-F624 HydrophobicContact CD1-CE2 4.36Å; L212-F624 HydrophobicContact CD1-CZ 4.45Å; L212-F624 HydrophobicContact CD2-CE1 4.34Å; L212-F624 HydrophobicContact CD2-CE2 4.27Å; L212-F624 HydrophobicContact CD2-CZ 3.78Å; L212-F624 HydrophobicContact CG-CE2 4.08Å; L212-F624 HydrophobicContact CG-CZ 4.1Å; Y213-F624 HydrophobicContact CD1-CB 3.83Å; Y213-F624 HydrophobicContact CD1-CD1 4.29Å; Y213-F624 HydrophobicContact CD1-CD2 4.05Å; Y213-F624 AromaticContact CD1-CG 3.81Å; Y213-F624 HydrophobicContact CD1-CG 3.81Å; Y213-F624 HydrophobicContact CE1-CB 3.67Å; Y213-F624 AromaticContact CE1-CD1 3.7Å; Y213-F624 HydrophobicContact CE1-CD1 3.7Å; Y213-F624 HydrophobicContact CE1-CD2 4.29Å; Y213-F624 HydrophobicContact CE1-CE1 4.37Å; Y213-F624 AromaticContact CE1-CG 3.64Å; Y213-F624 HydrophobicContact CE1-CG 3.64Å; T216-F624 HydrophobicContact CG2-CE2 4.16Å; T216-F624 VanDerWaalsContact OG1-CD2 3.3Å; T216-F624 WeakPolarHBondContact OG1-CD2 3.46Å; C217-F624 WeakPolarHBondContact SG-CA 3.43Å; P231-F624 HydrophobicContact CB-CE2 3.75Å; P231-F624 HydrophobicContact CB-CZ 3.96Å; P231-F624 HydrophobicContact CG-CD2 4.41Å; P231-F624 HydrophobicContact CG-CE2 3.78Å; P231-F624 HydrophobicContact CG-CZ 4.37Å; P620-F624 VanDerWaalsContact O-CB 3.31Å; P620-F624 WeakPolarHBondContact O-CB 3.25Å; P620-F624 PolarHBondContact O-N 3.05Å; A621-F624 WeakPolarHBondContact O-CB 3.16Å; A621-F624 PolarHBondContact O-N 2.83Å; L622-F624 VanDerWaalsContact C-N 3.32Å; L622-F624 PolarHBondContact O-N 3.14Å; F624-F626 VanDerWaalsContact C-N 3.33Å; F624-F626 PolarHBondContact O-N 2.99Å; F624-T627 WeakPolarHBondContact O-CB 3.33Å; F624-T627 PolarHBondContact O-N 3.41Å; F624-T627 PolarHBondContact O-OG1 3.11Å; F624-Y628 HydrophobicContact CD1-CE2 4.18Å; F624-Y628 AromaticContact CE1-CE2 3.67Å; F624-Y628 HydrophobicContact CE1-CE2 3.67Å; F624-Y628 HydrophobicContact CE2-CE2 4.25Å; F624-Y628 AromaticContact CZ-CE2 3.71Å; F624-Y628 HydrophobicContact CZ-CE2 3.71Å; F624-Y628 AromaticContact CZ-CZ 3.99Å; F624-Y628 WeakPolarHBondContact CZ-OH 3.35Å
625	A	95.7	Very high	90.7	Very high	3 Å²	3	26 Å²	26	3%	0.025	14%	0.141	C	C	.	.	H	α-helix	trans	-56.5	-43.1	176.4	0	0	0	0	0	112.7	A556 T559 I560 A621 L622 L623 T627 Y628	A556-A625 HydrophobicContact CB-CB 3.87Å; T559-A625 HydrophobicContact CG2-CB 4.08Å; I560-A625 HydrophobicContact CD1-CB 4.16Å; I560-A625 HydrophobicContact CG1-CB 3.93Å; A621-A625 PolarHBondContact O-N 2.83Å; L622-A625 WeakPolarHBondContact O-CB 3.06Å; L622-A625 PolarHBondContact O-N 3.25Å; L623-A625 PolarHBondContact O-N 3.38Å; A625-T627 PolarHBondContact O-N 2.73Å; A625-Y628 PolarHBondContact O-N 3.41Å
626	F	95.5	Very high	91.2	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63	-27.4	175.4	-77.8	-74.9	0	0	0	113.5	I560 L622 L623 F624 Y628 F629 D630 I637 V672 Y674 L677	I560-F626 HydrophobicContact CB-CZ 4.42Å; I560-F626 HydrophobicContact CD1-CD1 3.78Å; I560-F626 HydrophobicContact CD1-CD2 4.43Å; I560-F626 HydrophobicContact CD1-CE1 3.96Å; I560-F626 HydrophobicContact CD1-CG 4.04Å; I560-F626 HydrophobicContact CD1-CZ 4.36Å; I560-F626 HydrophobicContact CG1-CD1 4.25Å; I560-F626 HydrophobicContact CG1-CD2 4.19Å; I560-F626 HydrophobicContact CG1-CE1 4.09Å; I560-F626 HydrophobicContact CG1-CE2 4.03Å; I560-F626 HydrophobicContact CG1-CG 4.3Å; I560-F626 HydrophobicContact CG1-CZ 3.98Å; I560-F626 HydrophobicContact CG2-CE1 3.8Å; I560-F626 HydrophobicContact CG2-CE2 4.38Å; I560-F626 HydrophobicContact CG2-CZ 3.61Å; L622-F626 HydrophobicContact CD1-CD2 4.2Å; L622-F626 HydrophobicContact CD1-CE2 3.7Å; L622-F626 HydrophobicContact CD2-CE2 4.48Å; L622-F626 HydrophobicContact CG-CD2 4.23Å; L622-F626 HydrophobicContact CG-CE2 3.88Å; L622-F626 VanDerWaalsContact O-CD2 3.25Å; L622-F626 WeakPolarHBondContact O-CD2 3.48Å; L622-F626 PolarHBondContact O-N 2.85Å; L623-F626 PolarHBondContact O-N 3.41Å; F624-F626 VanDerWaalsContact C-N 3.33Å; F624-F626 PolarHBondContact O-N 2.99Å; F626-Y628 VanDerWaalsContact C-N 3.27Å; F626-Y628 PolarHBondContact O-N 3.2Å; F626-F629 PolarHBondContact O-N 2.92Å; F626-D630 PolarHBondContact O-N 3.34Å; F626-D630 VanDerWaalsContact O-N 3.15Å; F626-I637 HydrophobicContact CD1-CD1 3.82Å; F626-I637 HydrophobicContact CD1-CG1 4.34Å; F626-I637 HydrophobicContact CE1-CD1 4.41Å; F626-V672 HydrophobicContact CZ-CG1 4.5Å; F626-Y674 HydrophobicContact CB-CD1 3.65Å; F626-Y674 HydrophobicContact CB-CD2 4.5Å; F626-Y674 HydrophobicContact CB-CE1 4.01Å; F626-Y674 HydrophobicContact CB-CG 3.91Å; F626-Y674 AromaticContact CD1-CD1 3.82Å; F626-Y674 HydrophobicContact CD1-CD1 3.82Å; F626-Y674 HydrophobicContact CD1-CG 4.23Å; F626-Y674 HydrophobicContact CD2-CD1 4.31Å; F626-Y674 AromaticContact CD2-CG 3.92Å; F626-Y674 HydrophobicContact CD2-CG 3.92Å; F626-Y674 VanDerWaalsContact CE2-CB 3.43Å; F626-Y674 AromaticContact CG-CD1 3.68Å; F626-Y674 HydrophobicContact CG-CD1 3.68Å; F626-Y674 AromaticContact CG-CG 3.77Å; F626-Y674 HydrophobicContact CG-CG 3.77Å; F626-L677 HydrophobicContact CE2-CD1 4.44Å; F626-L677 HydrophobicContact CZ-CD1 4.24Å
627	T	93.1	Very high	91.7	Very high	6 Å²	6	22.7 Å²	22.7	4%	0.037	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-11.9	-179.3	69.8	0	0	0	0	115.3	P231 L623 F624 A625 F629	P231-T627 WeakPolarHBondContact CG-OG1 3.46Å; L623-T627 PolarHBondContact O-N 3.13Å; F624-T627 WeakPolarHBondContact O-CB 3.33Å; F624-T627 PolarHBondContact O-N 3.41Å; F624-T627 PolarHBondContact O-OG1 3.11Å; A625-T627 PolarHBondContact O-N 2.73Å; T627-F629 VanDerWaalsContact C-N 3.29Å
628	Y	93.1	Very high	92	Very high	12 Å²	12	28.4 Å²	28.4	5%	0.047	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-23.1	170.6	-80.3	-88	0	0	0	113	P231 L552 Q553 A556 F624 A625 F626	P231-Y628 HydrophobicContact CB-CD1 4.41Å; P231-Y628 HydrophobicContact CB-CE1 3.78Å; P231-Y628 HydrophobicContact CB-CE2 3.95Å; P231-Y628 HydrophobicContact CG-CD1 4.46Å; P231-Y628 HydrophobicContact CG-CD2 4.2Å; P231-Y628 HydrophobicContact CG-CE1 4.28Å; P231-Y628 HydrophobicContact CG-CE2 4.01Å; P231-Y628 HydrophobicContact CG-CG 4.42Å; L552-Y628 HydrophobicContact CB-CE1 3.87Å; L552-Y628 HydrophobicContact CD1-CE1 4.44Å; Q553-Y628 HydrophobicContact CG-CD1 4.39Å; A556-Y628 HydrophobicContact CB-CD2 3.85Å; A556-Y628 HydrophobicContact CB-CG 4.26Å; F624-Y628 HydrophobicContact CD1-CE2 4.18Å; F624-Y628 AromaticContact CE1-CE2 3.67Å; F624-Y628 HydrophobicContact CE1-CE2 3.67Å; F624-Y628 HydrophobicContact CE2-CE2 4.25Å; F624-Y628 AromaticContact CZ-CE2 3.71Å; F624-Y628 HydrophobicContact CZ-CE2 3.71Å; F624-Y628 AromaticContact CZ-CZ 3.99Å; F624-Y628 WeakPolarHBondContact CZ-OH 3.35Å; A625-Y628 PolarHBondContact O-N 3.41Å; F626-Y628 VanDerWaalsContact C-N 3.27Å; F626-Y628 PolarHBondContact O-N 3.2Å
629	F	95.1	Very high	92.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-43.2	-174.4	-57	-70.2	0	0	0	112.2	V115 K116 P118 Q553 A556 A557 I560 F626 T627 M631 I637 I645	V115-F629 WeakPolarHBondContact CA-O 3.42Å; V115-F629 HydrophobicContact CG1-CB 4.31Å; K116-F629 PolarHBondContact N-O 3.46Å; P118-F629 HydrophobicContact CG-CE1 4.49Å; Q553-F629 HydrophobicContact CB-CE1 4.41Å; Q553-F629 HydrophobicContact CB-CZ 4.33Å; Q553-F629 WeakPolarHBondContact O-CZ 3.4Å; A556-F629 HydrophobicContact CB-CE2 4Å; A556-F629 HydrophobicContact CB-CZ 4.48Å; A557-F629 HydrophobicContact CB-CE2 4.35Å; A557-F629 HydrophobicContact CB-CZ 3.97Å; I560-F629 HydrophobicContact CD1-CD2 4.02Å; I560-F629 HydrophobicContact CD1-CE2 3.97Å; F626-F629 PolarHBondContact O-N 2.92Å; T627-F629 VanDerWaalsContact C-N 3.29Å; F629-M631 VanDerWaalsContact C-N 3.33Å; F629-M631 PolarHBondContact O-N 3.15Å; F629-I637 HydrophobicContact CB-CD1 3.73Å; F629-I645 HydrophobicContact CB-CD1 3.93Å; F629-I645 HydrophobicContact CD1-CD1 3.7Å; F629-I645 HydrophobicContact CD1-CG1 4.02Å; F629-I645 HydrophobicContact CD1-CG2 4.01Å; F629-I645 HydrophobicContact CD2-CG2 4.41Å; F629-I645 HydrophobicContact CE1-CD1 4.39Å; F629-I645 HydrophobicContact CE1-CG1 4.29Å; F629-I645 HydrophobicContact CE1-CG2 3.61Å; F629-I645 HydrophobicContact CE2-CG2 4.04Å; F629-I645 HydrophobicContact CG-CD1 3.8Å; F629-I645 HydrophobicContact CG-CG2 4.4Å; F629-I645 HydrophobicContact CZ-CG2 3.62Å
630	D	93.3	Very high	92.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.143	C	C	.	.			trans	-79.5	75	178.4	-174.2	4.8	0	0	0	112.3	F626 S632 R633 A634 G635 Y674	F626-D630 PolarHBondContact O-N 3.34Å; F626-D630 VanDerWaalsContact O-N 3.15Å; D630-S632 PolarHBondContact O-N 3.44Å; D630-S632 PolarHBondContact OD1-N 2.93Å; D630-S632 PolarHBondContact OD1-OG 2.97Å; D630-R633 VanDerWaalsContact CG-CA 3.49Å; D630-R633 PolarHBondContact O-N 2.84Å; D630-R633 WeakPolarHBondContact OD1-CA 3.44Å; D630-R633 PolarHBondContact OD1-N 3.07Å; D630-R633 VanDerWaalsContact OD2-CA 3.32Å; D630-R633 WeakPolarHBondContact OD2-CA 3.44Å; D630-A634 VanDerWaalsContact CG-N 3.3Å; D630-A634 PolarHBondContact OD1-N 2.98Å; D630-A634 PolarHBondContact OD2-N 3.09Å; D630-G635 PolarHBondContact OD2-N 2.97Å; D630-Y674 HydrophobicContact CB-CE1 4.31Å; D630-Y674 PolarHBondContact OD2-OH 2.87Å
631	M	88.3	Confident	92.8	Very high	65 Å²	65	28.7 Å²	28.7	32%	0.32	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-35.6	173.8	-60.4	-65.1	-69.3	0	0	111.8	E114 K116 L230 F629 R633	E114-M631 HydrophobicContact CG-CB 4.48Å; E114-M631 WeakPolarHBondContact O-CB 3.38Å; E114-M631 PolarHBondContact O-N 3Å; E114-M631 VanDerWaalsContact O-N 3.16Å; K116-M631 HydrophobicContact CB-CG 3.81Å; K116-M631 HydrophobicContact CB-SD 4.28Å; K116-M631 HydrophobicContact CD-SD 4.5Å; L230-M631 HydrophobicContact CD1-CE 3.68Å; L230-M631 HydrophobicContact CD1-SD 4.28Å; F629-M631 VanDerWaalsContact C-N 3.33Å; F629-M631 PolarHBondContact O-N 3.15Å; M631-R633 VanDerWaalsContact C-N 3.33Å; M631-R633 PolarHBondContact O-N 3Å
632	S	86.8	Confident	93	Very high	14 Å²	14	26.9 Å²	26.9	10%	0.098	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-19.4	179.4	56.2	0	0	0	0	115.4	S111 R112 E114 D630 A634	S111-S632 VanDerWaalsContact CB-O 3.28Å; S111-S632 WeakPolarHBondContact CB-O 3.49Å; S111-S632 PolarHBondContact OG-O 3.29Å; R112-S632 WeakPolarHBondContact O-CB 3.47Å; E114-S632 PolarHBondContact N-OG 3.48Å; E114-S632 PolarHBondContact O-N 3.41Å; E114-S632 VanDerWaalsContact O-N 3.1Å; E114-S632 PolarHBondContact O-OG 2.58Å; D630-S632 PolarHBondContact O-N 3.44Å; D630-S632 PolarHBondContact OD1-N 2.93Å; D630-S632 PolarHBondContact OD1-OG 2.97Å; S632-A634 VanDerWaalsContact C-N 3.28Å; S632-A634 PolarHBondContact O-N 3.07Å; S632-A634 WeakPolarHBondContact OG-CB 3.34Å
633	R	86.4	Confident	93.1	Very high	43 Å²	43	26.9 Å²	26.9	16%	0.162	13%	0.129	C	C	.	.			trans	47	50.4	-163.8	-62.7	-176.5	169.9	133.6	-19.4	112.6	T216 R218 K228 V229 D630 M631 G635	T216-R633 PolarHBondContact O-NH2 2.99Å; R218-R633 PolarHBondContact NH1-O 2.87Å; K228-R633 PolarHBondContact O-NH1 3.03Å; K228-R633 PolarHBondContact O-NH2 3.21Å; V229-R633 PolarHBondContact O-NH2 3.16Å; D630-R633 VanDerWaalsContact CG-CA 3.49Å; D630-R633 PolarHBondContact O-N 2.84Å; D630-R633 WeakPolarHBondContact OD1-CA 3.44Å; D630-R633 PolarHBondContact OD1-N 3.07Å; D630-R633 VanDerWaalsContact OD2-CA 3.32Å; D630-R633 WeakPolarHBondContact OD2-CA 3.44Å; M631-R633 VanDerWaalsContact C-N 3.33Å; M631-R633 PolarHBondContact O-N 3Å; R633-G635 VanDerWaalsContact C-N 3.25Å
634	A	87.9	Confident	93.1	Very high	31 Å²	31	30.1 Å²	30.1	26%	0.256	14%	0.144	S	C	.	.			trans	-68	-22.1	174.4	0	0	0	0	0	113.1	Y113 D630 S632 Y636	Y113-A634 HydrophobicContact CD2-CB 4.29Å; D630-A634 VanDerWaalsContact CG-N 3.3Å; D630-A634 PolarHBondContact OD1-N 2.98Å; D630-A634 PolarHBondContact OD2-N 3.09Å; S632-A634 VanDerWaalsContact C-N 3.28Å; S632-A634 PolarHBondContact O-N 3.07Å; S632-A634 WeakPolarHBondContact OG-CB 3.34Å; A634-Y636 HydrophobicContact CB-CD1 3.96Å; A634-Y636 HydrophobicContact CB-CE1 3.71Å; A634-Y636 WeakPolarHBondContact O-CD1 3.48Å
635	G	89.7	Confident	93.3	Very high	16 Å²	16	29.3 Å²	29.3	17%	0.165	14%	0.141	C	C	.	.	S	Bend	trans	92.3	1.2	-176.8	0	0	0	0	0	113.8	D630 R633 Y674	D630-G635 PolarHBondContact OD2-N 2.97Å; R633-G635 VanDerWaalsContact C-N 3.25Å; G635-Y674 VanDerWaalsContact CA-CZ 3.42Å; G635-Y674 WeakPolarHBondContact CA-OH 3.31Å; G635-Y674 PolarHBondContact N-OH 2.86Å; G635-Y674 PolarHBondContact O-N 2.91Å
636	Y	93.3	Very high	93.3	Very high	75 Å²	75	29.2 Å²	29.2	29%	0.294	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	156.8	-176.2	67.5	-90.1	0	0	0	112.3	Y113 A634 H671 V672	Y113-Y636 HydrophobicContact CD2-CD2 4.11Å; Y113-Y636 AromaticContact CD2-CE2 3.38Å; Y113-Y636 HydrophobicContact CD2-CE2 3.38Å; Y113-Y636 AromaticContact CD2-CZ 3.71Å; Y113-Y636 AromaticContact CE2-CD2 3.87Å; Y113-Y636 HydrophobicContact CE2-CD2 3.87Å; Y113-Y636 AromaticContact CE2-CE2 3.53Å; Y113-Y636 HydrophobicContact CE2-CE2 3.53Å; Y113-Y636 HydrophobicContact CG-CE2 4.45Å; A634-Y636 HydrophobicContact CB-CD1 3.96Å; A634-Y636 HydrophobicContact CB-CE1 3.71Å; A634-Y636 WeakPolarHBondContact O-CD1 3.48Å; Y636-H671 HydrophobicContact CD2-CB 3.7Å; Y636-H671 AromaticContact CD2-CG 3.88Å; Y636-H671 HydrophobicContact CE2-CB 4.42Å; Y636-H671 HydrophobicContact CG-CB 4.35Å; Y636-H671 AromaticContact CG-CD2 3.84Å; Y636-V672 WeakPolarHBondContact CA-O 3.44Å; Y636-V672 WeakPolarHBondContact CB-O 3.21Å
637	I	95.3	Very high	93.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	139.8	166.5	-54.2	-175.4	0	0	0	108.3	V115 F626 F629 D641 L642 H671 V672	V115-I637 HydrophobicContact CG1-CG2 4.38Å; V115-I637 HydrophobicContact CG2-CG1 4.43Å; V115-I637 HydrophobicContact CG2-CG2 4.41Å; F626-I637 HydrophobicContact CD1-CD1 3.82Å; F626-I637 HydrophobicContact CD1-CG1 4.34Å; F626-I637 HydrophobicContact CE1-CD1 4.41Å; F629-I637 HydrophobicContact CB-CD1 3.73Å; I637-D641 HydrophobicContact CG2-CB 4.12Å; I637-L642 HydrophobicContact CB-CB 4.44Å; I637-L642 HydrophobicContact CG2-CB 3.85Å; I637-H671 CarbonylContact O-C 3.56Å; I637-H671 WeakPolarHBondContact O-CA 3.38Å; I637-H671 WeakPolarHBondContact O-CB 3.46Å; I637-V672 PolarHBondContact N-O 3.28Å; I637-V672 VanDerWaalsContact N-O 3.08Å; I637-V672 PolarHBondContact O-N 2.8Å
638	R	94.9	Very high	93.4	Very high	122 Å²	122	32.8 Å²	32.8	46%	0.46	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	148.6	175.6	-63.2	172.9	-154.7	-165.5	8	110.6	Y113 H640 D641 L642 D670	Y113-R638 HydrophobicContact CE1-CG 4.19Å; Y113-R638 HydrophobicContact CE2-CG 4Å; Y113-R638 WeakPolarHBondContact OH-CG 3.33Å; Y113-R638 PolarHBondContact OH-N 2.94Å; R638-H640 PolarHBondContact O-N 3.34Å; R638-D641 HydrophobicContact CB-CB 4.5Å; R638-D641 IonicContact NE-OD2 3.33Å; R638-D641 PolarHBondContact O-N 2.71Å; R638-L642 WeakPolarHBondContact O-CB 3.11Å; R638-L642 PolarHBondContact O-N 2.99Å; R638-D670 WeakPolarHBondContact CA-O 3.14Å
639	E	94.7	Very high	93.5	Very high	42 Å²	42	32.3 Å²	32.3	20%	0.196	16%	0.155	C	C	.	.	H	α-helix	trans	-54.9	-42.5	177.2	175.4	178.5	140.5	0	0	111.7	C643 V662 D670	E639-C643 VanDerWaalsContact O-CB 3.31Å; E639-C643 WeakPolarHBondContact O-CB 3.47Å; E639-C643 PolarHBondContact O-N 2.98Å; E639-C643 PolarHBondContact O-SG 3.32Å; E639-V662 HydrophobicContact CB-CG1 4.3Å; E639-V662 HydrophobicContact CG-CB 4.31Å; E639-V662 HydrophobicContact CG-CG1 3.83Å; E639-D670 PolarHBondContact N-O 2.59Å
640	H	94.4	Very high	93.4	Very high	89 Å²	89	33.5 Å²	33.5	41%	0.412	17%	0.167	S	C	.	.	H	α-helix	trans	-56.2	-55.5	178.6	-178.9	-85.6	0	0	0	112.1	R638 C643 E644 R655	R638-H640 PolarHBondContact O-N 3.34Å; H640-C643 WeakPolarHBondContact O-CB 3.22Å; H640-C643 PolarHBondContact O-N 2.87Å; H640-E644 IonicContact CE1-OE1 3.69Å; H640-E644 PolarHBondContact CE1-OE1 2.95Å; H640-E644 IonicContact CE1-OE2 3.3Å; H640-E644 PolarHBondContact CE1-OE2 3.1Å; H640-E644 IonicContact ND1-OE2 2.71Å; H640-E644 IonicContact NE2-OE1 2.67Å; H640-E644 PolarHBondContact NE2-OE1 3.31Å; H640-E644 PolarHBondContact O-N 2.92Å; H640-R655 PolarHBondContact NE2-NH2 2.72Å; H640-R655 VanDerWaalsContact NE2-NH2 3.18Å
641	D	95.9	Very high	93.3	Very high	24 Å²	24	33.8 Å²	33.8	13%	0.128	17%	0.168	C	C	.	.	H	α-helix	trans	-70.7	-37.7	-172	-51.2	-12	0	0	0	110.6	Y113 I117 I637 R638 E644 I645	Y113-D641 VanDerWaalsContact CE1-OD2 3.23Å; Y113-D641 WeakPolarHBondContact CE1-OD2 3.27Å; Y113-D641 VanDerWaalsContact CZ-OD2 3.3Å; Y113-D641 PolarHBondContact OH-OD2 3.13Å; I117-D641 HydrophobicContact CD1-CB 3.88Å; I637-D641 HydrophobicContact CG2-CB 4.12Å; R638-D641 HydrophobicContact CB-CB 4.5Å; R638-D641 IonicContact NE-OD2 3.33Å; R638-D641 PolarHBondContact O-N 2.71Å; D641-E644 PolarHBondContact O-N 3.46Å; D641-I645 WeakPolarHBondContact O-CG1 3.45Å; D641-I645 PolarHBondContact O-N 2.84Å
642	L	96.3	Very high	93.5	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66.8	-39.8	172.9	-178.8	57	0	0	0	112	I560 I564 I637 R638 E644 I645 L646 V662 V672	I560-L642 HydrophobicContact CG2-CD1 3.93Å; I564-L642 HydrophobicContact CD1-CD2 3.89Å; I637-L642 HydrophobicContact CB-CB 4.44Å; I637-L642 HydrophobicContact CG2-CB 3.85Å; R638-L642 WeakPolarHBondContact O-CB 3.11Å; R638-L642 PolarHBondContact O-N 2.99Å; L642-E644 VanDerWaalsContact C-N 3.27Å; L642-E644 PolarHBondContact O-N 2.98Å; L642-I645 PolarHBondContact O-N 3.34Å; L642-L646 HydrophobicContact CD1-CD1 4.03Å; L642-L646 HydrophobicContact CD1-CD2 4.48Å; L642-L646 HydrophobicContact CD1-CG 4Å; L642-L646 HydrophobicContact CG-CD1 4.02Å; L642-L646 HydrophobicContact CG-CG 4.41Å; L642-L646 WeakPolarHBondContact O-CB 3.23Å; L642-L646 VanDerWaalsContact O-CG 3.24Å; L642-L646 WeakPolarHBondContact O-CG 3.42Å; L642-L646 PolarHBondContact O-N 2.85Å; L642-V662 HydrophobicContact CD2-CG1 3.91Å; L642-V662 HydrophobicContact CG-CG1 4.38Å; L642-V662 HydrophobicContact CG-CG2 4.43Å; L642-V672 HydrophobicContact CD2-CB 3.99Å; L642-V672 HydrophobicContact CD2-CG1 4.44Å; L642-V672 HydrophobicContact CD2-CG2 3.59Å
643	C	96.3	Very high	93.8	Very high	4 Å²	4	40.3 Å²	40.3	3%	0.027	19%	0.188	C	C	.	.	H	α-helix	trans	-57.6	-43.3	171.6	-76.7	0	0	0	0	110.8	E639 H640 L646 H647 M658	E639-C643 VanDerWaalsContact O-CB 3.31Å; E639-C643 WeakPolarHBondContact O-CB 3.47Å; E639-C643 PolarHBondContact O-N 2.98Å; E639-C643 PolarHBondContact O-SG 3.32Å; H640-C643 WeakPolarHBondContact O-CB 3.22Å; H640-C643 PolarHBondContact O-N 2.87Å; C643-L646 PolarHBondContact O-N 2.95Å; C643-H647 PolarHBondContact O-N 3.41Å; C643-H647 PolarHBondContact O-ND1 2.95Å; C643-M658 HydrophobicContact CB-CG 4.25Å
644	E	95.9	Very high	94.2	Very high	69 Å²	69	40.9 Å²	40.9	32%	0.322	20%	0.198	S	C	.	.	H	α-helix	trans	-65.1	-48.7	179.7	-70.6	-176.3	162.9	0	0	111.8	I117 H640 D641 L642 L646 H647 L648 R655	I117-E644 HydrophobicContact CD1-CB 4.42Å; I117-E644 HydrophobicContact CG2-CB 4.4Å; H640-E644 IonicContact CE1-OE1 3.69Å; H640-E644 PolarHBondContact CE1-OE1 2.95Å; H640-E644 IonicContact CE1-OE2 3.3Å; H640-E644 PolarHBondContact CE1-OE2 3.1Å; H640-E644 IonicContact ND1-OE2 2.71Å; H640-E644 IonicContact NE2-OE1 2.67Å; H640-E644 PolarHBondContact NE2-OE1 3.31Å; H640-E644 PolarHBondContact O-N 2.92Å; D641-E644 PolarHBondContact O-N 3.46Å; L642-E644 VanDerWaalsContact C-N 3.27Å; L642-E644 PolarHBondContact O-N 2.98Å; E644-L646 VanDerWaalsContact C-N 3.29Å; E644-L646 PolarHBondContact O-N 2.84Å; E644-H647 PolarHBondContact O-N 3.16Å; E644-H647 VanDerWaalsContact O-N 3.09Å; E644-L648 WeakPolarHBondContact O-CG 3.4Å; E644-R655 IonicContact OE1-NH2 2.83Å; E644-R655 PolarHBondContact OE1-NH2 3.21Å
645	I	96.8	Very high	94.5	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-51.5	-46.6	173.7	-68.9	160.5	0	0	0	111.5	V115 I117 A557 F629 D641 L642 H647 L648	V115-I645 HydrophobicContact CG1-CD1 4.04Å; I117-I645 HydrophobicContact CG1-CD1 4.46Å; I117-I645 HydrophobicContact CG1-CG1 4.25Å; I117-I645 HydrophobicContact CG2-CG1 4.15Å; A557-I645 HydrophobicContact CB-CG2 4.02Å; F629-I645 HydrophobicContact CB-CD1 3.93Å; F629-I645 HydrophobicContact CD1-CD1 3.7Å; F629-I645 HydrophobicContact CD1-CG1 4.02Å; F629-I645 HydrophobicContact CD1-CG2 4.01Å; F629-I645 HydrophobicContact CD2-CG2 4.41Å; F629-I645 HydrophobicContact CE1-CD1 4.39Å; F629-I645 HydrophobicContact CE1-CG1 4.29Å; F629-I645 HydrophobicContact CE1-CG2 3.61Å; F629-I645 HydrophobicContact CE2-CG2 4.04Å; F629-I645 HydrophobicContact CG-CD1 3.8Å; F629-I645 HydrophobicContact CG-CG2 4.4Å; F629-I645 HydrophobicContact CZ-CG2 3.62Å; D641-I645 WeakPolarHBondContact O-CG1 3.45Å; D641-I645 PolarHBondContact O-N 2.84Å; L642-I645 PolarHBondContact O-N 3.34Å; I645-H647 VanDerWaalsContact C-N 3.34Å; I645-H647 PolarHBondContact O-N 3.02Å; I645-L648 WeakPolarHBondContact O-CB 3.39Å; I645-L648 PolarHBondContact O-N 3.07Å
646	L	96.7	Very high	94.8	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-72.1	-21	-177.3	-65	175.2	0	0	0	114	A557 I560 F561 I564 L642 C643 E644 L648 L649 M658 V662	A557-L646 VanDerWaalsContact O-CD2 3.29Å; A557-L646 WeakPolarHBondContact O-CD2 3.28Å; I560-L646 HydrophobicContact CG2-CD2 4.38Å; F561-L646 HydrophobicContact CB-CD2 3.97Å; I564-L646 HydrophobicContact CD1-CD1 4.13Å; L642-L646 HydrophobicContact CD1-CD1 4.03Å; L642-L646 HydrophobicContact CD1-CD2 4.48Å; L642-L646 HydrophobicContact CD1-CG 4Å; L642-L646 HydrophobicContact CG-CD1 4.02Å; L642-L646 HydrophobicContact CG-CG 4.41Å; L642-L646 WeakPolarHBondContact O-CB 3.23Å; L642-L646 VanDerWaalsContact O-CG 3.24Å; L642-L646 WeakPolarHBondContact O-CG 3.42Å; L642-L646 PolarHBondContact O-N 2.85Å; C643-L646 PolarHBondContact O-N 2.95Å; E644-L646 VanDerWaalsContact C-N 3.29Å; E644-L646 PolarHBondContact O-N 2.84Å; L646-L648 VanDerWaalsContact C-N 3.32Å; L646-L649 HydrophobicContact CD2-CD1 4.24Å; L646-M658 HydrophobicContact CB-CE 3.69Å; L646-M658 HydrophobicContact CB-CG 4.29Å; L646-M658 HydrophobicContact CB-SD 3.55Å; L646-M658 VanDerWaalsContact CB-SD 3.55Å; L646-M658 HydrophobicContact CD1-SD 3.9Å; L646-M658 HydrophobicContact CG-SD 4.39Å; L646-M658 WeakPolarHBondContact O-CE 3.34Å; L646-V662 HydrophobicContact CD1-CG2 3.8Å
647	H	95.5	Very high	94.8	Very high	57 Å²	57	48.1 Å²	48.1	26%	0.264	23%	0.227	S	C	.	.	H	α-helix	trans	-72.3	-25.9	171.2	-75.8	82.7	0	0	0	112.2	C643 E644 I645 L649 G650 R655 M658	C643-H647 PolarHBondContact O-N 3.41Å; C643-H647 PolarHBondContact O-ND1 2.95Å; E644-H647 PolarHBondContact O-N 3.16Å; E644-H647 VanDerWaalsContact O-N 3.09Å; I645-H647 VanDerWaalsContact C-N 3.34Å; I645-H647 PolarHBondContact O-N 3.02Å; H647-L649 PolarHBondContact O-N 3.23Å; H647-G650 PolarHBondContact O-N 2.88Å; H647-R655 WeakPolarHBondContact NE2-CA 3.37Å; H647-R655 PolarHBondContact NE2-N 3.35Å; H647-M658 VanDerWaalsContact CE1-CB 3.41Å; H647-M658 WeakPolarHBondContact CE1-CB 3.3Å
648	L	95.5	Very high	94.8	Very high	25 Å²	25	48.2 Å²	48.2	13%	0.131	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-17.5	-177.4	-52.4	-174.9	0	0	0	113.6	I117 P118 L121 F122 E644 I645 L646 G650	I117-L648 HydrophobicContact CG2-CD1 4.38Å; P118-L648 HydrophobicContact CB-CD1 3.79Å; P118-L648 HydrophobicContact CG-CD1 4.08Å; P118-L648 WeakPolarHBondContact O-CD1 3.48Å; L121-L648 WeakPolarHBondContact CA-O 3.46Å; F122-L648 HydrophobicContact CD2-CB 3.84Å; F122-L648 WeakPolarHBondContact CD2-O 3.36Å; F122-L648 HydrophobicContact CE2-CB 3.59Å; F122-L648 HydrophobicContact CE2-CD1 4.48Å; F122-L648 HydrophobicContact CZ-CB 4.15Å; F122-L648 HydrophobicContact CZ-CD1 4.24Å; F122-L648 PolarHBondContact N-O 2.77Å; E644-L648 WeakPolarHBondContact O-CG 3.4Å; I645-L648 WeakPolarHBondContact O-CB 3.39Å; I645-L648 PolarHBondContact O-N 3.07Å; L646-L648 VanDerWaalsContact C-N 3.32Å; L648-G650 PolarHBondContact O-N 3.07Å
649	L	95.2	Very high	94.8	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.01	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-22.8	170.8	-64.6	171.2	0	0	0	113.2	F122 N123 M158 R554 A557 F558 F561 L646 H647 L651	F122-L649 HydrophobicContact CD2-CD2 4.19Å; F122-L649 HydrophobicContact CE2-CD2 4.44Å; N123-L649 PolarHBondContact ND2-O 2.86Å; M158-L649 HydrophobicContact SD-CB 4.39Å; M158-L649 HydrophobicContact SD-CD2 3.98Å; R554-L649 HydrophobicContact CG-CD2 4.03Å; R554-L649 WeakPolarHBondContact O-CD2 3.5Å; A557-L649 HydrophobicContact CB-CD1 4.34Å; A557-L649 HydrophobicContact CB-CD2 3.78Å; A557-L649 HydrophobicContact CB-CG 4.12Å; F558-L649 HydrophobicContact CB-CD2 4.02Å; F558-L649 HydrophobicContact CD2-CD1 4.47Å; F561-L649 HydrophobicContact CB-CD1 3.91Å; F561-L649 HydrophobicContact CG-CD1 4.34Å; L646-L649 HydrophobicContact CD2-CD1 4.24Å; H647-L649 PolarHBondContact O-N 3.23Å; L649-L651 VanDerWaalsContact C-N 3.34Å; L649-L651 HydrophobicContact CB-CD1 4.02Å; L649-L651 HydrophobicContact CB-CG 3.85Å; L649-L651 HydrophobicContact CD1-CD1 3.85Å; L649-L651 PolarHBondContact O-N 2.72Å
650	G	92.4	Very high	94.8	Very high	25 Å²	25	53.1 Å²	53.1	26%	0.258	25%	0.248	S	C	.	.			trans	80	8.2	178.5	0	0	0	0	0	115.4	H647 L648 R652	H647-G650 PolarHBondContact O-N 2.88Å; L648-G650 PolarHBondContact O-N 3.07Å; G650-R652 PolarHBondContact O-N 2.94Å
651	L	92.1	Very high	94.7	Very high	5 Å²	5	49.9 Å²	49.9	3%	0.026	23%	0.234	C	C	.	.			trans	-62.7	10.5	-176.7	-63.4	174.6	0	0	0	116.1	M158 F558 F561 L649 Y653 A708 N711	M158-L651 HydrophobicContact CE-CD2 3.78Å; F558-L651 HydrophobicContact CD2-CD1 4.46Å; F561-L651 HydrophobicContact CD1-CD1 3.84Å; F561-L651 HydrophobicContact CD2-CD1 4.12Å; F561-L651 HydrophobicContact CE1-CD1 3.79Å; F561-L651 HydrophobicContact CE2-CD1 4.07Å; F561-L651 HydrophobicContact CG-CD1 4.02Å; F561-L651 HydrophobicContact CZ-CD1 3.92Å; L649-L651 VanDerWaalsContact C-N 3.34Å; L649-L651 HydrophobicContact CB-CD1 4.02Å; L649-L651 HydrophobicContact CB-CG 3.85Å; L649-L651 HydrophobicContact CD1-CD1 3.85Å; L649-L651 PolarHBondContact O-N 2.72Å; L651-Y653 HydrophobicContact CB-CD2 3.67Å; L651-Y653 HydrophobicContact CB-CE2 3.85Å; L651-Y653 HydrophobicContact CD1-CE2 4.35Å; L651-Y653 PolarHBondContact O-N 3.43Å; L651-A708 WeakPolarHBondContact CD2-O 3.16Å; L651-N711 PolarHBondContact O-N 3.3Å
652	R	91.3	Very high	94.7	Very high	174 Å²	174	48.7 Å²	48.7	66%	0.657	23%	0.228	S	C	*	.			trans	54.5	19.2	177.7	-54.4	-60.3	-169.6	166.5	3	116.2	G650 N711 R712	G650-R652 PolarHBondContact O-N 2.94Å; R652-N711 HydrophobicContact CB-CB 3.86Å; R652-N711 WeakPolarHBondContact O-CB 3.43Å; R652-N711 PolarHBondContact O-ND2 3.17Å; R652-R712 HydrophobicContact CB-CG 4.36Å; R652-R712 HydrophobicContact CG-CG 3.58Å
653	Y	93.1	Very high	94.5	Very high	43 Å²	43	50.7 Å²	50.7	17%	0.169	24%	0.244	C	C	.	.			trans	-67.3	140.9	168.4	-71.4	-76.9	0	0	0	111.6	F561 L651 Q657 M658 N711	F561-Y653 HydrophobicContact CE1-CE2 4.49Å; F561-Y653 HydrophobicContact CE2-CD2 4.17Å; F561-Y653 AromaticContact CE2-CE2 3.83Å; F561-Y653 HydrophobicContact CE2-CE2 3.83Å; F561-Y653 HydrophobicContact CZ-CD2 4.26Å; F561-Y653 AromaticContact CZ-CE2 3.46Å; F561-Y653 HydrophobicContact CZ-CE2 3.46Å; F561-Y653 VanDerWaalsContact CZ-CE2 3.46Å; F561-Y653 AromaticContact CZ-CZ 3.92Å; L651-Y653 HydrophobicContact CB-CD2 3.67Å; L651-Y653 HydrophobicContact CB-CE2 3.85Å; L651-Y653 HydrophobicContact CD1-CE2 4.35Å; L651-Y653 PolarHBondContact O-N 3.43Å; Y653-Q657 HydrophobicContact CD1-CB 3.97Å; Y653-M658 HydrophobicContact CD2-CE 4.34Å; Y653-M658 HydrophobicContact CG-CE 4.49Å; Y653-N711 WeakPolarHBondContact CA-ND2 3.25Å; Y653-N711 WeakPolarHBondContact CE1-OD1 3.48Å
654	S	94.7	Very high	94.3	Very high	54 Å²	54	52.9 Å²	52.9	38%	0.378	25%	0.252	S	S	.	.			trans	-76.4	155.7	170.8	63.7	0	0	0	0	111.6	T656 Q657 M658	S654-T656 PolarHBondContact O-N 2.98Å; S654-Q657 PolarHBondContact O-N 3.46Å; S654-Q657 WeakPolarHBondContact OG-CG 3.42Å; S654-Q657 PolarHBondContact OG-N 2.96Å; S654-Q657 PolarHBondContact OG-OE1 3.42Å; S654-M658 PolarHBondContact O-N 3Å
655	R	94.2	Very high	94.1	Very high	108 Å²	108	50.4 Å²	50.4	41%	0.408	24%	0.241	S	C	.	.	H	α-helix	trans	-55.4	-29.3	178.1	-159.4	175.6	-165.7	-177.9	6.6	113.1	H640 E644 H647 R659	H640-R655 PolarHBondContact NE2-NH2 2.72Å; H640-R655 VanDerWaalsContact NE2-NH2 3.18Å; E644-R655 IonicContact OE1-NH2 2.83Å; E644-R655 PolarHBondContact OE1-NH2 3.21Å; H647-R655 WeakPolarHBondContact NE2-CA 3.37Å; H647-R655 PolarHBondContact NE2-N 3.35Å; R655-R659 WeakPolarHBondContact O-CB 3.39Å; R655-R659 VanDerWaalsContact O-CG 3.28Å; R655-R659 WeakPolarHBondContact O-CG 3.31Å; R655-R659 PolarHBondContact O-N 2.92Å
656	T	95.5	Very high	93.9	Very high	91 Å²	91	51 Å²	51	56%	0.558	25%	0.245	S	C	*	.	H	α-helix	trans	-74.9	-40.2	175.2	-52.7	0	0	0	0	112.5	S654 K660	S654-T656 PolarHBondContact O-N 2.98Å; T656-K660 WeakPolarHBondContact O-CG 3.45Å; T656-K660 PolarHBondContact O-N 2.84Å
657	Q	94.8	Very high	93.4	Very high	75 Å²	75	52.8 Å²	52.8	35%	0.35	26%	0.257	S	S	.	.	H	α-helix	trans	-65.8	-46.9	174.1	-73.3	165.2	-61.2	0	0	111	Y653 S654 R659 K660 L661 N711	Y653-Q657 HydrophobicContact CD1-CB 3.97Å; S654-Q657 PolarHBondContact O-N 3.46Å; S654-Q657 WeakPolarHBondContact OG-CG 3.42Å; S654-Q657 PolarHBondContact OG-N 2.96Å; S654-Q657 PolarHBondContact OG-OE1 3.42Å; Q657-R659 PolarHBondContact O-N 3.21Å; Q657-K660 PolarHBondContact O-N 2.86Å; Q657-K660 VanDerWaalsContact O-N 3.16Å; Q657-L661 PolarHBondContact O-N 3.39Å; Q657-N711 PolarHBondContact NE2-ND2 3.42Å; Q657-N711 PolarHBondContact OE1-ND2 3.16Å; Q657-N711 VanDerWaalsContact OE1-ND2 3.15Å
658	M	95.5	Very high	92.5	Very high	2 Å²	2	61.5 Å²	61.5	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-62.1	-44.4	-178.5	-167.8	63.2	76	0	0	112.1	C643 L646 H647 Y653 S654 K660 L661 V662	C643-M658 HydrophobicContact CB-CG 4.25Å; L646-M658 HydrophobicContact CB-CE 3.69Å; L646-M658 HydrophobicContact CB-CG 4.29Å; L646-M658 HydrophobicContact CB-SD 3.55Å; L646-M658 VanDerWaalsContact CB-SD 3.55Å; L646-M658 HydrophobicContact CD1-SD 3.9Å; L646-M658 HydrophobicContact CG-SD 4.39Å; L646-M658 WeakPolarHBondContact O-CE 3.34Å; H647-M658 VanDerWaalsContact CE1-CB 3.41Å; H647-M658 WeakPolarHBondContact CE1-CB 3.3Å; Y653-M658 HydrophobicContact CD2-CE 4.34Å; Y653-M658 HydrophobicContact CG-CE 4.49Å; S654-M658 PolarHBondContact O-N 3Å; M658-K660 PolarHBondContact O-N 3.21Å; M658-L661 PolarHBondContact O-N 3.28Å; M658-V662 WeakPolarHBondContact O-CG2 3.35Å; M658-V662 PolarHBondContact O-N 3.46Å
659	R	94.5	Very high	91.9	Very high	111 Å²	111	69.9 Å²	69.9	42%	0.419	32%	0.317	S	S	.	.	H	α-helix	trans	-57.5	-45.9	172.6	-77.8	172.3	176.2	164.1	-5.4	112.3	R655 Q657 L661 V662 A663	R655-R659 WeakPolarHBondContact O-CB 3.39Å; R655-R659 VanDerWaalsContact O-CG 3.28Å; R655-R659 WeakPolarHBondContact O-CG 3.31Å; R655-R659 PolarHBondContact O-N 2.92Å; Q657-R659 PolarHBondContact O-N 3.21Å; R659-L661 VanDerWaalsContact C-N 3.3Å; R659-L661 PolarHBondContact O-N 3.4Å; R659-V662 PolarHBondContact O-N 2.83Å; R659-A663 VanDerWaalsContact O-CB 3.22Å; R659-A663 WeakPolarHBondContact O-CB 3.22Å; R659-A663 PolarHBondContact O-N 3.17Å
660	K	93.6	Very high	91.4	Very high	157 Å²	157	75.4 Å²	75.4	68%	0.683	35%	0.347	S	S	*	.	H	α-helix	trans	-59.7	-38.8	177.3	-78.7	-174.8	173.4	-165.7	0	112.6	T656 Q657 M658	T656-K660 WeakPolarHBondContact O-CG 3.45Å; T656-K660 PolarHBondContact O-N 2.84Å; Q657-K660 PolarHBondContact O-N 2.86Å; Q657-K660 VanDerWaalsContact O-N 3.16Å; M658-K660 PolarHBondContact O-N 3.21Å
661	L	93.5	Very high	91.4	Very high	20 Å²	20	76 Å²	76	11%	0.105	34%	0.342	C	S	.	.	H	α-helix	trans	-65.6	-52.7	174.4	-68.5	172.4	0	0	0	111.3	F561 I564 Q657 M658 R659 A663 R664	F561-L661 HydrophobicContact CE2-CD1 4.02Å; I564-L661 HydrophobicContact CG2-CB 4.24Å; I564-L661 WeakPolarHBondContact CG2-O 3.45Å; Q657-L661 PolarHBondContact O-N 3.39Å; M658-L661 PolarHBondContact O-N 3.28Å; R659-L661 VanDerWaalsContact C-N 3.3Å; R659-L661 PolarHBondContact O-N 3.4Å; L661-A663 VanDerWaalsContact C-N 3.3Å; L661-A663 PolarHBondContact O-N 3.09Å; L661-R664 VanDerWaalsContact O-CB 3.24Å; L661-R664 WeakPolarHBondContact O-CB 3.46Å; L661-R664 WeakPolarHBondContact O-CG 3.46Å; L661-R664 PolarHBondContact O-N 3.14Å; L661-R664 VanDerWaalsContact O-N 3.1Å
662	V	95.1	Very high	91.5	Very high	0 Å²	0	75.8 Å²	75.8	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-64.3	-33.9	-178.6	-179.3	0	0	0	0	112.2	E639 L642 L646 M658 R659 R664 V665 A666 V672	E639-V662 HydrophobicContact CB-CG1 4.3Å; E639-V662 HydrophobicContact CG-CB 4.31Å; E639-V662 HydrophobicContact CG-CG1 3.83Å; L642-V662 HydrophobicContact CD2-CG1 3.91Å; L642-V662 HydrophobicContact CG-CG1 4.38Å; L642-V662 HydrophobicContact CG-CG2 4.43Å; L646-V662 HydrophobicContact CD1-CG2 3.8Å; M658-V662 WeakPolarHBondContact O-CG2 3.35Å; M658-V662 PolarHBondContact O-N 3.46Å; R659-V662 PolarHBondContact O-N 2.83Å; V662-R664 PolarHBondContact O-N 3.49Å; V662-V665 WeakPolarHBondContact O-CG2 3.45Å; V662-V665 PolarHBondContact O-N 2.69Å; V662-A666 PolarHBondContact O-N 3.39Å; V662-V672 HydrophobicContact CG1-CG2 3.8Å
663	A	92.7	Very high	91.5	Very high	41 Å²	41	68.8 Å²	68.8	34%	0.339	32%	0.319	S	S	.	.	H	α-helix	trans	-59.9	-27.5	175.1	0	0	0	0	0	113.3	R659 L661 V665	R659-A663 VanDerWaalsContact O-CB 3.22Å; R659-A663 WeakPolarHBondContact O-CB 3.22Å; R659-A663 PolarHBondContact O-N 3.17Å; L661-A663 VanDerWaalsContact C-N 3.3Å; L661-A663 PolarHBondContact O-N 3.09Å; A663-V665 PolarHBondContact O-N 3.24Å
664	R	91.5	Very high	91.5	Very high	51 Å²	51	67.2 Å²	67.2	19%	0.192	31%	0.313	C	S	.	.	H	α-helix	trans	-56.7	-36.4	172.2	-63.4	179.9	177	170.5	-5.5	111.7	H565 E569 K570 L661 V662	H565-R664 PolarHBondContact O-NH1 2.82Å; E569-R664 IonicContact OE1-CZ 2.69Å; E569-R664 IonicContact OE1-NE 2.69Å; E569-R664 PolarHBondContact OE1-NE 2.94Å; E569-R664 IonicContact OE1-NH2 3.01Å; E569-R664 PolarHBondContact OE1-NH2 2.86Å; K570-R664 WeakPolarHBondContact CD-O 3.15Å; K570-R664 WeakPolarHBondContact CE-O 3.25Å; K570-R664 PolarHBondContact NZ-O 3.17Å; L661-R664 VanDerWaalsContact O-CB 3.24Å; L661-R664 WeakPolarHBondContact O-CB 3.46Å; L661-R664 WeakPolarHBondContact O-CG 3.46Å; L661-R664 PolarHBondContact O-N 3.14Å; L661-R664 VanDerWaalsContact O-N 3.1Å; V662-R664 PolarHBondContact O-N 3.49Å
665	V	92.5	Very high	91.4	Very high	17 Å²	17	66.6 Å²	66.6	10%	0.103	30%	0.304	C	S	.	.	H	α-helix	trans	-101.5	-23.3	-179.2	-62.6	0	0	0	0	114	I564 A567 K570 V662 A663 V672 L677	I564-V665 HydrophobicContact CD1-CG2 3.98Å; I564-V665 HydrophobicContact CG1-CG1 4.21Å; I564-V665 HydrophobicContact CG1-CG2 3.8Å; I564-V665 HydrophobicContact CG2-CG2 4.16Å; A567-V665 HydrophobicContact CB-CG1 3.58Å; K570-V665 PolarHBondContact NZ-O 2.91Å; V662-V665 WeakPolarHBondContact O-CG2 3.45Å; V662-V665 PolarHBondContact O-N 2.69Å; A663-V665 PolarHBondContact O-N 3.24Å; V665-V672 HydrophobicContact CB-CG1 4.29Å; V665-V672 HydrophobicContact CG2-CB 4.42Å; V665-V672 HydrophobicContact CG2-CG1 3.84Å; V665-V672 HydrophobicContact CG2-CG2 3.65Å; V665-L677 HydrophobicContact CB-CD1 4.23Å; V665-L677 HydrophobicContact CB-CD2 4.11Å; V665-L677 HydrophobicContact CG1-CD1 4.17Å; V665-L677 HydrophobicContact CG1-CD2 3.68Å
666	A	91.3	Very high	91.2	Very high	11 Å²	11	66 Å²	66	9%	0.091	31%	0.309	C	S	.	.			trans	-58.5	145.1	-178.6	0	0	0	0	0	114.3	K570 V662 V672	K570-A666 PolarHBondContact NZ-O 2.93Å; V662-A666 PolarHBondContact O-N 3.39Å; A666-V672 HydrophobicContact CB-CG2 4.41Å
667	T	86.7	Confident	91	Very high	39 Å²	39	64.1 Å²	64.1	24%	0.239	30%	0.295	C	S	.	.			trans	-83	170.1	173.6	66.1	0	0	0	0	111.4	R669 D670 H671	T667-R669 PolarHBondContact O-N 2.8Å; T667-D670 PolarHBondContact O-N 2.7Å; T667-H671 WeakPolarHBondContact CG2-O 3.47Å; T667-H671 PolarHBondContact N-O 3.03Å; T667-H671 PolarHBondContact OG1-CE1 2.69Å; T667-H671 PolarHBondContact OG1-ND1 2.86Å; T667-H671 PolarHBondContact OG1-NE2 2.9Å; T667-H671 PolarHBondContact OG1-O 3.08Å
668	R	78	Confident	90.9	Very high	240 Å²	240	60.6 Å²	60.6	91%	0.906	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	22.3	173.2	-64.1	-175.7	172	-167.4	-6.6	115
669	R	81.1	Confident	90.7	Very high	202 Å²	202	61.1 Å²	61.1	76%	0.762	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.1	29.2	-176.5	-69	-178.4	178.3	173.1	-0.1	110.3	T667 H671	T667-R669 PolarHBondContact O-N 2.8Å; R669-H671 VanDerWaalsContact CB-CE1 3.45Å; R669-H671 WeakPolarHBondContact CB-CE1 3.47Å; R669-H671 WeakPolarHBondContact CB-ND1 3.43Å; R669-H671 PolarHBondContact O-N 2.92Å; R669-H671 VanDerWaalsContact O-N 3.09Å; R669-H671 PolarHBondContact O-ND1 2.84Å
670	D	86.3	Confident	90.4	Very high	117 Å²	117	58.8 Å²	58.8	63%	0.626	28%	0.283	S	S	*	.	S	Bend	trans	51.6	36.6	172.1	-46.9	-15.1	0	0	0	114.5	R638 E639 T667	R638-D670 WeakPolarHBondContact CA-O 3.14Å; E639-D670 PolarHBondContact N-O 2.59Å; T667-D670 PolarHBondContact O-N 2.7Å
671	H	91.2	Very high	90	Very high	37 Å²	37	56 Å²	56	17%	0.171	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	149.3	175.1	66.6	-91.9	0	0	0	112.8	Y636 I637 T667 R669	Y636-H671 HydrophobicContact CD2-CB 3.7Å; Y636-H671 AromaticContact CD2-CG 3.88Å; Y636-H671 HydrophobicContact CE2-CB 4.42Å; Y636-H671 HydrophobicContact CG-CB 4.35Å; Y636-H671 AromaticContact CG-CD2 3.84Å; I637-H671 CarbonylContact O-C 3.56Å; I637-H671 WeakPolarHBondContact O-CA 3.38Å; I637-H671 WeakPolarHBondContact O-CB 3.46Å; T667-H671 WeakPolarHBondContact CG2-O 3.47Å; T667-H671 PolarHBondContact N-O 3.03Å; T667-H671 PolarHBondContact OG1-CE1 2.69Å; T667-H671 PolarHBondContact OG1-ND1 2.86Å; T667-H671 PolarHBondContact OG1-NE2 2.9Å; T667-H671 PolarHBondContact OG1-O 3.08Å; R669-H671 VanDerWaalsContact CB-CE1 3.45Å; R669-H671 WeakPolarHBondContact CB-CE1 3.47Å; R669-H671 WeakPolarHBondContact CB-ND1 3.43Å; R669-H671 PolarHBondContact O-N 2.92Å; R669-H671 VanDerWaalsContact O-N 3.09Å; R669-H671 PolarHBondContact O-ND1 2.84Å
672	V	93.6	Very high	89.3	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	106.1	172	-175.7	0	0	0	0	108.1	F626 Y636 I637 L642 V662 V665 A666 Y674 L677	F626-V672 HydrophobicContact CZ-CG1 4.5Å; Y636-V672 WeakPolarHBondContact CA-O 3.44Å; Y636-V672 WeakPolarHBondContact CB-O 3.21Å; I637-V672 PolarHBondContact N-O 3.28Å; I637-V672 VanDerWaalsContact N-O 3.08Å; I637-V672 PolarHBondContact O-N 2.8Å; L642-V672 HydrophobicContact CD2-CB 3.99Å; L642-V672 HydrophobicContact CD2-CG1 4.44Å; L642-V672 HydrophobicContact CD2-CG2 3.59Å; V662-V672 HydrophobicContact CG1-CG2 3.8Å; V665-V672 HydrophobicContact CB-CG1 4.29Å; V665-V672 HydrophobicContact CG2-CB 4.42Å; V665-V672 HydrophobicContact CG2-CG1 3.84Å; V665-V672 HydrophobicContact CG2-CG2 3.65Å; A666-V672 HydrophobicContact CB-CG2 4.41Å; V672-Y674 PolarHBondContact O-N 2.79Å; V672-L677 HydrophobicContact CG1-CD1 3.87Å
673	S	92.8	Very high	88.4	Confident	27 Å²	27	58.1 Å²	58.1	19%	0.189	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	104.9	166.8	171.7	0	0	0	0	107.8	H675 N676	S673-H675 PolarHBondContact O-N 3.43Å; S673-N676 VanDerWaalsContact O-CB 3.32Å; S673-N676 WeakPolarHBondContact O-CB 3.38Å; S673-N676 PolarHBondContact O-N 3.48Å; S673-N676 PolarHBondContact OG-OD1 3.4Å
674	Y	93	Very high	87.2	Confident	10 Å²	10	59.8 Å²	59.8	4%	0.039	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-66.7	-25.3	-172.3	48.3	-112.1	0	0	0	113	L623 F626 D630 G635 V672 N676 L677 T678	L623-Y674 HydrophobicContact CD1-CD2 3.41Å; L623-Y674 VanDerWaalsContact CD1-CD2 3.41Å; L623-Y674 HydrophobicContact CD1-CE2 3.45Å; L623-Y674 VanDerWaalsContact CD1-CE2 3.45Å; F626-Y674 HydrophobicContact CB-CD1 3.65Å; F626-Y674 HydrophobicContact CB-CD2 4.5Å; F626-Y674 HydrophobicContact CB-CE1 4.01Å; F626-Y674 HydrophobicContact CB-CG 3.91Å; F626-Y674 AromaticContact CD1-CD1 3.82Å; F626-Y674 HydrophobicContact CD1-CD1 3.82Å; F626-Y674 HydrophobicContact CD1-CG 4.23Å; F626-Y674 HydrophobicContact CD2-CD1 4.31Å; F626-Y674 AromaticContact CD2-CG 3.92Å; F626-Y674 HydrophobicContact CD2-CG 3.92Å; F626-Y674 VanDerWaalsContact CE2-CB 3.43Å; F626-Y674 AromaticContact CG-CD1 3.68Å; F626-Y674 HydrophobicContact CG-CD1 3.68Å; F626-Y674 AromaticContact CG-CG 3.77Å; F626-Y674 HydrophobicContact CG-CG 3.77Å; D630-Y674 HydrophobicContact CB-CE1 4.31Å; D630-Y674 PolarHBondContact OD2-OH 2.87Å; G635-Y674 VanDerWaalsContact CA-CZ 3.42Å; G635-Y674 WeakPolarHBondContact CA-OH 3.31Å; G635-Y674 PolarHBondContact N-OH 2.86Å; G635-Y674 PolarHBondContact O-N 2.91Å; V672-Y674 PolarHBondContact O-N 2.79Å; Y674-N676 PolarHBondContact O-N 2.79Å; Y674-L677 WeakPolarHBondContact O-CA 3.29Å; Y674-L677 PolarHBondContact O-N 2.88Å; Y674-T678 WeakPolarHBondContact O-CG2 3.45Å; Y674-T678 PolarHBondContact O-N 3.31Å; Y674-T678 PolarHBondContact O-OG1 2.8Å
675	H	91.8	Very high	85.8	Confident	42 Å²	42	58.3 Å²	58.3	19%	0.194	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-61.3	-7.6	168.8	-75.8	-74.5	0	0	0	114.6	R218 R615 S673 D679	R218-H675 PolarHBondContact O-CE1 3.06Å; R615-H675 PolarHBondContact NH2-O 3.01Å; S673-H675 PolarHBondContact O-N 3.43Å; H675-D679 WeakPolarHBondContact CB-OD2 3.34Å; H675-D679 IonicContact CE1-OD2 3.17Å; H675-D679 IonicContact CG-OD2 2.86Å; H675-D679 IonicContact ND1-OD1 2.89Å; H675-D679 IonicContact ND1-OD2 2.95Å; H675-D679 PolarHBondContact ND1-OD2 3.41Å; H675-D679 WeakPolarHBondContact O-CB 3.5Å
676	N	91.3	Very high	84.7	Confident	96 Å²	96	60.6 Å²	60.6	51%	0.513	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-91.9	-7.7	170.1	-60.2	-3.1	0	0	0	113	S673 Y674	S673-N676 VanDerWaalsContact O-CB 3.32Å; S673-N676 WeakPolarHBondContact O-CB 3.38Å; S673-N676 PolarHBondContact O-N 3.48Å; S673-N676 PolarHBondContact OG-OD1 3.4Å; Y674-N676 PolarHBondContact O-N 2.79Å
677	L	91.2	Very high	83.5	Confident	50 Å²	50	68.7 Å²	68.7	26%	0.262	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-23.8	178.5	-56	177.1	0	0	0	112.1	L622 F626 V665 V672 Y674	L622-L677 HydrophobicContact CD2-CB 3.88Å; F626-L677 HydrophobicContact CE2-CD1 4.44Å; F626-L677 HydrophobicContact CZ-CD1 4.24Å; V665-L677 HydrophobicContact CB-CD1 4.23Å; V665-L677 HydrophobicContact CB-CD2 4.11Å; V665-L677 HydrophobicContact CG1-CD1 4.17Å; V665-L677 HydrophobicContact CG1-CD2 3.68Å; V672-L677 HydrophobicContact CG1-CD1 3.87Å; Y674-L677 WeakPolarHBondContact O-CA 3.29Å; Y674-L677 PolarHBondContact O-N 2.88Å
678	T	92.3	Very high	82.4	Confident	2 Å²	2	73.2 Å²	73.2	1%	0.012	35%	0.354	C	S	.	.	S	Bend	trans	-99.6	-23.3	-175.4	61.5	0	0	0	0	114	T617 V618 N619 L622 L623 Y674	T617-T678 CarbonylContact C-O 3.55Å; V618-T678 PolarHBondContact N-O 3.39Å; N619-T678 PolarHBondContact N-O 3.35Å; L622-T678 HydrophobicContact CB-CG2 4.17Å; L622-T678 HydrophobicContact CD2-CG2 4.1Å; L622-T678 HydrophobicContact CG-CG2 3.97Å; L623-T678 HydrophobicContact CB-CG2 3.67Å; L623-T678 HydrophobicContact CD1-CG2 4.17Å; L623-T678 HydrophobicContact CG-CG2 4.48Å; Y674-T678 WeakPolarHBondContact O-CG2 3.45Å; Y674-T678 PolarHBondContact O-N 3.31Å; Y674-T678 PolarHBondContact O-OG1 2.8Å
679	D	91.2	Very high	81.4	Confident	13 Å²	13	62.5 Å²	62.5	7%	0.07	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	159.6	-169.9	-50.6	-17	0	0	0	112	R615 R616 T617 H675	R615-D679 HydrophobicContact CG-CB 4.17Å; R615-D679 IonicContact NE-OD2 3.94Å; R616-D679 CarbonylContact O-C 3.6Å; R616-D679 WeakPolarHBondContact O-CA 3.24Å; R616-D679 WeakPolarHBondContact O-CB 3.36Å; T617-D679 WeakPolarHBondContact CB-OD1 3.13Å; T617-D679 PolarHBondContact OG1-OD1 3.02Å; H675-D679 WeakPolarHBondContact CB-OD2 3.34Å; H675-D679 IonicContact CE1-OD2 3.17Å; H675-D679 IonicContact CG-OD2 2.86Å; H675-D679 IonicContact ND1-OD1 2.89Å; H675-D679 IonicContact ND1-OD2 2.95Å; H675-D679 PolarHBondContact ND1-OD2 3.41Å; H675-D679 WeakPolarHBondContact O-CB 3.5Å
680	S	87.7	Confident	80.3	Confident	62 Å²	62	56.9 Å²	56.9	43%	0.434	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	152.6	173.4	-66.2	0	0	0	0	111.1	R615 R616 I682	R615-S680 CarbonylContact C-O 3.42Å; R615-S680 WeakPolarHBondContact CA-O 3.48Å; R616-S680 PolarHBondContact N-O 2.9Å; R616-S680 PolarHBondContact O-N 3.34Å; S680-I682 PolarHBondContact O-N 3.12Å
681	D	85.2	Confident	78.7	Confident	98 Å²	98	54.7 Å²	54.7	52%	0.524	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	107.1	173.2	-60.6	-23.3	0	0	0	108.7	R613 R615	R613-D681 HydrophobicContact CB-CB 4.44Å; R615-D681 WeakPolarHBondContact CB-OD1 3.37Å; R615-D681 WeakPolarHBondContact CG-OD1 3.36Å; R615-D681 IonicContact NH1-OD1 3.81Å
682	I	79.2	Confident	76.8	Confident	4 Å²	4	55.4 Å²	55.4	2%	0.021	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	144.5	-172.3	-46.6	-171.8	0	0	0	110.1	R613 L614 R616 V618 S680 D686 K688 D689	R613-I682 CarbonylContact C-O 3.57Å; R613-I682 VanDerWaalsContact CA-O 3.23Å; R613-I682 WeakPolarHBondContact CA-O 3.14Å; L614-I682 PolarHBondContact N-O 3.05Å; L614-I682 PolarHBondContact O-N 2.95Å; R616-I682 HydrophobicContact CB-CD1 3.72Å; R616-I682 HydrophobicContact CB-CG1 4.25Å; R616-I682 HydrophobicContact CG-CB 4.49Å; R616-I682 HydrophobicContact CG-CD1 4.03Å; R616-I682 HydrophobicContact CG-CG1 4.32Å; V618-I682 HydrophobicContact CG2-CD1 3.76Å; S680-I682 PolarHBondContact O-N 3.12Å; I682-D686 HydrophobicContact CG2-CB 3.58Å; I682-K688 HydrophobicContact CD1-CB 4Å; I682-K688 VanDerWaalsContact CD1-O 3.32Å; I682-K688 WeakPolarHBondContact CD1-O 3.45Å; I682-K688 HydrophobicContact CG2-CB 4.23Å; I682-D689 HydrophobicContact CG2-CB 3.92Å
683	V	76.6	Confident	74.7	Confident	60 Å²	60	59.3 Å²	59.3	36%	0.364	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	132.6	169.6	164.8	0	0	0	0	109.3	V611 R613 G685 D686	V611-V683 HydrophobicContact CG1-CB 4.23Å; V611-V683 HydrophobicContact CG1-CG1 3.47Å; V611-V683 VanDerWaalsContact CG1-CG1 3.47Å; V611-V683 HydrophobicContact CG1-CG2 3.84Å; R613-V683 HydrophobicContact CG-CG2 4.3Å; V683-G685 PolarHBondContact O-N 3.08Å; V683-G685 VanDerWaalsContact O-N 3.07Å; V683-D686 WeakPolarHBondContact O-CB 3.49Å; V683-D686 PolarHBondContact O-N 3.45Å
684	E	66	Low	72.6	Confident	77 Å²	77	63.1 Å²	63.1	36%	0.36	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	116.5	-179.3	-154.6	-174.6	159	0	0	111.3	L614 K772	L614-E684 HydrophobicContact CD1-CB 3.86Å; L614-E684 HydrophobicContact CD1-CG 4.07Å; E684-K772 IonicContact OE1-NZ 2.78Å; E684-K772 PolarHBondContact OE1-NZ 3.02Å; E684-K772 IonicContact OE2-NZ 3.76Å; E684-K772 PolarHBondContact OE2-NZ 3.05Å
685	G	63.8	Low	70.5	Confident	20 Å²	20	69.7 Å²	69.7	21%	0.206	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	9.4	-173.3	0	0	0	0	0	117.9	V683 D689 R765	V683-G685 PolarHBondContact O-N 3.08Å; V683-G685 VanDerWaalsContact O-N 3.07Å; G685-D689 PolarHBondContact N-OD2 3.07Å; G685-R765 VanDerWaalsContact C-NH2 3.35Å; G685-R765 VanDerWaalsContact CA-NH2 3.3Å; G685-R765 PolarHBondContact O-NH2 3.09Å
686	D	68.4	Low	68.1	Low	64 Å²	64	74.7 Å²	74.7	34%	0.342	40%	0.403	S	S	.	.	S	Bend	trans	-55	157.6	158.2	-173.7	0.5	0	0	0	110	I682 V683 K688 D689	I682-D686 HydrophobicContact CG2-CB 3.58Å; V683-D686 WeakPolarHBondContact O-CB 3.49Å; V683-D686 PolarHBondContact O-N 3.45Å; D686-K688 PolarHBondContact O-N 3.32Å; D686-K688 VanDerWaalsContact O-N 3.17Å; D686-D689 HydrophobicContact CB-CB 4.26Å; D686-D689 WeakPolarHBondContact O-CB 3.15Å; D686-D689 PolarHBondContact O-N 3.25Å
687	E	66.3	Low	66.3	Low	181 Å²	181	74.8 Å²	74.8	85%	0.846	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-29.8	174.3	-63.9	-166.4	137.7	0	0	111.7	D689	E687-D689 VanDerWaalsContact C-N 3.33Å
688	K	63.1	Low	64.6	Low	134 Å²	134	81.8 Å²	81.8	58%	0.583	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-13.7	175.3	-57.8	170.9	-173.7	163.9	0	113.8	I682 D686 V690	I682-K688 HydrophobicContact CD1-CB 4Å; I682-K688 VanDerWaalsContact CD1-O 3.32Å; I682-K688 WeakPolarHBondContact CD1-O 3.45Å; I682-K688 HydrophobicContact CG2-CB 4.23Å; D686-K688 PolarHBondContact O-N 3.32Å; D686-K688 VanDerWaalsContact O-N 3.17Å; K688-V690 VanDerWaalsContact C-N 3.35Å
689	D	58.2	Low	63.2	Low	15 Å²	15	86.9 Å²	86.9	8%	0.08	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-38.6	-178.1	-161.1	69	0	0	0	110.1	R616 I682 G685 D686 E687 V691	R616-D689 IonicContact CZ-OD1 3.72Å; R616-D689 IonicContact CZ-OD2 3.93Å; R616-D689 IonicContact NE-OD1 3.5Å; R616-D689 PolarHBondContact NH1-O 3.3Å; R616-D689 IonicContact NH1-OD1 2.71Å; R616-D689 PolarHBondContact NH1-OD1 3.27Å; R616-D689 IonicContact NH1-OD2 2.88Å; R616-D689 PolarHBondContact NH1-OD2 3.21Å; R616-D689 IonicContact NH2-OD1 3.17Å; R616-D689 PolarHBondContact NH2-OD1 3.25Å; R616-D689 IonicContact NH2-OD2 3.33Å; R616-D689 PolarHBondContact NH2-OD2 3.49Å; I682-D689 HydrophobicContact CG2-CB 3.92Å; G685-D689 PolarHBondContact N-OD2 3.07Å; D686-D689 HydrophobicContact CB-CB 4.26Å; D686-D689 WeakPolarHBondContact O-CB 3.15Å; D686-D689 PolarHBondContact O-N 3.25Å; E687-D689 VanDerWaalsContact C-N 3.33Å; D689-V691 PolarHBondContact O-N 3.41Å; D689-V691 VanDerWaalsContact O-N 3.13Å
690	V	57.3	Low	62.5	Low	85 Å²	85	90.8 Å²	90.8	52%	0.515	48%	0.48	S	S	.	.	S	Bend	trans	-67.8	109.4	161.1	-177.7	0	0	0	0	107.7	K688 S692	K688-V690 VanDerWaalsContact C-N 3.35Å; V690-S692 PolarHBondContact O-N 3.12Å; V690-S692 PolarHBondContact O-OG 3.15Å
691	V	53.7	Low	62	Low	71 Å²	71	91.7 Å²	91.7	43%	0.43	48%	0.482	S	S	.	.			trans	-69.7	70.8	168.7	-172.1	0	0	0	0	108.9	D689 M693	D689-V691 PolarHBondContact O-N 3.41Å; D689-V691 VanDerWaalsContact O-N 3.13Å; V691-M693 PolarHBondContact O-N 2.73Å
692	S	49.7	Very low	61.9	Low	51 Å²	51	91.5 Å²	91.5	36%	0.357	48%	0.478	S	S	.	.			trans	-62	117.5	166.4	39.8	0	0	0	0	107.3	V690 N694	V690-S692 PolarHBondContact O-N 3.12Å; V690-S692 PolarHBondContact O-OG 3.15Å; S692-N694 PolarHBondContact O-N 3.38Å; S692-N694 PolarHBondContact OG-ND2 3.27Å; S692-N694 VanDerWaalsContact OG-ND2 3.16Å; S692-N694 PolarHBondContact OG-OD1 3.26Å
693	M	50.8	Low	62.2	Low	83 Å²	83	95.1 Å²	95.1	41%	0.409	50%	0.5	S	S	.	.			trans	-63.6	89.5	163.7	-68.8	-81.8	-166.8	0	0	106.5	Y213 P620 V691 L695	Y213-M693 HydrophobicContact CD2-CE 3.8Å; Y213-M693 HydrophobicContact CD2-SD 4.29Å; Y213-M693 HydrophobicContact CE2-CE 4.25Å; Y213-M693 HydrophobicContact CE2-SD 4.16Å; P620-M693 HydrophobicContact CG-SD 4.49Å; V691-M693 PolarHBondContact O-N 2.73Å; M693-L695 HydrophobicContact CB-CG 4.48Å; M693-L695 PolarHBondContact O-N 2.88Å
694	N	47.1	Very low	62.7	Low	107 Å²	107	92.7 Å²	92.7	57%	0.572	49%	0.486	S	S	*	.			trans	-76.7	68.4	-176.3	-78.6	-39	0	0	0	110.6	S692 N696 V697	S692-N694 PolarHBondContact O-N 3.38Å; S692-N694 PolarHBondContact OG-ND2 3.27Å; S692-N694 VanDerWaalsContact OG-ND2 3.16Å; S692-N694 PolarHBondContact OG-OD1 3.26Å; N694-N696 PolarHBondContact O-N 2.93Å; N694-V697 HydrophobicContact CB-CG2 3.97Å; N694-V697 WeakPolarHBondContact O-CG2 3.32Å; N694-V697 PolarHBondContact O-N 3.23Å
695	L	49.4	Very low	63.7	Low	148 Å²	148	91.9 Å²	91.9	78%	0.775	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-13.8	170.6	-60.8	170.6	0	0	0	112.6	M693	M693-L695 HydrophobicContact CB-CG 4.48Å; M693-L695 PolarHBondContact O-N 2.88Å
696	N	42.6	Very low	64.8	Low	147 Å²	147	95.6 Å²	95.6	79%	0.786	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	19.5	177.3	-87.4	-28.2	0	0	0	114	N694 K698	N694-N696 PolarHBondContact O-N 2.93Å; N696-K698 VanDerWaalsContact C-N 3.29Å; N696-K698 PolarHBondContact O-N 3.41Å
697	V	53.4	Low	65.8	Low	98 Å²	98	93.2 Å²	93.2	59%	0.594	48%	0.48	S	S	*	.			trans	-63.1	101.2	156.3	-179.8	0	0	0	0	106.6	N694 E699	N694-V697 HydrophobicContact CB-CG2 3.97Å; N694-V697 WeakPolarHBondContact O-CG2 3.32Å; N694-V697 PolarHBondContact O-N 3.23Å; V697-E699 HydrophobicContact CG1-CG 4Å; V697-E699 PolarHBondContact O-N 3.21Å
698	K	54.5	Low	67	Low	198 Å²	198	85.2 Å²	85.2	86%	0.861	45%	0.445	S	S	*	.			trans	-70.6	77.5	171.3	-71.3	-174.4	176.9	-177.3	0	108.7	N696 D700	N696-K698 VanDerWaalsContact C-N 3.29Å; N696-K698 PolarHBondContact O-N 3.41Å; K698-D700 PolarHBondContact O-N 3.06Å
699	E	63.5	Low	68.2	Low	108 Å²	108	80.2 Å²	80.2	51%	0.505	42%	0.424	S	S	.	.			trans	-56.7	132.3	166.4	-56.2	-153.2	123.1	0	0	108.4	K562 V697 V701	K562-E699 WeakPolarHBondContact CE-OE1 3.3Å; K562-E699 IonicContact NZ-OE1 3.81Å; K562-E699 PolarHBondContact NZ-OE1 3.37Å; K562-E699 IonicContact NZ-OE2 3.42Å; K562-E699 PolarHBondContact NZ-OE2 2.78Å; V697-E699 HydrophobicContact CG1-CG 4Å; V697-E699 PolarHBondContact O-N 3.21Å; E699-V701 PolarHBondContact O-N 3.07Å
700	D	75.5	Confident	69.6	Low	95 Å²	95	79.9 Å²	79.9	51%	0.508	43%	0.425	S	S	.	.			trans	-68	110.8	172.9	-172.4	-39.7	0	0	0	108	K698 E702 V703 T704	K698-D700 PolarHBondContact O-N 3.06Å; D700-E702 PolarHBondContact O-N 2.98Å; D700-E702 WeakPolarHBondContact OD1-CA 3.4Å; D700-E702 WeakPolarHBondContact OD1-CB 3.45Å; D700-E702 PolarHBondContact OD1-N 3.44Å; D700-V703 HydrophobicContact CB-CB 3.92Å; D700-V703 HydrophobicContact CB-CG2 3.79Å; D700-V703 PolarHBondContact O-N 3.08Å; D700-V703 PolarHBondContact OD1-N 3Å; D700-T704 WeakPolarHBondContact O-CB 3.48Å; D700-T704 PolarHBondContact O-N 3.39Å; D700-T704 PolarHBondContact O-OG1 3.43Å
701	V	78.5	Confident	71.2	Confident	81 Å²	81	76.8 Å²	76.8	49%	0.491	41%	0.405	S	S	.	.	H	α-helix	trans	-65.2	-31.5	-177.1	-179.9	0	0	0	0	110.5	E699 T704 R705	E699-V701 PolarHBondContact O-N 3.07Å; V701-T704 PolarHBondContact O-N 3.26Å; V701-R705 WeakPolarHBondContact O-CB 3.48Å; V701-R705 PolarHBondContact O-N 3.24Å
702	E	81.8	Confident	72.6	Confident	94 Å²	94	78.2 Å²	78.2	44%	0.439	40%	0.403	S	S	.	.	H	α-helix	trans	-77.4	-39.7	178.9	-164.7	58	-144.6	0	0	111.1	D700 T704 R705 M706	D700-E702 PolarHBondContact O-N 2.98Å; D700-E702 WeakPolarHBondContact OD1-CA 3.4Å; D700-E702 WeakPolarHBondContact OD1-CB 3.45Å; D700-E702 PolarHBondContact OD1-N 3.44Å; E702-T704 VanDerWaalsContact C-N 3.29Å; E702-T704 PolarHBondContact O-N 3.06Å; E702-R705 WeakPolarHBondContact O-CB 3.24Å; E702-R705 PolarHBondContact O-N 2.86Å; E702-R705 IonicContact OE2-CZ 3.91Å; E702-R705 IonicContact OE2-NE 2.77Å; E702-R705 IonicContact OE2-NH1 2.75Å; E702-R705 PolarHBondContact OE2-NH1 3.14Å; E702-M706 WeakPolarHBondContact O-CG 3.45Å; E702-M706 PolarHBondContact O-N 3.01Å
703	V	85.7	Confident	74.2	Confident	80 Å²	80	77.4 Å²	77.4	49%	0.485	40%	0.399	S	S	.	.	H	α-helix	trans	-59.7	-43.4	169	175.7	0	0	0	0	110.5	D700 R705 M706 L707	D700-V703 HydrophobicContact CB-CB 3.92Å; D700-V703 HydrophobicContact CB-CG2 3.79Å; D700-V703 PolarHBondContact O-N 3.08Å; D700-V703 PolarHBondContact OD1-N 3Å; V703-R705 PolarHBondContact O-N 3.01Å; V703-M706 PolarHBondContact O-N 3.42Å; V703-L707 HydrophobicContact CG1-CD1 4.37Å; V703-L707 WeakPolarHBondContact O-CG 3.12Å; V703-L707 PolarHBondContact O-N 2.73Å
704	T	88.4	Confident	75.7	Confident	9 Å²	9	79.2 Å²	79.2	6%	0.055	41%	0.41	C	S	.	.	H	α-helix	trans	-67.8	-35.3	179.3	-53.3	0	0	0	0	111.9	H159 F558 K562 D700 V701 E702 L707 A708	H159-T704 HydrophobicContact CB-CG2 4.22Å; F558-T704 HydrophobicContact CE1-CG2 3.94Å; F558-T704 HydrophobicContact CZ-CG2 4.37Å; K562-T704 PolarHBondContact NZ-OG1 3.19Å; D700-T704 WeakPolarHBondContact O-CB 3.48Å; D700-T704 PolarHBondContact O-N 3.39Å; D700-T704 PolarHBondContact O-OG1 3.43Å; V701-T704 PolarHBondContact O-N 3.26Å; E702-T704 VanDerWaalsContact C-N 3.29Å; E702-T704 PolarHBondContact O-N 3.06Å; T704-L707 PolarHBondContact O-N 2.71Å; T704-A708 WeakPolarHBondContact O-CB 3.08Å; T704-A708 PolarHBondContact O-N 2.96Å
705	R	86.6	Confident	76.9	Confident	60 Å²	60	81.8 Å²	81.8	23%	0.226	42%	0.416	C	S	.	.	H	α-helix	trans	-63.9	-43.2	170.6	178.7	179.7	-71.3	156.2	-7.8	112.3	H159 V701 E702 V703 A708 L709 P720	H159-R705 HydrophobicContact CB-CB 4.13Å; H159-R705 PolarHBondContact NE2-NH2 3.3Å; V701-R705 WeakPolarHBondContact O-CB 3.48Å; V701-R705 PolarHBondContact O-N 3.24Å; E702-R705 WeakPolarHBondContact O-CB 3.24Å; E702-R705 PolarHBondContact O-N 2.86Å; E702-R705 IonicContact OE2-CZ 3.91Å; E702-R705 IonicContact OE2-NE 2.77Å; E702-R705 IonicContact OE2-NH1 2.75Å; E702-R705 PolarHBondContact OE2-NH1 3.14Å; V703-R705 PolarHBondContact O-N 3.01Å; R705-A708 WeakPolarHBondContact O-CB 3.45Å; R705-A708 PolarHBondContact O-N 3.43Å; R705-L709 PolarHBondContact O-N 3.47Å; R705-L709 VanDerWaalsContact O-N 3.12Å; R705-P720 HydrophobicContact CG-CB 4.36Å; R705-P720 HydrophobicContact CG-CG 3.85Å
706	M	86.6	Confident	77.7	Confident	98 Å²	98	77.5 Å²	77.5	48%	0.483	39%	0.394	S	S	.	.	H	α-helix	trans	-65	-38.7	175.2	-71.9	-62	-65.6	0	0	112	E702 V703 A708 L709 G710 A713	E702-M706 WeakPolarHBondContact O-CG 3.45Å; E702-M706 PolarHBondContact O-N 3.01Å; V703-M706 PolarHBondContact O-N 3.42Å; M706-A708 VanDerWaalsContact C-N 3.33Å; M706-A708 PolarHBondContact O-N 3.38Å; M706-L709 PolarHBondContact O-N 3.3Å; M706-L709 HydrophobicContact SD-CD1 4.01Å; M706-G710 PolarHBondContact O-N 3.36Å; M706-A713 HydrophobicContact CE-CB 4.06Å
707	L	90	Very high	78.3	Confident	15 Å²	15	78.7 Å²	78.7	8%	0.079	40%	0.397	C	S	.	.	H	α-helix	trans	-64.1	-36.3	171.3	-69.6	173.7	0	0	0	112.5	F558 K562 V703 T704 L709 G710	F558-L707 HydrophobicContact CZ-CB 4.16Å; K562-L707 HydrophobicContact CG-CD1 4.38Å; V703-L707 HydrophobicContact CG1-CD1 4.37Å; V703-L707 WeakPolarHBondContact O-CG 3.12Å; V703-L707 PolarHBondContact O-N 2.73Å; T704-L707 PolarHBondContact O-N 2.71Å; L707-L709 VanDerWaalsContact C-N 3.29Å; L707-L709 PolarHBondContact O-N 3.3Å; L707-G710 PolarHBondContact O-N 2.9Å; L707-G710 VanDerWaalsContact O-N 3.13Å
708	A	90.2	Very high	78.5	Confident	13 Å²	13	78.5 Å²	78.5	11%	0.107	40%	0.396	C	S	.	.	H	α-helix	trans	-70.1	-20.2	176.5	0	0	0	0	0	114	M158 H159 F558 L651 T704 R705 M706	M158-A708 HydrophobicContact CB-CB 4.02Å; M158-A708 HydrophobicContact CE-CB 4.43Å; M158-A708 VanDerWaalsContact CE-O 3.3Å; M158-A708 WeakPolarHBondContact CE-O 3.2Å; H159-A708 HydrophobicContact CB-CB 4.08Å; F558-A708 HydrophobicContact CE2-CB 4.17Å; F558-A708 HydrophobicContact CZ-CB 3.81Å; L651-A708 WeakPolarHBondContact CD2-O 3.16Å; T704-A708 WeakPolarHBondContact O-CB 3.08Å; T704-A708 PolarHBondContact O-N 2.96Å; R705-A708 WeakPolarHBondContact O-CB 3.45Å; R705-A708 PolarHBondContact O-N 3.43Å; M706-A708 VanDerWaalsContact C-N 3.33Å; M706-A708 PolarHBondContact O-N 3.38Å
709	L	87.8	Confident	78.6	Confident	28 Å²	28	74.9 Å²	74.9	15%	0.147	39%	0.39	C	S	.	.	H	α-helix	trans	-76.5	-35.7	166.7	-70.7	170.6	0	0	0	111.8	R705 M706 L707 R712 A713 P720	R705-L709 PolarHBondContact O-N 3.47Å; R705-L709 VanDerWaalsContact O-N 3.12Å; M706-L709 PolarHBondContact O-N 3.3Å; M706-L709 HydrophobicContact SD-CD1 4.01Å; L707-L709 VanDerWaalsContact C-N 3.29Å; L707-L709 PolarHBondContact O-N 3.3Å; L709-R712 WeakPolarHBondContact O-CB 3.34Å; L709-R712 VanDerWaalsContact O-CG 3.28Å; L709-R712 WeakPolarHBondContact O-CG 3.29Å; L709-R712 PolarHBondContact O-N 2.85Å; L709-A713 HydrophobicContact CB-CB 3.98Å; L709-A713 HydrophobicContact CD1-CB 4.12Å; L709-P720 HydrophobicContact CD1-CG 4.36Å; L709-P720 HydrophobicContact CD2-CG 3.98Å; L709-P720 HydrophobicContact CG-CG 4.24Å
710	G	89.5	Confident	78	Confident	9 Å²	9	71.3 Å²	71.3	9%	0.093	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	56	-138.9	-174.2	0	0	0	0	0	111.9	M706 L707 R712 A713	M706-G710 PolarHBondContact O-N 3.36Å; L707-G710 PolarHBondContact O-N 2.9Å; L707-G710 VanDerWaalsContact O-N 3.13Å; G710-R712 PolarHBondContact O-N 3.17Å; G710-A713 PolarHBondContact O-N 3.4Å
711	N	90.4	Very high	77.1	Confident	20 Å²	20	74.6 Å²	74.6	11%	0.107	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-63.2	-10.2	176.4	-82.2	-4.3	0	0	0	113.5	L651 R652 Y653 Q657 A713 L714 F715	L651-N711 PolarHBondContact O-N 3.3Å; R652-N711 HydrophobicContact CB-CB 3.86Å; R652-N711 WeakPolarHBondContact O-CB 3.43Å; R652-N711 PolarHBondContact O-ND2 3.17Å; Y653-N711 WeakPolarHBondContact CA-ND2 3.25Å; Y653-N711 WeakPolarHBondContact CE1-OD1 3.48Å; Q657-N711 PolarHBondContact NE2-ND2 3.42Å; Q657-N711 PolarHBondContact OE1-ND2 3.16Å; Q657-N711 VanDerWaalsContact OE1-ND2 3.15Å; N711-A713 VanDerWaalsContact C-N 3.26Å; N711-A713 PolarHBondContact O-N 3.22Å; N711-L714 HydrophobicContact CB-CD1 4.41Å; N711-L714 WeakPolarHBondContact O-CB 3.33Å; N711-L714 PolarHBondContact O-N 3.45Å; N711-F715 WeakPolarHBondContact O-CD2 3.45Å
712	R	83.4	Confident	76.1	Confident	101 Å²	101	74.5 Å²	74.5	38%	0.381	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-65	-32	175.8	-56.8	-175.1	72.3	171	-1.2	111.8	R652 L709 G710 L714 F715 D716	R652-R712 HydrophobicContact CB-CG 4.36Å; R652-R712 HydrophobicContact CG-CG 3.58Å; L709-R712 WeakPolarHBondContact O-CB 3.34Å; L709-R712 VanDerWaalsContact O-CG 3.28Å; L709-R712 WeakPolarHBondContact O-CG 3.29Å; L709-R712 PolarHBondContact O-N 2.85Å; G710-R712 PolarHBondContact O-N 3.17Å; R712-L714 PolarHBondContact O-N 3.37Å; R712-F715 PolarHBondContact O-N 3.2Å; R712-D716 HydrophobicContact CB-CB 4.36Å; R712-D716 IonicContact CZ-OD2 2.86Å; R712-D716 VanDerWaalsContact CZ-OD2 3.3Å; R712-D716 IonicContact NE-OD2 3.99Å; R712-D716 PolarHBondContact NE-OD2 3.29Å; R712-D716 IonicContact NH2-OD2 2.88Å; R712-D716 PolarHBondContact NH2-OD2 3.17Å; R712-D716 PolarHBondContact O-N 3.45Å
713	A	82.8	Confident	75.3	Confident	34 Å²	34	71.8 Å²	71.8	28%	0.281	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-60.7	-11.3	175.9	0	0	0	0	0	114.3	M706 L709 G710 N711	M706-A713 HydrophobicContact CE-CB 4.06Å; L709-A713 HydrophobicContact CB-CB 3.98Å; L709-A713 HydrophobicContact CD1-CB 4.12Å; G710-A713 PolarHBondContact O-N 3.4Å; N711-A713 VanDerWaalsContact C-N 3.26Å; N711-A713 PolarHBondContact O-N 3.22Å
714	L	81.7	Confident	74.5	Confident	120 Å²	120	70.4 Å²	70.4	63%	0.628	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-88.1	-10.2	175.4	-54.7	175	0	0	0	113.5	N711 R712	N711-L714 HydrophobicContact CB-CD1 4.41Å; N711-L714 WeakPolarHBondContact O-CB 3.33Å; N711-L714 PolarHBondContact O-N 3.45Å; R712-L714 PolarHBondContact O-N 3.37Å
715	F	72.1	Confident	73.6	Confident	162 Å²	162	72.5 Å²	72.5	71%	0.711	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.5	-42.4	-170.8	-52.3	-72.5	0	0	0	113.3	N711 R712	N711-F715 WeakPolarHBondContact O-CD2 3.45Å; R712-F715 PolarHBondContact O-N 3.2Å
716	D	66	Low	72.8	Confident	58 Å²	58	71 Å²	71	31%	0.31	39%	0.387	S	S	.	.			trans	-98	97.7	-176.8	-61.7	-14.2	0	0	0	109.5	R712 T718	R712-D716 HydrophobicContact CB-CB 4.36Å; R712-D716 IonicContact CZ-OD2 2.86Å; R712-D716 VanDerWaalsContact CZ-OD2 3.3Å; R712-D716 IonicContact NE-OD2 3.99Å; R712-D716 PolarHBondContact NE-OD2 3.29Å; R712-D716 IonicContact NH2-OD2 2.88Å; R712-D716 PolarHBondContact NH2-OD2 3.17Å; R712-D716 PolarHBondContact O-N 3.45Å; D716-T718 PolarHBondContact O-N 2.93Å; D716-T718 VanDerWaalsContact O-N 3.09Å
717	M	56.5	Low	71.8	Confident	171 Å²	171	71.5 Å²	71.5	84%	0.842	40%	0.396	S	S	*	.			trans	-75	16	173.6	-84.2	-62.5	-54.4	0	0	114	V719	M717-V719 PolarHBondContact O-N 3.01Å
718	T	57.7	Low	70.3	Confident	95 Å²	95	72.5 Å²	72.5	58%	0.583	40%	0.4	S	S	*	.			trans	-76.1	107.6	179.3	52	0	0	0	0	110.5	D716	D716-T718 PolarHBondContact O-N 2.93Å; D716-T718 VanDerWaalsContact O-N 3.09Å
719	V	55.4	Low	68.1	Low	121 Å²	121	75.5 Å²	75.5	73%	0.733	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-54.5	129.1	173.7	-177.8	0	0	0	0	109.7	M717 Q721	M717-V719 PolarHBondContact O-N 3.01Å; V719-Q721 PolarHBondContact O-N 3.41Å
720	P	52.6	Low	65.9	Low	34 Å²	34	77.6 Å²	77.6	22%	0.221	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-55.7	128.6	172.8	-27.6	36.8	0	0	0	111.1	H159 R705 L709	H159-P720 WeakPolarHBondContact CE1-CB 3.47Å; R705-P720 HydrophobicContact CG-CB 4.36Å; R705-P720 HydrophobicContact CG-CG 3.85Å; L709-P720 HydrophobicContact CD1-CG 4.36Å; L709-P720 HydrophobicContact CD2-CG 3.98Å; L709-P720 HydrophobicContact CG-CG 4.24Å
721	Q	55.9	Low	63.7	Low	163 Å²	163	79.1 Å²	79.1	76%	0.762	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-66	155.1	176.2	-61.7	-171	14.8	0	0	110.7	V719	V719-Q721 PolarHBondContact O-N 3.41Å
722	A	58.2	Low	62	Low	79 Å²	79	83.1 Å²	83.1	65%	0.653	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-62.3	149.7	170.5	0	0	0	0	0	110.2	A724	A722-A724 PolarHBondContact O-N 3.03Å
723	P	63.1	Low	60.8	Low	38 Å²	38	83.7 Å²	83.7	25%	0.247	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-60.2	128.9	-176.7	26.9	-37.4	0	0	0	111.5	E154 S155 R725	E154-P723 WeakPolarHBondContact O-CA 3.5Å; S155-P723 WeakPolarHBondContact O-CB 3.26Å; P723-R725 HydrophobicContact CB-CG 4.46Å; P723-R725 PolarHBondContact O-N 2.98Å
724	A	69	Low	60.1	Low	50 Å²	50	87.1 Å²	87.1	41%	0.413	52%	0.524	S	S	.	.			trans	-76.7	33.6	-170.9	0	0	0	0	0	114.8	E154 A722	E154-A724 HydrophobicContact CB-CB 3.87Å; E154-A724 PolarHBondContact O-N 2.9Å; A722-A724 PolarHBondContact O-N 3.03Å
725	R	69.8	Low	59.3	Low	53 Å²	53	86.5 Å²	86.5	20%	0.2	52%	0.517	C	S	.	.			trans	-76.9	139	-178.1	-55.2	-168.8	-155.1	171.3	12	111.6	S155 E160 E291 P723 V727	S155-R725 WeakPolarHBondContact O-CG 3.5Å; S155-R725 PolarHBondContact O-NE 2.95Å; E160-R725 IonicContact OE1-CZ 2.78Å; E160-R725 IonicContact OE1-NE 3.79Å; E160-R725 IonicContact OE1-NH2 3.48Å; E160-R725 PolarHBondContact OE1-NH2 3.08Å; E291-R725 VanDerWaalsContact OE1-CD 3.3Å; E291-R725 WeakPolarHBondContact OE1-CD 3.21Å; E291-R725 IonicContact OE1-CZ 3.91Å; E291-R725 IonicContact OE1-NE 2.93Å; E291-R725 IonicContact OE1-NH1 3.64Å; E291-R725 PolarHBondContact OE1-NH1 2.74Å; P723-R725 HydrophobicContact CB-CG 4.46Å; P723-R725 PolarHBondContact O-N 2.98Å; R725-V727 PolarHBondContact O-N 2.82Å; R725-V727 VanDerWaalsContact O-N 3.17Å
726	I	70.9	Confident	58.7	Low	30 Å²	30	83.8 Å²	83.8	15%	0.154	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	90.4	178.9	-55.5	159.1	0	0	0	108.2	P267 I271 W292 R294 F331 L728	P267-I726 HydrophobicContact CB-CD1 3.86Å; P267-I726 HydrophobicContact CB-CG1 4.48Å; P267-I726 HydrophobicContact CB-CG2 4.44Å; P267-I726 HydrophobicContact CG-CG2 4.47Å; I271-I726 HydrophobicContact CD1-CD1 4.45Å; I271-I726 HydrophobicContact CD1-CG2 3.8Å; W292-I726 HydrophobicContact CB-CB 4.44Å; W292-I726 PolarHBondContact N-O 3.49Å; W292-I726 WeakPolarHBondContact O-CA 3.31Å; W292-I726 VanDerWaalsContact O-CB 3.32Å; W292-I726 WeakPolarHBondContact O-CB 3.45Å; W292-I726 PolarHBondContact O-N 3Å; R294-I726 HydrophobicContact CB-CD1 3.89Å; F331-I726 HydrophobicContact CE1-CD1 4.22Å; I726-L728 HydrophobicContact CG2-CD2 3.72Å
727	V	64.4	Low	59	Low	108 Å²	108	85.9 Å²	85.9	66%	0.655	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	116.2	173.8	-177.7	0	0	0	0	109.3	R725 G729	R725-V727 PolarHBondContact O-N 2.82Å; R725-V727 VanDerWaalsContact O-N 3.17Å; V727-G729 PolarHBondContact O-N 3.13Å
728	L	58.9	Low	59.9	Low	35 Å²	35	82.7 Å²	82.7	18%	0.183	50%	0.5	C	S	.	.			trans	-83.7	94.8	179.4	-56.4	-169.7	0	0	0	110.2	M268 I271 T290 W292 I726 G730	M268-L728 HydrophobicContact CE-CD1 4.34Å; M268-L728 HydrophobicContact SD-CD1 4.01Å; M268-L728 HydrophobicContact SD-CD2 3.37Å; M268-L728 WeakPolarHBondContact SD-CD2 3.32Å; M268-L728 HydrophobicContact SD-CG 4.31Å; I271-L728 HydrophobicContact CD1-CD2 4.2Å; I271-L728 HydrophobicContact CG2-CD1 4.27Å; T290-L728 PolarHBondContact O-N 2.81Å; W292-L728 HydrophobicContact CG-CD1 4.48Å; I726-L728 HydrophobicContact CG2-CD2 3.72Å; L728-G730 PolarHBondContact O-N 2.89Å
729	G	44.9	Very low	60.5	Low	77 Å²	77	85.3 Å²	85.3	79%	0.794	50%	0.5	S	S	*	.			trans	-67.1	66.3	164.6	0	0	0	0	0	111.4	V727	V727-G729 PolarHBondContact O-N 3.13Å
730	G	40.2	Very low	61.3	Low	72 Å²	72	82.9 Å²	82.9	74%	0.742	49%	0.485	S	S	*	.			trans	-130.6	31.7	-162.3	0	0	0	0	0	115	L728	L728-G730 PolarHBondContact O-N 2.89Å
731	G	44.8	Very low	62.5	Low	41 Å²	41	86.9 Å²	86.9	42%	0.423	50%	0.501	S	S	.	.	S	Bend	trans	-135.1	151.7	168.2	0	0	0	0	0	110.2	T733	G731-T733 PolarHBondContact O-N 3.31Å
732	N	53.3	Low	63.7	Low	103 Å²	103	84.8 Å²	84.8	55%	0.551	49%	0.494	S	S	*	.			trans	-50.3	134.1	176	-75.7	4.6	0	0	0	109.7	E734 Q735 M736	N732-E734 PolarHBondContact O-N 3.13Å; N732-E734 VanDerWaalsContact O-N 3.14Å; N732-Q735 HydrophobicContact CB-CB 4.31Å; N732-Q735 HydrophobicContact CB-CG 4.11Å; N732-Q735 WeakPolarHBondContact O-CA 3.34Å; N732-Q735 WeakPolarHBondContact O-CB 3.24Å; N732-Q735 PolarHBondContact O-N 2.92Å; N732-M736 PolarHBondContact O-N 3.02Å
733	T	59.7	Low	64.5	Low	114 Å²	114	83.9 Å²	83.9	70%	0.699	49%	0.487	S	S	*	.	H	α-helix	trans	-53.7	-37.2	177.8	47.7	0	0	0	0	111.5	G731 M736 L737	G731-T733 PolarHBondContact O-N 3.31Å; T733-M736 PolarHBondContact O-N 3.07Å; T733-L737 WeakPolarHBondContact O-CB 3.47Å; T733-L737 VanDerWaalsContact O-CG 3.31Å; T733-L737 WeakPolarHBondContact O-CG 3.31Å; T733-L737 PolarHBondContact O-N 2.87Å
734	E	67	Low	65.1	Low	106 Å²	106	87.1 Å²	87.1	50%	0.495	50%	0.499	S	S	.	.	H	α-helix	trans	-59.5	-40.5	171.4	-167.1	-161.2	158	0	0	114	N732 K738	N732-E734 PolarHBondContact O-N 3.13Å; N732-E734 VanDerWaalsContact O-N 3.14Å; E734-K738 HydrophobicContact CG-CD 4.43Å; E734-K738 WeakPolarHBondContact O-CB 3.28Å; E734-K738 VanDerWaalsContact O-CG 3.27Å; E734-K738 WeakPolarHBondContact O-CG 3.38Å; E734-K738 PolarHBondContact O-N 2.95Å; E734-K738 WeakPolarHBondContact OE1-CE 3.34Å; E734-K738 IonicContact OE1-NZ 2.95Å; E734-K738 PolarHBondContact OE1-NZ 3.49Å
735	Q	65.6	Low	65.7	Low	106 Å²	106	87.3 Å²	87.3	50%	0.495	50%	0.5	S	S	.	.	H	α-helix	trans	-71.8	-35	175	-71.8	-178.1	3.6	0	0	111.7	N732 R739	N732-Q735 HydrophobicContact CB-CB 4.31Å; N732-Q735 HydrophobicContact CB-CG 4.11Å; N732-Q735 WeakPolarHBondContact O-CA 3.34Å; N732-Q735 WeakPolarHBondContact O-CB 3.24Å; N732-Q735 PolarHBondContact O-N 2.92Å; Q735-R739 WeakPolarHBondContact O-CG 3.46Å; Q735-R739 PolarHBondContact O-N 3.13Å
736	M	59.2	Low	66.2	Low	106 Å²	106	88.7 Å²	88.7	52%	0.522	51%	0.514	S	S	.	.	H	α-helix	trans	-65.9	-45.3	174.3	-165.6	-171.4	-59.8	0	0	110.7	N732 T733 R739 V740	N732-M736 PolarHBondContact O-N 3.02Å; T733-M736 PolarHBondContact O-N 3.07Å; M736-R739 WeakPolarHBondContact O-CB 3.31Å; M736-R739 PolarHBondContact O-N 3.43Å; M736-V740 WeakPolarHBondContact O-CG2 3.39Å; M736-V740 PolarHBondContact O-N 3.01Å
737	L	71.8	Confident	66.6	Low	102 Å²	102	92.8 Å²	92.8	53%	0.534	53%	0.531	S	S	.	.	H	α-helix	trans	-58.8	-48.9	173.5	-73.9	167	0	0	0	111.2	T733 R739 V740 E741	T733-L737 WeakPolarHBondContact O-CB 3.47Å; T733-L737 VanDerWaalsContact O-CG 3.31Å; T733-L737 WeakPolarHBondContact O-CG 3.31Å; T733-L737 PolarHBondContact O-N 2.87Å; L737-R739 VanDerWaalsContact C-N 3.27Å; L737-R739 PolarHBondContact O-N 2.97Å; L737-V740 CarbonylContact O-C 3.59Å; L737-V740 WeakPolarHBondContact O-CA 3.49Å; L737-V740 WeakPolarHBondContact O-CB 3.37Å; L737-V740 PolarHBondContact O-N 3.25Å; L737-E741 WeakPolarHBondContact O-CG 3.29Å; L737-E741 PolarHBondContact O-N 3.18Å
738	K	76	Confident	67.3	Low	103 Å²	103	93.7 Å²	93.7	45%	0.448	53%	0.528	S	S	.	.	H	α-helix	trans	-59.5	-34.2	175	-74.1	169.3	178.8	177	0	113.3	E734 L742	E734-K738 HydrophobicContact CG-CD 4.43Å; E734-K738 WeakPolarHBondContact O-CB 3.28Å; E734-K738 VanDerWaalsContact O-CG 3.27Å; E734-K738 WeakPolarHBondContact O-CG 3.38Å; E734-K738 PolarHBondContact O-N 2.95Å; E734-K738 WeakPolarHBondContact OE1-CE 3.34Å; E734-K738 IonicContact OE1-NZ 2.95Å; E734-K738 PolarHBondContact OE1-NZ 3.49Å; K738-L742 VanDerWaalsContact O-CB 3.3Å; K738-L742 WeakPolarHBondContact O-CB 3.46Å; K738-L742 WeakPolarHBondContact O-CD1 3.4Å; K738-L742 WeakPolarHBondContact O-CG 3.44Å; K738-L742 PolarHBondContact O-N 3.45Å
739	R	69.7	Low	68.4	Low	150 Å²	150	98.7 Å²	98.7	57%	0.566	55%	0.548	S	S	*	.	H	α-helix	trans	-69	-37.9	172.1	-76.1	176.4	-179.3	-176.3	1.6	112.1	Q735 M736 L737 A743	Q735-R739 WeakPolarHBondContact O-CG 3.46Å; Q735-R739 PolarHBondContact O-N 3.13Å; M736-R739 WeakPolarHBondContact O-CB 3.31Å; M736-R739 PolarHBondContact O-N 3.43Å; L737-R739 VanDerWaalsContact C-N 3.27Å; L737-R739 PolarHBondContact O-N 2.97Å; R739-A743 VanDerWaalsContact O-CB 3.24Å; R739-A743 WeakPolarHBondContact O-CB 3.26Å; R739-A743 PolarHBondContact O-N 3.27Å
740	V	73.6	Confident	70.2	Confident	71 Å²	71	99.7 Å²	99.7	43%	0.43	54%	0.535	S	S	.	.	H	α-helix	trans	-66.9	-48.7	174	172.2	0	0	0	0	110.7	M736 L737 L742 A743 E744	M736-V740 WeakPolarHBondContact O-CG2 3.39Å; M736-V740 PolarHBondContact O-N 3.01Å; L737-V740 CarbonylContact O-C 3.59Å; L737-V740 WeakPolarHBondContact O-CA 3.49Å; L737-V740 WeakPolarHBondContact O-CB 3.37Å; L737-V740 PolarHBondContact O-N 3.25Å; V740-L742 VanDerWaalsContact C-N 3.34Å; V740-L742 PolarHBondContact O-N 2.87Å; V740-A743 CarbonylContact O-C 3.47Å; V740-A743 PolarHBondContact O-N 3.29Å; V740-A743 VanDerWaalsContact O-N 3.09Å; V740-E744 HydrophobicContact CG1-CG 4.37Å; V740-E744 WeakPolarHBondContact O-CB 3.4Å; V740-E744 WeakPolarHBondContact O-CG 3.31Å; V740-E744 PolarHBondContact O-N 2.83Å
741	E	77.8	Confident	71.9	Confident	118 Å²	118	101.2 Å²	101.2	55%	0.551	52%	0.523	S	S	*	.	H	α-helix	trans	-56.6	-44.7	175.7	-69.9	165.9	-178.8	0	0	111.9	L737 E744 A745	L737-E741 WeakPolarHBondContact O-CG 3.29Å; L737-E741 PolarHBondContact O-N 3.18Å; E741-E744 PolarHBondContact O-N 3.49Å; E741-A745 WeakPolarHBondContact O-CB 3.41Å; E741-A745 PolarHBondContact O-N 2.93Å
742	L	80.4	Confident	73.6	Confident	119 Å²	119	105.4 Å²	105.4	62%	0.623	53%	0.529	S	S	*	.	H	α-helix	trans	-66.2	-39.9	174.4	-74.4	170.6	0	0	0	112.3	K738 V740 A745 V746	K738-L742 VanDerWaalsContact O-CB 3.3Å; K738-L742 WeakPolarHBondContact O-CB 3.46Å; K738-L742 WeakPolarHBondContact O-CD1 3.4Å; K738-L742 WeakPolarHBondContact O-CG 3.44Å; K738-L742 PolarHBondContact O-N 3.45Å; V740-L742 VanDerWaalsContact C-N 3.34Å; V740-L742 PolarHBondContact O-N 2.87Å; L742-A745 PolarHBondContact O-N 3.2Å; L742-V746 WeakPolarHBondContact O-CB 3.25Å; L742-V746 VanDerWaalsContact O-CG2 3.28Å; L742-V746 WeakPolarHBondContact O-CG2 3.06Å; L742-V746 PolarHBondContact O-N 2.67Å
743	A	74.2	Confident	75	Confident	60 Å²	60	104.4 Å²	104.4	50%	0.496	52%	0.521	S	S	.	.	H	α-helix	trans	-66.5	-36.2	175.6	0	0	0	0	0	112	R739 V740 K747	R739-A743 VanDerWaalsContact O-CB 3.24Å; R739-A743 WeakPolarHBondContact O-CB 3.26Å; R739-A743 PolarHBondContact O-N 3.27Å; V740-A743 CarbonylContact O-C 3.47Å; V740-A743 PolarHBondContact O-N 3.29Å; V740-A743 VanDerWaalsContact O-N 3.09Å; A743-K747 WeakPolarHBondContact O-CB 3.5Å; A743-K747 PolarHBondContact O-N 2.86Å
744	E	75.8	Confident	75.9	Confident	106 Å²	106	105.7 Å²	105.7	50%	0.495	52%	0.518	S	S	.	.	H	α-helix	trans	-69.5	-41.1	174	-73.6	-172.3	164.7	0	0	111.9	V740 E741 K747 Q748	V740-E744 HydrophobicContact CG1-CG 4.37Å; V740-E744 WeakPolarHBondContact O-CB 3.4Å; V740-E744 WeakPolarHBondContact O-CG 3.31Å; V740-E744 PolarHBondContact O-N 2.83Å; E741-E744 PolarHBondContact O-N 3.49Å; E744-K747 WeakPolarHBondContact O-CB 2.99Å; E744-K747 PolarHBondContact O-N 2.91Å; E744-Q748 WeakPolarHBondContact O-CB 3.31Å; E744-Q748 VanDerWaalsContact O-CG 3.29Å; E744-Q748 WeakPolarHBondContact O-CG 3.32Å; E744-Q748 PolarHBondContact O-N 3.42Å
745	A	82.1	Confident	76.6	Confident	53 Å²	53	107.4 Å²	107.4	44%	0.438	52%	0.524	S	S	.	.	H	α-helix	trans	-64.7	-41.3	173.7	0	0	0	0	0	112.2	E741 L742 Q748 K749	E741-A745 WeakPolarHBondContact O-CB 3.41Å; E741-A745 PolarHBondContact O-N 2.93Å; L742-A745 PolarHBondContact O-N 3.2Å; A745-Q748 PolarHBondContact O-N 3.17Å; A745-K749 WeakPolarHBondContact O-CB 3.26Å; A745-K749 PolarHBondContact O-N 3.16Å
746	V	80.7	Confident	77.4	Confident	83 Å²	83	106.6 Å²	106.6	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-65.2	-42.3	172.9	168.5	0	0	0	0	110.8	L742 K749 L750	L742-V746 WeakPolarHBondContact O-CB 3.25Å; L742-V746 VanDerWaalsContact O-CG2 3.28Å; L742-V746 WeakPolarHBondContact O-CG2 3.06Å; L742-V746 PolarHBondContact O-N 2.67Å; V746-K749 PolarHBondContact O-N 3.27Å; V746-L750 HydrophobicContact CG1-CD1 3.87Å; V746-L750 HydrophobicContact CG1-CG 4.36Å; V746-L750 WeakPolarHBondContact O-CB 3.48Å; V746-L750 WeakPolarHBondContact O-CG 3.4Å; V746-L750 PolarHBondContact O-N 2.75Å
747	K	79.4	Confident	78.6	Confident	116 Å²	116	106.6 Å²	106.6	50%	0.504	52%	0.521	S	S	.	.	H	α-helix	trans	-59.3	-48.9	174.4	175.5	-171.3	162.6	-170	0	111.4	A743 E744 K749 L750 E751	A743-K747 WeakPolarHBondContact O-CB 3.5Å; A743-K747 PolarHBondContact O-N 2.86Å; E744-K747 WeakPolarHBondContact O-CB 2.99Å; E744-K747 PolarHBondContact O-N 2.91Å; K747-K749 VanDerWaalsContact C-N 3.29Å; K747-K749 PolarHBondContact O-N 2.96Å; K747-L750 CarbonylContact O-C 3.11Å; K747-L750 PolarHBondContact O-N 2.77Å; K747-L750 VanDerWaalsContact O-N 3.11Å; K747-E751 VanDerWaalsContact CE-CD 3.46Å; K747-E751 WeakPolarHBondContact CE-OE1 3.43Å; K747-E751 HydrophobicContact CG-CG 4.3Å; K747-E751 IonicContact NZ-OE1 3.33Å; K747-E751 WeakPolarHBondContact O-CB 3.48Å; K747-E751 WeakPolarHBondContact O-CG 3.38Å; K747-E751 PolarHBondContact O-N 2.9Å
748	Q	78.8	Confident	79	Confident	127 Å²	127	108.2 Å²	108.2	59%	0.593	52%	0.524	S	S	*	.	H	α-helix	trans	-59.4	-40.5	177.2	-72.8	171.4	23	0	0	111.8	E744 A745 E751 F752	E744-Q748 WeakPolarHBondContact O-CB 3.31Å; E744-Q748 VanDerWaalsContact O-CG 3.29Å; E744-Q748 WeakPolarHBondContact O-CG 3.32Å; E744-Q748 PolarHBondContact O-N 3.42Å; A745-Q748 PolarHBondContact O-N 3.17Å; Q748-E751 PolarHBondContact O-N 3.27Å; Q748-F752 WeakPolarHBondContact O-CB 3.42Å; Q748-F752 PolarHBondContact O-N 2.65Å
749	K	82.3	Confident	79.4	Confident	139 Å²	139	106.7 Å²	106.7	60%	0.604	52%	0.52	S	S	*	.	H	α-helix	trans	-63.8	-41.9	174.2	-172.9	-179.4	178.6	-175.7	0	112	A745 V746 K747 F752 Q753	A745-K749 WeakPolarHBondContact O-CB 3.26Å; A745-K749 PolarHBondContact O-N 3.16Å; V746-K749 PolarHBondContact O-N 3.27Å; K747-K749 VanDerWaalsContact C-N 3.29Å; K747-K749 PolarHBondContact O-N 2.96Å; K749-F752 PolarHBondContact O-N 2.72Å; K749-Q753 WeakPolarHBondContact O-CB 3.16Å; K749-Q753 WeakPolarHBondContact O-CG 3.47Å; K749-Q753 PolarHBondContact O-N 3.43Å
750	L	81.6	Confident	80.1	Confident	99 Å²	99	105.6 Å²	105.6	52%	0.518	52%	0.522	S	S	.	.	H	α-helix	trans	-68.6	-37.8	176	-72.6	170.3	0	0	0	112.4	V746 K747 Q753 F754	V746-L750 HydrophobicContact CG1-CD1 3.87Å; V746-L750 HydrophobicContact CG1-CG 4.36Å; V746-L750 WeakPolarHBondContact O-CB 3.48Å; V746-L750 WeakPolarHBondContact O-CG 3.4Å; V746-L750 PolarHBondContact O-N 2.75Å; K747-L750 CarbonylContact O-C 3.11Å; K747-L750 PolarHBondContact O-N 2.77Å; K747-L750 VanDerWaalsContact O-N 3.11Å; L750-Q753 PolarHBondContact O-N 2.9Å; L750-F754 WeakPolarHBondContact O-CB 3.42Å; L750-F754 PolarHBondContact O-N 3.12Å
751	E	76.1	Confident	80.6	Confident	104 Å²	104	106.5 Å²	106.5	49%	0.486	52%	0.524	S	S	.	.	H	α-helix	trans	-65.1	-39.6	174.4	-74.9	173.8	154.8	0	0	111	K747 Q748 F754 F755	K747-E751 VanDerWaalsContact CE-CD 3.46Å; K747-E751 WeakPolarHBondContact CE-OE1 3.43Å; K747-E751 HydrophobicContact CG-CG 4.3Å; K747-E751 IonicContact NZ-OE1 3.33Å; K747-E751 WeakPolarHBondContact O-CB 3.48Å; K747-E751 WeakPolarHBondContact O-CG 3.38Å; K747-E751 PolarHBondContact O-N 2.9Å; Q748-E751 PolarHBondContact O-N 3.27Å; E751-F754 PolarHBondContact O-N 3.5Å; E751-F755 WeakPolarHBondContact O-CB 3.38Å; E751-F755 PolarHBondContact O-N 2.91Å
752	F	81.2	Confident	80.8	Confident	128 Å²	128	105 Å²	105	56%	0.561	52%	0.517	S	S	*	.	H	α-helix	trans	-66.6	-44.7	172.6	-176.8	-98.6	0	0	0	112.5	Q748 K749 F754 F755 Q756	Q748-F752 WeakPolarHBondContact O-CB 3.42Å; Q748-F752 PolarHBondContact O-N 2.65Å; K749-F752 PolarHBondContact O-N 2.72Å; F752-F754 VanDerWaalsContact C-N 3.33Å; F752-F754 PolarHBondContact O-N 3.13Å; F752-F755 WeakPolarHBondContact O-CB 3.21Å; F752-F755 PolarHBondContact O-N 3.16Å; F752-Q756 HydrophobicContact CD1-CG 4.45Å; F752-Q756 VanDerWaalsContact CE1-CD 3.47Å; F752-Q756 HydrophobicContact CE1-CG 4.12Å; F752-Q756 HydrophobicContact CZ-CG 4.39Å; F752-Q756 WeakPolarHBondContact O-CG 3.42Å; F752-Q756 PolarHBondContact O-N 3.02Å
753	Q	81.3	Confident	81	Confident	82 Å²	82	104.7 Å²	104.7	38%	0.383	51%	0.51	S	S	.	.	H	α-helix	trans	-63.4	-38.6	174.2	-74.7	-179.6	-50.1	0	0	111.9	K749 L750 F755 Q756 I757	K749-Q753 WeakPolarHBondContact O-CB 3.16Å; K749-Q753 WeakPolarHBondContact O-CG 3.47Å; K749-Q753 PolarHBondContact O-N 3.43Å; L750-Q753 PolarHBondContact O-N 2.9Å; Q753-F755 VanDerWaalsContact C-N 3.34Å; Q753-Q756 PolarHBondContact O-N 3.26Å; Q753-I757 WeakPolarHBondContact O-CB 3.47Å; Q753-I757 VanDerWaalsContact O-CG1 3.25Å; Q753-I757 WeakPolarHBondContact O-CG1 3.42Å; Q753-I757 PolarHBondContact O-N 3.22Å
754	F	80	Confident	81.5	Confident	142 Å²	142	105.4 Å²	105.4	62%	0.623	51%	0.508	S	S	*	.	H	α-helix	trans	-65.1	-37.7	174.6	-176.1	-96.3	0	0	0	111.8	L750 E751 F752 I757 K758	L750-F754 WeakPolarHBondContact O-CB 3.42Å; L750-F754 PolarHBondContact O-N 3.12Å; E751-F754 PolarHBondContact O-N 3.5Å; F752-F754 VanDerWaalsContact C-N 3.33Å; F752-F754 PolarHBondContact O-N 3.13Å; F754-I757 PolarHBondContact O-N 3.32Å; F754-K758 VanDerWaalsContact O-CB 3.26Å; F754-K758 WeakPolarHBondContact O-CB 3.48Å; F754-K758 PolarHBondContact O-N 3.33Å
755	F	80.8	Confident	81.9	Confident	141 Å²	141	104.6 Å²	104.6	62%	0.618	50%	0.501	S	S	*	.	H	α-helix	trans	-62.6	-45.3	172	-177.7	-91	0	0	0	111.9	E751 F752 Q753 K758 D759	E751-F755 WeakPolarHBondContact O-CB 3.38Å; E751-F755 PolarHBondContact O-N 2.91Å; F752-F755 WeakPolarHBondContact O-CB 3.21Å; F752-F755 PolarHBondContact O-N 3.16Å; Q753-F755 VanDerWaalsContact C-N 3.34Å; F755-K758 PolarHBondContact O-N 3.44Å; F755-D759 WeakPolarHBondContact O-CB 3.5Å; F755-D759 PolarHBondContact O-N 2.63Å
756	Q	82.8	Confident	82	Confident	90 Å²	90	106.3 Å²	106.3	42%	0.421	51%	0.506	S	S	.	.	H	α-helix	trans	-60.4	-48.4	174.4	-68.9	-178.4	-51.1	0	0	111.9	F752 Q753 K758 D759 E760	F752-Q756 HydrophobicContact CD1-CG 4.45Å; F752-Q756 VanDerWaalsContact CE1-CD 3.47Å; F752-Q756 HydrophobicContact CE1-CG 4.12Å; F752-Q756 HydrophobicContact CZ-CG 4.39Å; F752-Q756 WeakPolarHBondContact O-CG 3.42Å; F752-Q756 PolarHBondContact O-N 3.02Å; Q753-Q756 PolarHBondContact O-N 3.26Å; Q756-K758 VanDerWaalsContact C-N 3.29Å; Q756-K758 PolarHBondContact O-N 3.42Å; Q756-D759 PolarHBondContact O-N 2.99Å; Q756-E760 PolarHBondContact O-N 3.09Å
757	I	83.8	Confident	82.3	Confident	106 Å²	106	108.3 Å²	108.3	54%	0.544	51%	0.508	S	S	.	.	H	α-helix	trans	-62.1	-36.3	177.9	-69	164.6	0	0	0	111.2	Q753 F754 L761	Q753-I757 WeakPolarHBondContact O-CB 3.47Å; Q753-I757 VanDerWaalsContact O-CG1 3.25Å; Q753-I757 WeakPolarHBondContact O-CG1 3.42Å; Q753-I757 PolarHBondContact O-N 3.22Å; F754-I757 PolarHBondContact O-N 3.32Å; I757-L761 WeakPolarHBondContact O-CB 3.32Å; I757-L761 PolarHBondContact O-N 3.18Å
758	K	81.2	Confident	82.7	Confident	136 Å²	136	106 Å²	106	59%	0.591	50%	0.503	S	S	*	.	H	α-helix	trans	-68.2	-40	176.4	-176	173.6	-179.9	177.7	0	112.4	F754 F755 Q756 L761 E762	F754-K758 VanDerWaalsContact O-CB 3.26Å; F754-K758 WeakPolarHBondContact O-CB 3.48Å; F754-K758 PolarHBondContact O-N 3.33Å; F755-K758 PolarHBondContact O-N 3.44Å; Q756-K758 VanDerWaalsContact C-N 3.29Å; Q756-K758 PolarHBondContact O-N 3.42Å; K758-L761 PolarHBondContact O-N 3.01Å; K758-E762 PolarHBondContact O-N 3.29Å
759	D	83.7	Confident	82.9	Confident	70 Å²	70	103 Å²	103	37%	0.374	49%	0.491	S	S	.	.	H	α-helix	trans	-67.1	-40.5	174.6	171.1	51.7	0	0	0	111.8	F755 Q756 E762 K763	F755-D759 WeakPolarHBondContact O-CB 3.5Å; F755-D759 PolarHBondContact O-N 2.63Å; Q756-D759 PolarHBondContact O-N 2.99Å; D759-E762 PolarHBondContact O-N 2.82Å; D759-K763 WeakPolarHBondContact O-CB 3.49Å; D759-K763 WeakPolarHBondContact O-CD 3.38Å; D759-K763 VanDerWaalsContact O-CG 3.26Å; D759-K763 WeakPolarHBondContact O-CG 3.21Å; D759-K763 PolarHBondContact O-N 3.15Å; D759-K763 WeakPolarHBondContact OD1-CE 3.34Å; D759-K763 IonicContact OD1-NZ 3.22Å; D759-K763 PolarHBondContact OD1-NZ 3.2Å; D759-K763 IonicContact OD2-NZ 2.76Å; D759-K763 PolarHBondContact OD2-NZ 3.44Å
760	E	84.7	Confident	83.1	Confident	127 Å²	127	99.1 Å²	99.1	59%	0.593	48%	0.481	S	S	*	.	H	α-helix	trans	-67.1	-36.6	171.6	-71.1	-174	172.5	0	0	113.1	Q756 K763 T764	Q756-E760 PolarHBondContact O-N 3.09Å; E760-K763 PolarHBondContact O-N 2.69Å; E760-T764 WeakPolarHBondContact O-CB 3.37Å; E760-T764 WeakPolarHBondContact O-CG2 3.46Å; E760-T764 PolarHBondContact O-N 3.48Å; E760-T764 PolarHBondContact O-OG1 2.9Å
761	L	84	Confident	83.4	Confident	91 Å²	91	101 Å²	101	48%	0.476	49%	0.486	S	S	.	.	H	α-helix	trans	-63.8	-42.9	174.6	-177.2	63.7	0	0	0	111.2	I757 K758 T764 R765	I757-L761 WeakPolarHBondContact O-CB 3.32Å; I757-L761 PolarHBondContact O-N 3.18Å; K758-L761 PolarHBondContact O-N 3.01Å; L761-T764 WeakPolarHBondContact CA-OG1 3.42Å; L761-T764 PolarHBondContact O-N 2.9Å; L761-T764 PolarHBondContact O-OG1 3.22Å; L761-R765 WeakPolarHBondContact O-CB 3.44Å; L761-R765 PolarHBondContact O-N 3.11Å
762	E	82.2	Confident	83.9	Confident	86 Å²	86	98.7 Å²	98.7	40%	0.402	47%	0.474	S	S	.	.	H	α-helix	trans	-70.6	-40.6	178	-162.9	56.8	-135.6	0	0	111.2	K758 D759 T764 R765 V766	K758-E762 PolarHBondContact O-N 3.29Å; D759-E762 PolarHBondContact O-N 2.82Å; E762-T764 VanDerWaalsContact C-N 3.32Å; E762-T764 PolarHBondContact O-N 3.17Å; E762-R765 PolarHBondContact O-N 3.37Å; E762-R765 WeakPolarHBondContact OE1-CD 3.37Å; E762-R765 IonicContact OE1-CZ 3.68Å; E762-R765 IonicContact OE1-NE 3.62Å; E762-R765 IonicContact OE1-NH1 3.27Å; E762-R765 WeakPolarHBondContact OE2-CD 3.19Å; E762-R765 IonicContact OE2-CZ 2.75Å; E762-R765 IonicContact OE2-NE 2.68Å; E762-R765 IonicContact OE2-NH1 2.76Å; E762-R765 PolarHBondContact OE2-NH1 3.05Å; E762-V766 WeakPolarHBondContact O-CG2 3.43Å; E762-V766 PolarHBondContact O-N 3.28Å
763	K	85.4	Confident	84.3	Confident	113 Å²	113	98 Å²	98	49%	0.491	48%	0.476	S	S	.	.	H	α-helix	trans	-60.3	-37.1	172.5	-74.1	165.8	-176.4	163.4	0	113.3	D759 E760 K767	D759-K763 WeakPolarHBondContact O-CB 3.49Å; D759-K763 WeakPolarHBondContact O-CD 3.38Å; D759-K763 VanDerWaalsContact O-CG 3.26Å; D759-K763 WeakPolarHBondContact O-CG 3.21Å; D759-K763 PolarHBondContact O-N 3.15Å; D759-K763 WeakPolarHBondContact OD1-CE 3.34Å; D759-K763 IonicContact OD1-NZ 3.22Å; D759-K763 PolarHBondContact OD1-NZ 3.2Å; D759-K763 IonicContact OD2-NZ 2.76Å; D759-K763 PolarHBondContact OD2-NZ 3.44Å; E760-K763 PolarHBondContact O-N 2.69Å; K763-K767 WeakPolarHBondContact O-CG 3.37Å; K763-K767 PolarHBondContact O-N 3.05Å
764	T	84.7	Confident	84.6	Confident	74 Å²	74	97.1 Å²	97.1	45%	0.454	48%	0.477	S	S	.	.	H	α-helix	trans	-76.7	-36.9	176.4	47.9	0	0	0	0	111.8	E760 L761 E762 K767 V768	E760-T764 WeakPolarHBondContact O-CB 3.37Å; E760-T764 WeakPolarHBondContact O-CG2 3.46Å; E760-T764 PolarHBondContact O-N 3.48Å; E760-T764 PolarHBondContact O-OG1 2.9Å; L761-T764 WeakPolarHBondContact CA-OG1 3.42Å; L761-T764 PolarHBondContact O-N 2.9Å; L761-T764 PolarHBondContact O-OG1 3.22Å; E762-T764 VanDerWaalsContact C-N 3.32Å; E762-T764 PolarHBondContact O-N 3.17Å; T764-K767 WeakPolarHBondContact O-CB 3.47Å; T764-K767 PolarHBondContact O-N 3.18Å; T764-V768 WeakPolarHBondContact O-CG2 3.33Å; T764-V768 PolarHBondContact O-N 2.94Å
765	R	82.7	Confident	85	Confident	89 Å²	89	95 Å²	95	34%	0.336	47%	0.468	S	S	.	.	H	α-helix	trans	-60.9	-44.7	172.6	176.5	-178.1	166.7	-171.3	3.1	113.1	G685 L761 E762 K767 V768 N769	G685-R765 VanDerWaalsContact C-NH2 3.35Å; G685-R765 VanDerWaalsContact CA-NH2 3.3Å; G685-R765 PolarHBondContact O-NH2 3.09Å; L761-R765 WeakPolarHBondContact O-CB 3.44Å; L761-R765 PolarHBondContact O-N 3.11Å; E762-R765 PolarHBondContact O-N 3.37Å; E762-R765 WeakPolarHBondContact OE1-CD 3.37Å; E762-R765 IonicContact OE1-CZ 3.68Å; E762-R765 IonicContact OE1-NE 3.62Å; E762-R765 IonicContact OE1-NH1 3.27Å; E762-R765 WeakPolarHBondContact OE2-CD 3.19Å; E762-R765 IonicContact OE2-CZ 2.75Å; E762-R765 IonicContact OE2-NE 2.68Å; E762-R765 IonicContact OE2-NH1 2.76Å; E762-R765 PolarHBondContact OE2-NH1 3.05Å; R765-K767 VanDerWaalsContact C-N 3.32Å; R765-K767 PolarHBondContact O-N 3.29Å; R765-V768 PolarHBondContact O-N 2.94Å; R765-N769 PolarHBondContact O-N 3.5Å
766	V	85.5	Confident	85.5	Confident	89 Å²	89	92.2 Å²	92.2	54%	0.539	46%	0.46	S	S	.	.	H	α-helix	trans	-59	-43.5	174.5	169.8	0	0	0	0	111	E762 N769 S770	E762-V766 WeakPolarHBondContact O-CG2 3.43Å; E762-V766 PolarHBondContact O-N 3.28Å; V766-N769 PolarHBondContact O-N 3.35Å; V766-S770 PolarHBondContact O-N 3.08Å
767	K	86.7	Confident	85.8	Confident	125 Å²	125	93.9 Å²	93.9	54%	0.543	47%	0.468	S	S	.	.	H	α-helix	trans	-61.9	-47.2	173.9	-69.6	172.4	-176.7	178.6	0	111.9	K763 T764 R765 N769 S770 F771	K763-K767 WeakPolarHBondContact O-CG 3.37Å; K763-K767 PolarHBondContact O-N 3.05Å; T764-K767 WeakPolarHBondContact O-CB 3.47Å; T764-K767 PolarHBondContact O-N 3.18Å; R765-K767 VanDerWaalsContact C-N 3.32Å; R765-K767 PolarHBondContact O-N 3.29Å; K767-N769 VanDerWaalsContact C-N 3.29Å; K767-N769 PolarHBondContact O-N 3.31Å; K767-S770 PolarHBondContact O-N 3.05Å; K767-S770 PolarHBondContact O-OG 3.14Å; K767-F771 HydrophobicContact CB-CE2 4.22Å; K767-F771 VanDerWaalsContact O-CD2 3.23Å; K767-F771 WeakPolarHBondContact O-CD2 3.46Å; K767-F771 WeakPolarHBondContact O-CG 3.49Å; K767-F771 PolarHBondContact O-N 2.86Å
768	V	86.8	Confident	86.2	Confident	67 Å²	67	93.2 Å²	93.2	41%	0.406	47%	0.465	S	S	.	.	H	α-helix	trans	-58	-40	177.8	164.1	0	0	0	0	111.8	T764 R765 F771 K772	T764-V768 WeakPolarHBondContact O-CG2 3.33Å; T764-V768 PolarHBondContact O-N 2.94Å; R765-V768 PolarHBondContact O-N 2.94Å; V768-F771 PolarHBondContact O-N 3.36Å; V768-K772 WeakPolarHBondContact O-CG 3.37Å; V768-K772 PolarHBondContact O-N 3.05Å
769	N	84.5	Confident	86.7	Confident	66 Å²	66	91.7 Å²	91.7	35%	0.353	46%	0.455	S	S	.	.	H	α-helix	trans	-65.8	-49.2	174.8	-73.5	-4.8	0	0	0	111.5	R765 V766 K767 F771 K772 D773	R765-N769 PolarHBondContact O-N 3.5Å; V766-N769 PolarHBondContact O-N 3.35Å; K767-N769 VanDerWaalsContact C-N 3.29Å; K767-N769 PolarHBondContact O-N 3.31Å; N769-F771 PolarHBondContact O-N 2.7Å; N769-F771 VanDerWaalsContact O-N 3.15Å; N769-K772 WeakPolarHBondContact O-CA 3.36Å; N769-K772 WeakPolarHBondContact O-CB 3.49Å; N769-K772 PolarHBondContact O-N 3.43Å; N769-K772 PolarHBondContact OD1-NZ 2.83Å; N769-D773 VanDerWaalsContact O-CG 3.28Å; N769-D773 PolarHBondContact O-N 2.77Å
770	S	85.9	Confident	87	Confident	56 Å²	56	90.6 Å²	90.6	39%	0.392	46%	0.456	S	S	.	.	H	α-helix	trans	-57.5	-33.2	176	66.2	0	0	0	0	113.4	V766 K767 T774	V766-S770 PolarHBondContact O-N 3.08Å; K767-S770 PolarHBondContact O-N 3.05Å; K767-S770 PolarHBondContact O-OG 3.14Å; S770-T774 PolarHBondContact O-N 2.93Å; S770-T774 PolarHBondContact O-OG1 3.21Å
771	F	88	Confident	87.4	Confident	139 Å²	139	89.7 Å²	89.7	61%	0.61	45%	0.452	S	S	*	.	H	α-helix	trans	-71.3	-35.2	173.1	-65.9	-42.5	0	0	0	113.2	K767 V768 N769 T774 E775	K767-F771 HydrophobicContact CB-CE2 4.22Å; K767-F771 VanDerWaalsContact O-CD2 3.23Å; K767-F771 WeakPolarHBondContact O-CD2 3.46Å; K767-F771 WeakPolarHBondContact O-CG 3.49Å; K767-F771 PolarHBondContact O-N 2.86Å; V768-F771 PolarHBondContact O-N 3.36Å; N769-F771 PolarHBondContact O-N 2.7Å; N769-F771 VanDerWaalsContact O-N 3.15Å; F771-T774 PolarHBondContact O-OG1 3.21Å; F771-E775 WeakPolarHBondContact O-CB 3.12Å; F771-E775 PolarHBondContact O-N 2.78Å
772	K	87	Confident	87.7	Confident	56 Å²	56	90.5 Å²	90.5	24%	0.243	46%	0.457	C	S	.	.	H	α-helix	trans	-65.3	-41.9	172.7	-69.9	168.1	-170.3	168.3	0	111.5	E684 V768 N769 T774 E775 D776	E684-K772 IonicContact OE1-NZ 2.78Å; E684-K772 PolarHBondContact OE1-NZ 3.02Å; E684-K772 IonicContact OE2-NZ 3.76Å; E684-K772 PolarHBondContact OE2-NZ 3.05Å; V768-K772 WeakPolarHBondContact O-CG 3.37Å; V768-K772 PolarHBondContact O-N 3.05Å; N769-K772 WeakPolarHBondContact O-CA 3.36Å; N769-K772 WeakPolarHBondContact O-CB 3.49Å; N769-K772 PolarHBondContact O-N 3.43Å; N769-K772 PolarHBondContact OD1-NZ 2.83Å; K772-T774 VanDerWaalsContact C-N 3.32Å; K772-T774 PolarHBondContact O-N 2.81Å; K772-E775 WeakPolarHBondContact O-CA 3.5Å; K772-E775 WeakPolarHBondContact O-CB 3.31Å; K772-E775 PolarHBondContact O-N 3.3Å; K772-D776 PolarHBondContact O-N 3.49Å
773	D	88.4	Confident	88.2	Confident	112 Å²	112	94.2 Å²	94.2	60%	0.599	47%	0.467	S	S	*	.	H	α-helix	trans	-58.4	-47.2	178.1	-57.7	-33.1	0	0	0	109.9	N769 E775 D776 E777	N769-D773 VanDerWaalsContact O-CG 3.28Å; N769-D773 PolarHBondContact O-N 2.77Å; D773-E775 VanDerWaalsContact C-N 3.34Å; D773-E775 PolarHBondContact O-N 3.05Å; D773-D776 PolarHBondContact O-N 3.03Å; D773-E777 WeakPolarHBondContact O-CB 3.46Å; D773-E777 PolarHBondContact O-N 2.98Å
774	T	88.7	Confident	88.5	Confident	65 Å²	65	92.4 Å²	92.4	40%	0.399	46%	0.463	S	S	.	.	H	α-helix	trans	-66.4	-29.9	172.8	60.1	0	0	0	0	113.9	S770 F771 K772 L778	S770-T774 PolarHBondContact O-N 2.93Å; S770-T774 PolarHBondContact O-OG1 3.21Å; F771-T774 PolarHBondContact O-OG1 3.21Å; K772-T774 VanDerWaalsContact C-N 3.32Å; K772-T774 PolarHBondContact O-N 2.81Å; T774-L778 WeakPolarHBondContact O-CB 3.42Å; T774-L778 WeakPolarHBondContact O-CD1 3.41Å; T774-L778 WeakPolarHBondContact O-CG 3.48Å; T774-L778 PolarHBondContact O-N 2.88Å
775	E	87.7	Confident	88.9	Confident	96 Å²	96	94 Å²	94	45%	0.449	47%	0.468	S	S	.	.	H	α-helix	trans	-70.4	-39.8	177.4	-163.8	-169.4	-156.2	0	0	111.3	F771 K772 D773 R779	F771-E775 WeakPolarHBondContact O-CB 3.12Å; F771-E775 PolarHBondContact O-N 2.78Å; K772-E775 WeakPolarHBondContact O-CA 3.5Å; K772-E775 WeakPolarHBondContact O-CB 3.31Å; K772-E775 PolarHBondContact O-N 3.3Å; D773-E775 VanDerWaalsContact C-N 3.34Å; D773-E775 PolarHBondContact O-N 3.05Å; E775-R779 WeakPolarHBondContact O-CB 3.46Å; E775-R779 WeakPolarHBondContact O-CD 3.38Å; E775-R779 WeakPolarHBondContact O-CG 3.41Å; E775-R779 PolarHBondContact O-N 3.33Å; E775-R779 IonicContact OE1-CZ 3.05Å; E775-R779 IonicContact OE1-NH2 3.62Å; E775-R779 PolarHBondContact OE1-NH2 3.35Å; E775-R779 IonicContact OE2-CZ 3.85Å; E775-R779 IonicContact OE2-NH1 3.57Å; E775-R779 PolarHBondContact OE2-NH1 3.07Å; E775-R779 IonicContact OE2-NH2 2.86Å; E775-R779 PolarHBondContact OE2-NH2 2.94Å
776	D	90.3	Very high	89.3	Confident	83 Å²	83	92.4 Å²	92.4	44%	0.444	47%	0.474	S	S	.	.	H	α-helix	trans	-77.7	-30.4	177.7	-81.6	-25.5	0	0	0	112.9	K772 D773 R779 A780	K772-D776 PolarHBondContact O-N 3.49Å; D773-D776 PolarHBondContact O-N 3.03Å; D776-R779 PolarHBondContact O-N 2.93Å; D776-R779 WeakPolarHBondContact OD1-CD 3.42Å; D776-R779 IonicContact OD1-CZ 3.66Å; D776-R779 IonicContact OD1-NE 3.09Å; D776-R779 IonicContact OD1-NH1 3.64Å; D776-R779 PolarHBondContact OD1-NH1 2.82Å; D776-A780 PolarHBondContact O-N 3.43Å
777	E	91	Very high	89.6	Confident	125 Å²	125	91.1 Å²	91.1	58%	0.584	47%	0.469	S	S	*	.	H	α-helix	trans	-60	-54.3	165.8	-177.1	173.2	-140.1	0	0	111	D773 R779 A780 E781	D773-E777 WeakPolarHBondContact O-CB 3.46Å; D773-E777 PolarHBondContact O-N 2.98Å; E777-R779 PolarHBondContact O-N 3.46Å; E777-A780 WeakPolarHBondContact O-CA 3.49Å; E777-A780 WeakPolarHBondContact O-CB 3.34Å; E777-A780 PolarHBondContact O-N 3.28Å; E777-E781 PolarHBondContact O-N 3.34Å
778	L	91.3	Very high	89.9	Confident	93 Å²	93	92 Å²	92	49%	0.487	47%	0.469	S	S	.	.	H	α-helix	trans	-60.5	-31.6	176	-72.7	169.4	0	0	0	112.5	T774 N782	T774-L778 WeakPolarHBondContact O-CB 3.42Å; T774-L778 WeakPolarHBondContact O-CD1 3.41Å; T774-L778 WeakPolarHBondContact O-CG 3.48Å; T774-L778 PolarHBondContact O-N 2.88Å; L778-N782 WeakPolarHBondContact O-CB 3.38Å; L778-N782 PolarHBondContact O-N 3.12Å; L778-N782 PolarHBondContact O-ND2 3.16Å
779	R	91.4	Very high	90.2	Very high	103 Å²	103	93.8 Å²	93.8	39%	0.389	48%	0.476	S	S	.	.	H	α-helix	trans	-70.5	-32.9	171.2	-78.1	163.2	173.7	142.7	10.7	112.8	E775 D776 E777 R783	E775-R779 WeakPolarHBondContact O-CB 3.46Å; E775-R779 WeakPolarHBondContact O-CD 3.38Å; E775-R779 WeakPolarHBondContact O-CG 3.41Å; E775-R779 PolarHBondContact O-N 3.33Å; E775-R779 IonicContact OE1-CZ 3.05Å; E775-R779 IonicContact OE1-NH2 3.62Å; E775-R779 PolarHBondContact OE1-NH2 3.35Å; E775-R779 IonicContact OE2-CZ 3.85Å; E775-R779 IonicContact OE2-NH1 3.57Å; E775-R779 PolarHBondContact OE2-NH1 3.07Å; E775-R779 IonicContact OE2-NH2 2.86Å; E775-R779 PolarHBondContact OE2-NH2 2.94Å; D776-R779 PolarHBondContact O-N 2.93Å; D776-R779 WeakPolarHBondContact OD1-CD 3.42Å; D776-R779 IonicContact OD1-CZ 3.66Å; D776-R779 IonicContact OD1-NE 3.09Å; D776-R779 IonicContact OD1-NH1 3.64Å; D776-R779 PolarHBondContact OD1-NH1 2.82Å; E777-R779 PolarHBondContact O-N 3.46Å; R779-R783 VanDerWaalsContact O-CG 3.29Å; R779-R783 WeakPolarHBondContact O-CG 3.23Å; R779-R783 PolarHBondContact O-N 3.25Å; R779-R783 PolarHBondContact O-NE 2.7Å
780	A	91.1	Very high	90.6	Very high	48 Å²	48	97.4 Å²	97.4	40%	0.397	49%	0.488	S	S	.	.	H	α-helix	trans	-68.8	-49.3	174.6	0	0	0	0	0	110	D776 E777 N782 R783 D784	D776-A780 PolarHBondContact O-N 3.43Å; E777-A780 WeakPolarHBondContact O-CA 3.49Å; E777-A780 WeakPolarHBondContact O-CB 3.34Å; E777-A780 PolarHBondContact O-N 3.28Å; A780-N782 VanDerWaalsContact C-N 3.3Å; A780-N782 PolarHBondContact O-N 3.06Å; A780-R783 WeakPolarHBondContact O-CB 3.3Å; A780-R783 PolarHBondContact O-N 3.31Å; A780-D784 PolarHBondContact O-N 3.03Å
781	E	92.7	Very high	90.8	Very high	108 Å²	108	97.2 Å²	97.2	51%	0.505	49%	0.487	S	S	.	.	H	α-helix	trans	-54.8	-44.3	174.1	-67.7	-163.3	135	0	0	112.1	E777 R783 D784 L785	E777-E781 PolarHBondContact O-N 3.34Å; E781-R783 VanDerWaalsContact C-N 3.33Å; E781-R783 PolarHBondContact O-N 2.9Å; E781-D784 PolarHBondContact O-N 3.44Å; E781-D784 VanDerWaalsContact O-N 3.16Å; E781-L785 WeakPolarHBondContact O-CB 3.24Å; E781-L785 WeakPolarHBondContact O-CG 3.38Å; E781-L785 PolarHBondContact O-N 3.11Å
782	N	90.7	Very high	91	Very high	108 Å²	108	95.6 Å²	95.6	58%	0.578	48%	0.481	S	S	*	.	H	α-helix	trans	-64.4	-33	177.5	-88.8	-86.9	0	0	0	113.4	L778 A780 A786	L778-N782 WeakPolarHBondContact O-CB 3.38Å; L778-N782 PolarHBondContact O-N 3.12Å; L778-N782 PolarHBondContact O-ND2 3.16Å; A780-N782 VanDerWaalsContact C-N 3.3Å; A780-N782 PolarHBondContact O-N 3.06Å; N782-A786 WeakPolarHBondContact O-CB 3.31Å; N782-A786 PolarHBondContact O-N 3.3Å
783	R	91.9	Very high	91.3	Very high	163 Å²	163	98.5 Å²	98.5	62%	0.615	50%	0.496	S	S	*	.	H	α-helix	trans	-67.7	-40.6	172.7	-69.8	169.2	-134.3	172.9	3.6	110.9	R779 A780 E781 A786 S787	R779-R783 VanDerWaalsContact O-CG 3.29Å; R779-R783 WeakPolarHBondContact O-CG 3.23Å; R779-R783 PolarHBondContact O-N 3.25Å; R779-R783 PolarHBondContact O-NE 2.7Å; A780-R783 WeakPolarHBondContact O-CB 3.3Å; A780-R783 PolarHBondContact O-N 3.31Å; E781-R783 VanDerWaalsContact C-N 3.33Å; E781-R783 PolarHBondContact O-N 2.9Å; R783-A786 PolarHBondContact O-N 3.25Å; R783-S787 WeakPolarHBondContact O-CB 3.5Å; R783-S787 PolarHBondContact O-N 3.06Å
784	D	92.5	Very high	91.6	Very high	75 Å²	75	99.3 Å²	99.3	40%	0.401	49%	0.494	S	S	.	.	H	α-helix	trans	-71.7	-41.8	-178.6	-119.1	46.3	0	0	0	112.5	A780 E781 A786 S787 R788	A780-D784 PolarHBondContact O-N 3.03Å; E781-D784 PolarHBondContact O-N 3.44Å; E781-D784 VanDerWaalsContact O-N 3.16Å; D784-A786 VanDerWaalsContact C-N 3.32Å; D784-A786 PolarHBondContact O-N 3.31Å; D784-S787 PolarHBondContact O-N 3.39Å; D784-S787 PolarHBondContact O-OG 2.87Å; D784-R788 WeakPolarHBondContact O-CB 3.45Å; D784-R788 VanDerWaalsContact O-CG 3.25Å; D784-R788 WeakPolarHBondContact O-CG 3.36Å; D784-R788 PolarHBondContact O-N 3.15Å; D784-R788 IonicContact OD2-CZ 2.69Å; D784-R788 IonicContact OD2-NE 3.91Å; D784-R788 IonicContact OD2-NH2 3.53Å; D784-R788 PolarHBondContact OD2-NH2 3.07Å
785	L	91.6	Very high	91.8	Very high	107 Å²	107	100.3 Å²	100.3	56%	0.56	49%	0.494	S	S	*	.	H	α-helix	trans	-62.9	-39.4	171.1	-69.3	171.9	0	0	0	111.1	E781 L789	E781-L785 WeakPolarHBondContact O-CB 3.24Å; E781-L785 WeakPolarHBondContact O-CG 3.38Å; E781-L785 PolarHBondContact O-N 3.11Å; L785-L789 WeakPolarHBondContact O-CB 3.49Å; L785-L789 PolarHBondContact O-N 3.37Å
786	A	92.2	Very high	92	Very high	56 Å²	56	100.3 Å²	100.3	46%	0.463	50%	0.497	S	S	.	.	H	α-helix	trans	-68.9	-32	174.6	0	0	0	0	0	113.4	N782 R783 D784 K790	N782-A786 WeakPolarHBondContact O-CB 3.31Å; N782-A786 PolarHBondContact O-N 3.3Å; R783-A786 PolarHBondContact O-N 3.25Å; D784-A786 VanDerWaalsContact C-N 3.32Å; D784-A786 PolarHBondContact O-N 3.31Å; A786-K790 WeakPolarHBondContact O-CB 3.42Å; A786-K790 PolarHBondContact O-N 2.87Å
787	S	91.9	Very high	92	Very high	63 Å²	63	103 Å²	103	44%	0.441	51%	0.506	S	S	.	.	H	α-helix	trans	-72.2	-44.6	175.9	81.4	0	0	0	0	111	R783 D784 K790 S791	R783-S787 WeakPolarHBondContact O-CB 3.5Å; R783-S787 PolarHBondContact O-N 3.06Å; D784-S787 PolarHBondContact O-N 3.39Å; D784-S787 PolarHBondContact O-OG 2.87Å; S787-K790 WeakPolarHBondContact O-CB 3.42Å; S787-K790 PolarHBondContact O-N 3.33Å; S787-K790 VanDerWaalsContact O-N 3.14Å; S787-S791 PolarHBondContact O-N 3.12Å
788	R	92.8	Very high	92.1	Very high	144 Å²	144	102.3 Å²	102.3	54%	0.543	50%	0.503	S	S	.	.	H	α-helix	trans	-61.6	-47	173.8	-67.8	172.8	-158.9	-167.2	8.7	111.8	D784 K790 S791 E792	D784-R788 WeakPolarHBondContact O-CB 3.45Å; D784-R788 VanDerWaalsContact O-CG 3.25Å; D784-R788 WeakPolarHBondContact O-CG 3.36Å; D784-R788 PolarHBondContact O-N 3.15Å; D784-R788 IonicContact OD2-CZ 2.69Å; D784-R788 IonicContact OD2-NE 3.91Å; D784-R788 IonicContact OD2-NH2 3.53Å; D784-R788 PolarHBondContact OD2-NH2 3.07Å; R788-K790 PolarHBondContact O-N 2.93Å; R788-K790 VanDerWaalsContact O-N 3.16Å; R788-S791 WeakPolarHBondContact CA-OG 3.14Å; R788-S791 PolarHBondContact O-N 3.29Å; R788-S791 PolarHBondContact O-OG 2.87Å; R788-E792 WeakPolarHBondContact O-CG 3.3Å; R788-E792 PolarHBondContact O-N 3.15Å
789	L	92.1	Very high	92.1	Very high	103 Å²	103	104.6 Å²	104.6	54%	0.539	51%	0.506	S	S	.	.	H	α-helix	trans	-53.5	-38.2	173.6	-173.6	78	0	0	0	111.6	L785 Q793	L785-L789 WeakPolarHBondContact O-CB 3.49Å; L785-L789 PolarHBondContact O-N 3.37Å; L789-Q793 WeakPolarHBondContact O-CB 3.28Å; L789-Q793 WeakPolarHBondContact O-CG 3.17Å; L789-Q793 PolarHBondContact O-N 3.28Å
790	K	92.5	Very high	92.3	Very high	142 Å²	142	105.9 Å²	105.9	62%	0.617	51%	0.514	S	S	*	.	H	α-helix	trans	-77.6	-25.2	-179.6	-169	175.3	-178.1	178.8	0	113.6	A786 S787 R788 K794	A786-K790 WeakPolarHBondContact O-CB 3.42Å; A786-K790 PolarHBondContact O-N 2.87Å; S787-K790 WeakPolarHBondContact O-CB 3.42Å; S787-K790 PolarHBondContact O-N 3.33Å; S787-K790 VanDerWaalsContact O-N 3.14Å; R788-K790 PolarHBondContact O-N 2.93Å; R788-K790 VanDerWaalsContact O-N 3.16Å; K790-K794 WeakPolarHBondContact O-CG 3.36Å
791	S	91.8	Very high	92.3	Very high	52 Å²	52	106.8 Å²	106.8	36%	0.364	52%	0.518	S	S	.	.	H	α-helix	trans	-77.5	-43.4	168.2	48.4	0	0	0	0	111.9	S787 R788 Q793 K794 Q795	S787-S791 PolarHBondContact O-N 3.12Å; R788-S791 WeakPolarHBondContact CA-OG 3.14Å; R788-S791 PolarHBondContact O-N 3.29Å; R788-S791 PolarHBondContact O-OG 2.87Å; S791-Q793 VanDerWaalsContact C-N 3.33Å; S791-Q793 PolarHBondContact O-N 3.22Å; S791-K794 WeakPolarHBondContact O-CB 3.18Å; S791-K794 PolarHBondContact O-N 3.41Å; S791-Q795 PolarHBondContact O-N 3.3Å
792	E	92.1	Very high	92.3	Very high	106 Å²	106	106 Å²	106	50%	0.495	51%	0.514	S	S	.	.	H	α-helix	trans	-57.4	-45.3	174.3	-70.5	-58.4	144.6	0	0	111.5	R788 K794 Q795 L796	R788-E792 WeakPolarHBondContact O-CG 3.3Å; R788-E792 PolarHBondContact O-N 3.15Å; E792-K794 VanDerWaalsContact C-N 3.27Å; E792-K794 PolarHBondContact O-N 3.14Å; E792-Q795 PolarHBondContact O-N 2.88Å; E792-L796 WeakPolarHBondContact O-CB 2.94Å; E792-L796 PolarHBondContact O-N 2.96Å
793	Q	93.6	Very high	92.3	Very high	116 Å²	116	103 Å²	103	54%	0.542	51%	0.505	S	S	.	.	H	α-helix	trans	-61.6	-31.4	175.5	-77.6	173.1	5.6	0	0	113.6	L789 S791 H797	L789-Q793 WeakPolarHBondContact O-CB 3.28Å; L789-Q793 WeakPolarHBondContact O-CG 3.17Å; L789-Q793 PolarHBondContact O-N 3.28Å; S791-Q793 VanDerWaalsContact C-N 3.33Å; S791-Q793 PolarHBondContact O-N 3.22Å; Q793-H797 PolarHBondContact O-N 2.83Å
794	K	92.8	Very high	92.4	Very high	130 Å²	130	100.7 Å²	100.7	57%	0.565	51%	0.505	S	S	*	.	H	α-helix	trans	-72.5	-49	173.4	-76.7	175.3	174.2	-172.4	0	111.3	K790 S791 E792 L796 H797 E798	K790-K794 WeakPolarHBondContact O-CG 3.36Å; S791-K794 WeakPolarHBondContact O-CB 3.18Å; S791-K794 PolarHBondContact O-N 3.41Å; E792-K794 VanDerWaalsContact C-N 3.27Å; E792-K794 PolarHBondContact O-N 3.14Å; K794-L796 VanDerWaalsContact C-N 3.31Å; K794-L796 PolarHBondContact O-N 3.43Å; K794-H797 CarbonylContact O-C 3.5Å; K794-H797 WeakPolarHBondContact O-CA 3.32Å; K794-H797 WeakPolarHBondContact O-CB 3.46Å; K794-H797 PolarHBondContact O-N 3.38Å; K794-E798 PolarHBondContact O-N 3.28Å
795	Q	93.1	Very high	92.3	Very high	86 Å²	86	100.7 Å²	100.7	40%	0.402	51%	0.507	S	S	.	.	H	α-helix	trans	-59.1	-43.6	177.8	-68.7	-174.3	8.4	0	0	111.1	S791 E792 H797 E798 Y799	S791-Q795 PolarHBondContact O-N 3.3Å; E792-Q795 PolarHBondContact O-N 2.88Å; Q795-H797 PolarHBondContact O-N 2.95Å; Q795-E798 PolarHBondContact O-N 3.12Å; Q795-E798 VanDerWaalsContact O-N 3.17Å; Q795-Y799 HydrophobicContact CB-CD2 4.26Å; Q795-Y799 HydrophobicContact CB-CE2 4.05Å; Q795-Y799 WeakPolarHBondContact O-CB 3.46Å; Q795-Y799 WeakPolarHBondContact O-CD2 3.34Å; Q795-Y799 PolarHBondContact O-N 3.49Å
796	L	92.5	Very high	92.4	Very high	95 Å²	95	102.6 Å²	102.6	50%	0.497	51%	0.508	S	S	.	.	H	α-helix	trans	-59.5	-30.3	172.1	-90.6	167.4	0	0	0	113.9	E792 K794 K800	E792-L796 WeakPolarHBondContact O-CB 2.94Å; E792-L796 PolarHBondContact O-N 2.96Å; K794-L796 VanDerWaalsContact C-N 3.31Å; K794-L796 PolarHBondContact O-N 3.43Å; L796-K800 WeakPolarHBondContact O-CB 3.26Å; L796-K800 WeakPolarHBondContact O-CD 3.33Å; L796-K800 WeakPolarHBondContact O-CG 3.36Å; L796-K800 PolarHBondContact O-N 3.23Å
797	H	91.2	Very high	92.4	Very high	139 Å²	139	104 Å²	104	64%	0.644	51%	0.508	S	S	*	.	H	α-helix	trans	-77.3	-40.4	174.7	-168.8	72.8	0	0	0	111.7	Q793 K794 Q795 K800 S801	Q793-H797 PolarHBondContact O-N 2.83Å; K794-H797 CarbonylContact O-C 3.5Å; K794-H797 WeakPolarHBondContact O-CA 3.32Å; K794-H797 WeakPolarHBondContact O-CB 3.46Å; K794-H797 PolarHBondContact O-N 3.38Å; Q795-H797 PolarHBondContact O-N 2.95Å; H797-K800 PolarHBondContact O-N 2.73Å; H797-S801 WeakPolarHBondContact O-CB 3.35Å; H797-S801 PolarHBondContact O-N 2.71Å
798	E	92	Very high	92.4	Very high	111 Å²	111	107.3 Å²	107.3	52%	0.519	52%	0.516	S	S	.	.	H	α-helix	trans	-65.5	-47.3	176.1	-71.4	169.9	-155.3	0	0	111.6	K794 Q795 K800 S801 Q802	K794-E798 PolarHBondContact O-N 3.28Å; Q795-E798 PolarHBondContact O-N 3.12Å; Q795-E798 VanDerWaalsContact O-N 3.17Å; E798-K800 VanDerWaalsContact C-N 3.34Å; E798-K800 PolarHBondContact O-N 3.41Å; E798-S801 WeakPolarHBondContact O-CA 3.33Å; E798-S801 WeakPolarHBondContact O-CB 3.36Å; E798-S801 PolarHBondContact O-N 2.9Å; E798-S801 VanDerWaalsContact O-N 3.11Å; E798-Q802 WeakPolarHBondContact O-CG 3.08Å; E798-Q802 PolarHBondContact O-N 3.14Å
799	Y	92.6	Very high	92.4	Very high	142 Å²	142	105.6 Å²	105.6	56%	0.557	52%	0.517	S	S	*	.	H	α-helix	trans	-61.5	-38.4	173.4	-70.3	-52.1	0	0	0	112.5	Q795 S801 Q802 A803	Q795-Y799 HydrophobicContact CB-CD2 4.26Å; Q795-Y799 HydrophobicContact CB-CE2 4.05Å; Q795-Y799 WeakPolarHBondContact O-CB 3.46Å; Q795-Y799 WeakPolarHBondContact O-CD2 3.34Å; Q795-Y799 PolarHBondContact O-N 3.49Å; Y799-S801 VanDerWaalsContact C-N 3.35Å; Y799-Q802 PolarHBondContact O-N 2.89Å; Y799-A803 VanDerWaalsContact O-CB 3.28Å; Y799-A803 WeakPolarHBondContact O-CB 3.47Å; Y799-A803 PolarHBondContact O-N 3.16Å
800	K	93.8	Very high	92.5	Very high	129 Å²	129	106.6 Å²	106.6	56%	0.561	52%	0.522	S	S	*	.	H	α-helix	trans	-65.8	-36.8	172.7	-77.9	172.5	-176.2	177.9	0	112.2	L796 H797 E798 N804	L796-K800 WeakPolarHBondContact O-CB 3.26Å; L796-K800 WeakPolarHBondContact O-CD 3.33Å; L796-K800 WeakPolarHBondContact O-CG 3.36Å; L796-K800 PolarHBondContact O-N 3.23Å; H797-K800 PolarHBondContact O-N 2.73Å; E798-K800 VanDerWaalsContact C-N 3.34Å; E798-K800 PolarHBondContact O-N 3.41Å; K800-N804 WeakPolarHBondContact O-CB 3.45Å; K800-N804 PolarHBondContact O-N 3.11Å; K800-N804 PolarHBondContact O-ND2 2.86Å
801	S	91.5	Very high	92.5	Very high	67 Å²	67	107.7 Å²	107.7	47%	0.469	52%	0.523	S	S	.	.	H	α-helix	trans	-64.5	-46.7	174	-165.9	0	0	0	0	111.5	H797 E798 Y799 N804 T805	H797-S801 WeakPolarHBondContact O-CB 3.35Å; H797-S801 PolarHBondContact O-N 2.71Å; E798-S801 WeakPolarHBondContact O-CA 3.33Å; E798-S801 WeakPolarHBondContact O-CB 3.36Å; E798-S801 PolarHBondContact O-N 2.9Å; E798-S801 VanDerWaalsContact O-N 3.11Å; Y799-S801 VanDerWaalsContact C-N 3.35Å; S801-N804 WeakPolarHBondContact O-CB 3.49Å; S801-N804 PolarHBondContact O-N 3.18Å; S801-T805 PolarHBondContact O-N 3.16Å
802	Q	92.4	Very high	92.5	Very high	92 Å²	92	107.2 Å²	107.2	43%	0.43	52%	0.519	S	S	.	.	H	α-helix	trans	-62.8	-44.3	175.1	-68.6	174.8	9.7	0	0	112.2	E798 Y799 N804 T805 Y806	E798-Q802 WeakPolarHBondContact O-CG 3.08Å; E798-Q802 PolarHBondContact O-N 3.14Å; Y799-Q802 PolarHBondContact O-N 2.89Å; Q802-N804 VanDerWaalsContact C-N 3.25Å; Q802-N804 PolarHBondContact O-N 3.25Å; Q802-T805 WeakPolarHBondContact CA-OG1 3.38Å; Q802-T805 PolarHBondContact O-N 3.09Å; Q802-T805 VanDerWaalsContact O-N 3.17Å; Q802-T805 PolarHBondContact O-OG1 2.81Å; Q802-Y806 HydrophobicContact CB-CD2 4.42Å; Q802-Y806 HydrophobicContact CB-CE2 4.32Å; Q802-Y806 WeakPolarHBondContact O-CD2 3.34Å; Q802-Y806 PolarHBondContact O-N 2.88Å
803	A	92.4	Very high	92.6	Very high	45 Å²	45	104.1 Å²	104.1	37%	0.372	51%	0.511	S	S	.	.	H	α-helix	trans	-59.5	-37.8	175.4	0	0	0	0	0	111.7	Y799 N807	Y799-A803 VanDerWaalsContact O-CB 3.28Å; Y799-A803 WeakPolarHBondContact O-CB 3.47Å; Y799-A803 PolarHBondContact O-N 3.16Å; A803-N807 VanDerWaalsContact O-CB 3.31Å; A803-N807 WeakPolarHBondContact O-CB 3.32Å; A803-N807 PolarHBondContact O-N 2.82Å; A803-N807 PolarHBondContact O-ND2 2.91Å
804	N	92.3	Very high	92.6	Very high	115 Å²	115	106 Å²	106	62%	0.615	51%	0.514	S	S	*	.	H	α-helix	trans	-68.4	-40.5	174.6	-72.6	-24.7	0	0	0	112.5	K800 S801 Q802 N807 H808	K800-N804 WeakPolarHBondContact O-CB 3.45Å; K800-N804 PolarHBondContact O-N 3.11Å; K800-N804 PolarHBondContact O-ND2 2.86Å; S801-N804 WeakPolarHBondContact O-CB 3.49Å; S801-N804 PolarHBondContact O-N 3.18Å; Q802-N804 VanDerWaalsContact C-N 3.25Å; Q802-N804 PolarHBondContact O-N 3.25Å; N804-N807 PolarHBondContact O-N 2.88Å; N804-H808 WeakPolarHBondContact O-CB 3.49Å; N804-H808 PolarHBondContact O-N 3.3Å
805	T	91.9	Very high	92.6	Very high	74 Å²	74	104 Å²	104	45%	0.454	51%	0.509	S	S	.	.	H	α-helix	trans	-69.8	-40.6	176.5	57.3	0	0	0	0	112	S801 Q802 H808 L809	S801-T805 PolarHBondContact O-N 3.16Å; Q802-T805 WeakPolarHBondContact CA-OG1 3.38Å; Q802-T805 PolarHBondContact O-N 3.09Å; Q802-T805 VanDerWaalsContact O-N 3.17Å; Q802-T805 PolarHBondContact O-OG1 2.81Å; T805-H808 PolarHBondContact O-N 2.77Å; T805-L809 WeakPolarHBondContact O-CB 3.42Å; T805-L809 WeakPolarHBondContact O-CG 3.14Å; T805-L809 PolarHBondContact O-N 2.81Å
806	Y	92.2	Very high	92.6	Very high	147 Å²	147	105.7 Å²	105.7	58%	0.576	52%	0.517	S	S	*	.	H	α-helix	trans	-60.8	-44	171.3	-74.1	-58.8	0	0	0	111.9	Q802 H808 L809 L810	Q802-Y806 HydrophobicContact CB-CD2 4.42Å; Q802-Y806 HydrophobicContact CB-CE2 4.32Å; Q802-Y806 WeakPolarHBondContact O-CD2 3.34Å; Q802-Y806 PolarHBondContact O-N 2.88Å; Y806-H808 VanDerWaalsContact C-N 3.31Å; Y806-H808 PolarHBondContact O-N 3.22Å; Y806-L809 PolarHBondContact O-N 2.81Å; Y806-L810 WeakPolarHBondContact O-CB 3.22Å; Y806-L810 VanDerWaalsContact O-CG 3.31Å; Y806-L810 WeakPolarHBondContact O-CG 3.24Å; Y806-L810 PolarHBondContact O-N 2.88Å
807	N	93.3	Very high	92.6	Very high	86 Å²	86	106.6 Å²	106.6	46%	0.46	52%	0.52	S	S	.	.	H	α-helix	trans	-60.7	-38.2	174.2	-92.2	-89.9	0	0	0	112.6	A803 N804 R811	A803-N807 VanDerWaalsContact O-CB 3.31Å; A803-N807 WeakPolarHBondContact O-CB 3.32Å; A803-N807 PolarHBondContact O-N 2.82Å; A803-N807 PolarHBondContact O-ND2 2.91Å; N804-N807 PolarHBondContact O-N 2.88Å; N807-R811 WeakPolarHBondContact O-CB 3.35Å; N807-R811 WeakPolarHBondContact O-CD 3.46Å; N807-R811 VanDerWaalsContact O-CG 3.22Å; N807-R811 WeakPolarHBondContact O-CG 3.44Å; N807-R811 PolarHBondContact O-N 2.79Å
808	H	91.5	Very high	92.6	Very high	133 Å²	133	103.5 Å²	103.5	62%	0.616	51%	0.508	S	S	*	.	H	α-helix	trans	-70	-40.5	176.1	-173.6	62.7	0	0	0	112.3	N804 T805 Y806 R811 S812	N804-H808 WeakPolarHBondContact O-CB 3.49Å; N804-H808 PolarHBondContact O-N 3.3Å; T805-H808 PolarHBondContact O-N 2.77Å; Y806-H808 VanDerWaalsContact C-N 3.31Å; Y806-H808 PolarHBondContact O-N 3.22Å; H808-R811 PolarHBondContact O-N 3.34Å; H808-S812 WeakPolarHBondContact O-CB 3.5Å; H808-S812 PolarHBondContact O-N 2.62Å
809	L	93.7	Very high	92.6	Very high	107 Å²	107	104.5 Å²	104.5	56%	0.56	51%	0.511	S	S	*	.	H	α-helix	trans	-65	-44.2	175.6	-73.5	168.9	0	0	0	111.8	T805 Y806 R811 S812 A813	T805-L809 WeakPolarHBondContact O-CB 3.42Å; T805-L809 WeakPolarHBondContact O-CG 3.14Å; T805-L809 PolarHBondContact O-N 2.81Å; Y806-L809 PolarHBondContact O-N 2.81Å; L809-R811 PolarHBondContact O-N 2.63Å; L809-S812 PolarHBondContact O-N 3.15Å; L809-A813 VanDerWaalsContact O-CB 3.31Å; L809-A813 WeakPolarHBondContact O-CB 3.32Å; L809-A813 PolarHBondContact O-N 2.9Å
810	L	93.1	Very high	92.6	Very high	124 Å²	124	100.1 Å²	100.1	65%	0.649	50%	0.504	S	S	*	.	H	α-helix	trans	-63.7	-39.4	176.1	-72.1	168.9	0	0	0	111.9	Y806 R814	Y806-L810 WeakPolarHBondContact O-CB 3.22Å; Y806-L810 VanDerWaalsContact O-CG 3.31Å; Y806-L810 WeakPolarHBondContact O-CG 3.24Å; Y806-L810 PolarHBondContact O-N 2.88Å; L810-R814 WeakPolarHBondContact O-CB 3.36Å; L810-R814 PolarHBondContact O-N 3.43Å
811	R	92.9	Very high	92.5	Very high	166 Å²	166	98.4 Å²	98.4	63%	0.626	50%	0.5	S	S	*	.	H	α-helix	trans	-64.7	-45.5	172	-74.4	168.7	-177.8	-99.6	1.1	111.8	N807 H808 L809 A813 R814 D815	N807-R811 WeakPolarHBondContact O-CB 3.35Å; N807-R811 WeakPolarHBondContact O-CD 3.46Å; N807-R811 VanDerWaalsContact O-CG 3.22Å; N807-R811 WeakPolarHBondContact O-CG 3.44Å; N807-R811 PolarHBondContact O-N 2.79Å; H808-R811 PolarHBondContact O-N 3.34Å; L809-R811 PolarHBondContact O-N 2.63Å; R811-A813 PolarHBondContact O-N 3.32Å; R811-R814 WeakPolarHBondContact O-CB 3.43Å; R811-R814 PolarHBondContact O-N 3.29Å; R811-D815 WeakPolarHBondContact O-CB 3.35Å; R811-D815 PolarHBondContact O-N 2.67Å
812	S	92.1	Very high	92.5	Very high	42 Å²	42	101.4 Å²	101.4	29%	0.294	51%	0.505	S	S	.	.	H	α-helix	trans	-63.3	-41.1	177.2	-175.1	0	0	0	0	112.5	H808 L809 D815 Q816	H808-S812 WeakPolarHBondContact O-CB 3.5Å; H808-S812 PolarHBondContact O-N 2.62Å; L809-S812 PolarHBondContact O-N 3.15Å; S812-D815 PolarHBondContact O-N 2.81Å; S812-Q816 WeakPolarHBondContact O-CB 3.37Å; S812-Q816 VanDerWaalsContact O-CG 3.23Å; S812-Q816 WeakPolarHBondContact O-CG 3.43Å; S812-Q816 PolarHBondContact O-N 2.83Å; S812-Q816 PolarHBondContact O-NE2 3.27Å; S812-Q816 PolarHBondContact OG-NE2 3.24Å
813	A	92.9	Very high	92.4	Very high	40 Å²	40	101 Å²	101	33%	0.331	51%	0.506	S	S	.	.	H	α-helix	trans	-65.1	-41.6	174.5	0	0	0	0	0	111.4	L809 R811 Q816 M817	L809-A813 VanDerWaalsContact O-CB 3.31Å; L809-A813 WeakPolarHBondContact O-CB 3.32Å; L809-A813 PolarHBondContact O-N 2.9Å; R811-A813 PolarHBondContact O-N 3.32Å; A813-Q816 PolarHBondContact O-N 3.43Å; A813-M817 WeakPolarHBondContact O-CG 3.5Å; A813-M817 PolarHBondContact O-N 3.2Å
814	R	94.3	Very high	92.3	Very high	156 Å²	156	103.4 Å²	103.4	59%	0.589	51%	0.511	S	S	*	.	H	α-helix	trans	-60	-51.2	170.9	177	178.8	174.9	160.2	5	111.6	L810 R811 Q816 M817 D818	L810-R814 WeakPolarHBondContact O-CB 3.36Å; L810-R814 PolarHBondContact O-N 3.43Å; R811-R814 WeakPolarHBondContact O-CB 3.43Å; R811-R814 PolarHBondContact O-N 3.29Å; R814-Q816 PolarHBondContact O-N 3.28Å; R814-Q816 VanDerWaalsContact O-N 3.13Å; R814-M817 CarbonylContact O-C 3.59Å; R814-M817 PolarHBondContact O-N 2.82Å; R814-D818 WeakPolarHBondContact CG-OD2 3.41Å; R814-D818 IonicContact CZ-OD2 2.66Å; R814-D818 IonicContact NE-OD2 2.83Å; R814-D818 PolarHBondContact NE-OD2 2.81Å; R814-D818 IonicContact NH2-OD2 3.16Å; R814-D818 WeakPolarHBondContact O-CB 3.31Å; R814-D818 PolarHBondContact O-N 2.84Å
815	D	92.5	Very high	92.1	Very high	88 Å²	88	102.5 Å²	102.5	47%	0.471	51%	0.507	S	S	.	.	H	α-helix	trans	-61.3	-23.4	179.5	-67.1	-13.8	0	0	0	112.5	R811 S812 K819	R811-D815 WeakPolarHBondContact O-CB 3.35Å; R811-D815 PolarHBondContact O-N 2.67Å; S812-D815 PolarHBondContact O-N 2.81Å; D815-K819 WeakPolarHBondContact O-CD 3.11Å; D815-K819 WeakPolarHBondContact O-CE 3.37Å; D815-K819 WeakPolarHBondContact O-CG 3.38Å; D815-K819 PolarHBondContact O-N 3.49Å
816	Q	93	Very high	92.1	Very high	121 Å²	121	103.6 Å²	103.6	57%	0.565	51%	0.505	S	S	*	.	H	α-helix	trans	-80.9	-42.7	171.4	-72.8	170.2	43	0	0	112.1	S812 A813 R814 K819 A820	S812-Q816 WeakPolarHBondContact O-CB 3.37Å; S812-Q816 VanDerWaalsContact O-CG 3.23Å; S812-Q816 WeakPolarHBondContact O-CG 3.43Å; S812-Q816 PolarHBondContact O-N 2.83Å; S812-Q816 PolarHBondContact O-NE2 3.27Å; S812-Q816 PolarHBondContact OG-NE2 3.24Å; A813-Q816 PolarHBondContact O-N 3.43Å; R814-Q816 PolarHBondContact O-N 3.28Å; R814-Q816 VanDerWaalsContact O-N 3.13Å; Q816-K819 PolarHBondContact O-N 2.98Å; Q816-A820 WeakPolarHBondContact O-CB 3.23Å; Q816-A820 PolarHBondContact O-N 2.65Å
817	M	93	Very high	91.9	Very high	115 Å²	115	102.5 Å²	102.5	57%	0.567	51%	0.505	S	S	*	.	H	α-helix	trans	-65.1	-44	174.7	-71.7	-175.2	-65.7	0	0	111.9	A813 R814 K819 A820 L821	A813-M817 WeakPolarHBondContact O-CG 3.5Å; A813-M817 PolarHBondContact O-N 3.2Å; R814-M817 CarbonylContact O-C 3.59Å; R814-M817 PolarHBondContact O-N 2.82Å; M817-K819 VanDerWaalsContact C-N 3.26Å; M817-K819 PolarHBondContact O-N 3.36Å; M817-A820 PolarHBondContact O-N 3.17Å; M817-A820 VanDerWaalsContact O-N 3.13Å; M817-L821 WeakPolarHBondContact O-CB 3.41Å; M817-L821 VanDerWaalsContact O-CG 3.28Å; M817-L821 WeakPolarHBondContact O-CG 3.26Å; M817-L821 PolarHBondContact O-N 2.98Å
818	D	91.7	Very high	91.5	Very high	74 Å²	74	105.4 Å²	105.4	40%	0.396	51%	0.514	S	S	.	.	H	α-helix	trans	-61.8	-34.2	176.7	-73	-19.3	0	0	0	110.9	R814 F822	R814-D818 WeakPolarHBondContact CG-OD2 3.41Å; R814-D818 IonicContact CZ-OD2 2.66Å; R814-D818 IonicContact NE-OD2 2.83Å; R814-D818 PolarHBondContact NE-OD2 2.81Å; R814-D818 IonicContact NH2-OD2 3.16Å; R814-D818 WeakPolarHBondContact O-CB 3.31Å; R814-D818 PolarHBondContact O-N 2.84Å; D818-F822 WeakPolarHBondContact O-CB 3.2Å; D818-F822 PolarHBondContact O-N 2.98Å
819	K	91.9	Very high	91.3	Very high	132 Å²	132	104.2 Å²	104.2	57%	0.574	51%	0.512	S	S	*	.	H	α-helix	trans	-71.2	-44.1	170.5	-75.6	167.9	-167	154.3	0	113.1	D815 Q816 M817 L821 F822 D823	D815-K819 WeakPolarHBondContact O-CD 3.11Å; D815-K819 WeakPolarHBondContact O-CE 3.37Å; D815-K819 WeakPolarHBondContact O-CG 3.38Å; D815-K819 PolarHBondContact O-N 3.49Å; Q816-K819 PolarHBondContact O-N 2.98Å; M817-K819 VanDerWaalsContact C-N 3.26Å; M817-K819 PolarHBondContact O-N 3.36Å; K819-L821 VanDerWaalsContact C-N 3.33Å; K819-L821 PolarHBondContact O-N 3.09Å; K819-F822 WeakPolarHBondContact O-CB 3.47Å; K819-F822 PolarHBondContact O-N 3.32Å; K819-D823 PolarHBondContact O-N 2.8Å
820	A	91.7	Very high	91	Very high	49 Å²	49	105.1 Å²	105.1	41%	0.405	51%	0.512	S	S	.	.	H	α-helix	trans	-62.6	-41.8	177.7	0	0	0	0	0	111.1	Q816 M817 D823 I824	Q816-A820 WeakPolarHBondContact O-CB 3.23Å; Q816-A820 PolarHBondContact O-N 2.65Å; M817-A820 PolarHBondContact O-N 3.17Å; M817-A820 VanDerWaalsContact O-N 3.13Å; A820-D823 PolarHBondContact O-N 3.41Å; A820-I824 VanDerWaalsContact O-CB 3.3Å; A820-I824 WeakPolarHBondContact O-CB 3.48Å; A820-I824 WeakPolarHBondContact O-CD1 3.32Å; A820-I824 WeakPolarHBondContact O-CG1 3.08Å; A820-I824 PolarHBondContact O-N 3.02Å
821	L	92	Very high	90.5	Very high	94 Å²	94	102.7 Å²	102.7	49%	0.492	50%	0.497	S	S	.	.	H	α-helix	trans	-64.1	-39.7	172.9	-70.9	170.7	0	0	0	112	M817 K819 I824 N825	M817-L821 WeakPolarHBondContact O-CB 3.41Å; M817-L821 VanDerWaalsContact O-CG 3.28Å; M817-L821 WeakPolarHBondContact O-CG 3.26Å; M817-L821 PolarHBondContact O-N 2.98Å; K819-L821 VanDerWaalsContact C-N 3.33Å; K819-L821 PolarHBondContact O-N 3.09Å; L821-I824 PolarHBondContact O-N 2.78Å; L821-N825 WeakPolarHBondContact O-CB 3.4Å; L821-N825 PolarHBondContact O-N 2.96Å
822	F	91.3	Very high	90.2	Very high	130 Å²	130	100.3 Å²	100.3	57%	0.57	49%	0.491	S	S	*	.	H	α-helix	trans	-62.4	-47.1	173.6	177.8	-96	0	0	0	112.2	D818 K819 N825 K826	D818-F822 WeakPolarHBondContact O-CB 3.2Å; D818-F822 PolarHBondContact O-N 2.98Å; K819-F822 WeakPolarHBondContact O-CB 3.47Å; K819-F822 PolarHBondContact O-N 3.32Å; F822-N825 PolarHBondContact O-N 3.25Å; F822-K826 HydrophobicContact CD1-CD 4.46Å; F822-K826 HydrophobicContact CE1-CD 3.88Å; F822-K826 HydrophobicContact CZ-CD 4.38Å; F822-K826 WeakPolarHBondContact O-CB 3.13Å; F822-K826 PolarHBondContact O-N 2.67Å
823	D	90.9	Very high	89.8	Confident	84 Å²	84	100.9 Å²	100.9	45%	0.449	50%	0.499	S	S	.	.	H	α-helix	trans	-70.9	-31.3	177.6	-81.2	-37.5	0	0	0	112.4	K819 A820 K826 Q827	K819-D823 PolarHBondContact O-N 2.8Å; A820-D823 PolarHBondContact O-N 3.41Å; D823-K826 IonicContact OD1-NZ 2.77Å; D823-Q827 WeakPolarHBondContact O-CB 3.5Å; D823-Q827 WeakPolarHBondContact O-CG 3.44Å; D823-Q827 PolarHBondContact O-N 3.4Å
824	I	90.3	Very high	89.4	Confident	94 Å²	94	103.7 Å²	103.7	48%	0.482	50%	0.503	S	S	.	.	H	α-helix	trans	-65.5	-49.2	170.8	-73.7	164.2	0	0	0	110.8	A820 L821 K826 Q827 F828	A820-I824 VanDerWaalsContact O-CB 3.3Å; A820-I824 WeakPolarHBondContact O-CB 3.48Å; A820-I824 WeakPolarHBondContact O-CD1 3.32Å; A820-I824 WeakPolarHBondContact O-CG1 3.08Å; A820-I824 PolarHBondContact O-N 3.02Å; L821-I824 PolarHBondContact O-N 2.78Å; I824-K826 VanDerWaalsContact C-N 3.3Å; I824-K826 PolarHBondContact O-N 3.44Å; I824-Q827 CarbonylContact O-C 3.59Å; I824-Q827 WeakPolarHBondContact O-CB 3.46Å; I824-Q827 PolarHBondContact O-N 3.04Å; I824-Q827 VanDerWaalsContact O-N 3.09Å; I824-F828 PolarHBondContact O-N 3.48Å
825	N	89.2	Confident	88.8	Confident	97 Å²	97	103.5 Å²	103.5	52%	0.519	50%	0.503	S	S	.	.	H	α-helix	trans	-60.3	-42.3	176.6	-77	-5.6	0	0	0	110.9	L821 F822 Q827 F828 D829	L821-N825 WeakPolarHBondContact O-CB 3.4Å; L821-N825 PolarHBondContact O-N 2.96Å; F822-N825 PolarHBondContact O-N 3.25Å; N825-Q827 VanDerWaalsContact C-N 3.3Å; N825-Q827 PolarHBondContact O-N 2.64Å; N825-F828 CarbonylContact O-C 3.54Å; N825-F828 WeakPolarHBondContact O-CA 3.39Å; N825-F828 WeakPolarHBondContact O-CB 3.4Å; N825-F828 PolarHBondContact O-N 3.46Å; N825-D829 PolarHBondContact O-N 3.28Å
826	K	90.6	Very high	88.3	Confident	96 Å²	96	104.7 Å²	104.7	42%	0.417	51%	0.505	S	S	.	.	H	α-helix	trans	-67.3	-24.9	175.5	-178.1	180	171.7	-166.4	0	113.9	F822 D823 I824 K830	F822-K826 HydrophobicContact CD1-CD 4.46Å; F822-K826 HydrophobicContact CE1-CD 3.88Å; F822-K826 HydrophobicContact CZ-CD 4.38Å; F822-K826 WeakPolarHBondContact O-CB 3.13Å; F822-K826 PolarHBondContact O-N 2.67Å; D823-K826 IonicContact OD1-NZ 2.77Å; I824-K826 VanDerWaalsContact C-N 3.3Å; I824-K826 PolarHBondContact O-N 3.44Å; K826-K830 WeakPolarHBondContact O-CD 3.45Å; K826-K830 VanDerWaalsContact O-CG 3.25Å; K826-K830 WeakPolarHBondContact O-CG 3.2Å; K826-K830 PolarHBondContact O-N 2.85Å
827	Q	88.2	Confident	87.7	Confident	125 Å²	125	101.8 Å²	101.8	58%	0.584	50%	0.502	S	S	*	.	H	α-helix	trans	-74.7	-41	165.7	-70	-84.6	30.9	0	0	110.5	D823 I824 N825 K830 E831	D823-Q827 WeakPolarHBondContact O-CB 3.5Å; D823-Q827 WeakPolarHBondContact O-CG 3.44Å; D823-Q827 PolarHBondContact O-N 3.4Å; I824-Q827 CarbonylContact O-C 3.59Å; I824-Q827 WeakPolarHBondContact O-CB 3.46Å; I824-Q827 PolarHBondContact O-N 3.04Å; I824-Q827 VanDerWaalsContact O-N 3.09Å; N825-Q827 VanDerWaalsContact C-N 3.3Å; N825-Q827 PolarHBondContact O-N 2.64Å; Q827-K830 WeakPolarHBondContact O-CB 3.2Å; Q827-K830 PolarHBondContact O-N 2.88Å; Q827-E831 WeakPolarHBondContact O-CB 3.35Å; Q827-E831 PolarHBondContact O-N 3.47Å
828	F	85.7	Confident	87.1	Confident	147 Å²	147	101.1 Å²	101.1	65%	0.645	50%	0.498	S	S	*	.	H	α-helix	trans	-64.6	-40.2	178.1	-128.7	-82.5	0	0	0	112.6	I824 N825 K830 E831 K832	I824-F828 PolarHBondContact O-N 3.48Å; N825-F828 CarbonylContact O-C 3.54Å; N825-F828 WeakPolarHBondContact O-CA 3.39Å; N825-F828 WeakPolarHBondContact O-CB 3.4Å; N825-F828 PolarHBondContact O-N 3.46Å; F828-K830 VanDerWaalsContact C-N 3.33Å; F828-E831 PolarHBondContact O-N 3.1Å; F828-K832 WeakPolarHBondContact O-CB 3.5Å; F828-K832 PolarHBondContact O-N 2.8Å
829	D	86.3	Confident	86.6	Confident	107 Å²	107	104 Å²	104	57%	0.572	51%	0.507	S	S	*	.	H	α-helix	trans	-65	-36.4	173.8	-71	-35.3	0	0	0	111.4	N825 A833	N825-D829 PolarHBondContact O-N 3.28Å; D829-A833 VanDerWaalsContact O-CB 3.26Å; D829-A833 WeakPolarHBondContact O-CB 3.47Å; D829-A833 PolarHBondContact O-N 2.97Å
830	K	86.9	Confident	85.9	Confident	127 Å²	127	100.5 Å²	100.5	55%	0.552	50%	0.503	S	S	*	.	H	α-helix	trans	-70.4	-43.7	173	-75.7	172.3	177.9	-176.4	0	112.5	K826 Q827 F828 K832 A833 K834	K826-K830 WeakPolarHBondContact O-CD 3.45Å; K826-K830 VanDerWaalsContact O-CG 3.25Å; K826-K830 WeakPolarHBondContact O-CG 3.2Å; K826-K830 PolarHBondContact O-N 2.85Å; Q827-K830 WeakPolarHBondContact O-CB 3.2Å; Q827-K830 PolarHBondContact O-N 2.88Å; F828-K830 VanDerWaalsContact C-N 3.33Å; K830-K832 VanDerWaalsContact C-N 3.31Å; K830-A833 PolarHBondContact O-N 2.59Å; K830-K834 WeakPolarHBondContact O-CB 3.49Å; K830-K834 PolarHBondContact O-N 2.87Å
831	E	84.1	Confident	85.2	Confident	72 Å²	72	101.1 Å²	101.1	34%	0.336	51%	0.508	S	S	.	.	H	α-helix	trans	-61.7	-41.6	173.7	-103.9	-74.9	115.7	0	0	110.5	Q827 F828 K834 R835	Q827-E831 WeakPolarHBondContact O-CB 3.35Å; Q827-E831 PolarHBondContact O-N 3.47Å; F828-E831 PolarHBondContact O-N 3.1Å; E831-K834 PolarHBondContact O-N 2.96Å; E831-R835 WeakPolarHBondContact O-CB 3.47Å; E831-R835 VanDerWaalsContact O-CG 3.26Å; E831-R835 WeakPolarHBondContact O-CG 3.46Å; E831-R835 PolarHBondContact O-N 2.71Å; E831-R835 IonicContact OE2-CZ 2.64Å; E831-R835 IonicContact OE2-NE 3.93Å; E831-R835 PolarHBondContact OE2-NE 2.77Å; E831-R835 IonicContact OE2-NH2 3.91Å; E831-R835 PolarHBondContact OE2-NH2 3.33Å
832	K	85.3	Confident	84.5	Confident	116 Å²	116	99 Å²	99	50%	0.504	50%	0.503	S	S	.	.	H	α-helix	trans	-63.3	-52	174.9	-179.6	178	170.6	-176.7	0	111.3	F828 K830 K834 R835 E836	F828-K832 WeakPolarHBondContact O-CB 3.5Å; F828-K832 PolarHBondContact O-N 2.8Å; K830-K832 VanDerWaalsContact C-N 3.31Å; K832-K834 VanDerWaalsContact C-N 3.26Å; K832-K834 PolarHBondContact O-N 2.78Å; K832-R835 CarbonylContact O-C 3.38Å; K832-R835 PolarHBondContact O-N 3.01Å; K832-R835 VanDerWaalsContact O-N 3.15Å; K832-E836 WeakPolarHBondContact CE-OE1 3.43Å; K832-E836 HydrophobicContact CG-CG 4.46Å; K832-E836 IonicContact NZ-OE1 3.8Å; K832-E836 WeakPolarHBondContact O-CB 3.27Å; K832-E836 WeakPolarHBondContact O-CG 3.37Å; K832-E836 PolarHBondContact O-N 2.88Å
833	A	83.4	Confident	83.8	Confident	55 Å²	55	96.7 Å²	96.7	46%	0.455	50%	0.497	S	S	.	.	H	α-helix	trans	-60.9	-35.3	176.2	0	0	0	0	0	112.3	D829 K830 A837	D829-A833 VanDerWaalsContact O-CB 3.26Å; D829-A833 WeakPolarHBondContact O-CB 3.47Å; D829-A833 PolarHBondContact O-N 2.97Å; K830-A833 PolarHBondContact O-N 2.59Å; A833-A837 VanDerWaalsContact O-CB 3.31Å; A833-A837 WeakPolarHBondContact O-CB 3.48Å; A833-A837 PolarHBondContact O-N 2.86Å
834	K	85.9	Confident	83	Confident	98 Å²	98	95.2 Å²	95.2	43%	0.426	50%	0.497	S	S	.	.	H	α-helix	trans	-67.2	-44.3	173.3	178.8	177.8	171.1	-71.5	0	111.6	K830 E831 K832 A837 E838	K830-K834 WeakPolarHBondContact O-CB 3.49Å; K830-K834 PolarHBondContact O-N 2.87Å; E831-K834 PolarHBondContact O-N 2.96Å; K832-K834 VanDerWaalsContact C-N 3.26Å; K832-K834 PolarHBondContact O-N 2.78Å; K834-A837 CarbonylContact O-C 3.52Å; K834-A837 PolarHBondContact O-N 2.83Å; K834-E838 VanDerWaalsContact CE-OE1 3.23Å; K834-E838 WeakPolarHBondContact CE-OE1 3.42Å; K834-E838 HydrophobicContact CG-CG 4.4Å; K834-E838 IonicContact NZ-OE1 2.67Å; K834-E838 PolarHBondContact NZ-OE1 3.06Å; K834-E838 IonicContact NZ-OE2 3.6Å; K834-E838 PolarHBondContact NZ-OE2 2.57Å; K834-E838 WeakPolarHBondContact O-CB 3.49Å; K834-E838 WeakPolarHBondContact O-CG 3.34Å; K834-E838 PolarHBondContact O-N 2.84Å
835	R	81.1	Confident	82.1	Confident	153 Å²	153	97.6 Å²	97.6	58%	0.577	51%	0.506	S	S	*	.	H	α-helix	trans	-68.9	-32.3	175.6	-72	177.6	-162.8	-167.3	5.1	112.5	E831 K832 K839	E831-R835 WeakPolarHBondContact O-CB 3.47Å; E831-R835 VanDerWaalsContact O-CG 3.26Å; E831-R835 WeakPolarHBondContact O-CG 3.46Å; E831-R835 PolarHBondContact O-N 2.71Å; E831-R835 IonicContact OE2-CZ 2.64Å; E831-R835 IonicContact OE2-NE 3.93Å; E831-R835 PolarHBondContact OE2-NE 2.77Å; E831-R835 IonicContact OE2-NH2 3.91Å; E831-R835 PolarHBondContact OE2-NH2 3.33Å; K832-R835 CarbonylContact O-C 3.38Å; K832-R835 PolarHBondContact O-N 3.01Å; K832-R835 VanDerWaalsContact O-N 3.15Å; R835-K839 WeakPolarHBondContact O-CB 3.25Å; R835-K839 PolarHBondContact O-N 3.49Å
836	E	82.6	Confident	81.3	Confident	112 Å²	112	98.6 Å²	98.6	52%	0.523	51%	0.506	S	S	.	.	H	α-helix	trans	-69.2	-38.1	172.2	-74.2	170.5	175.8	0	0	110.7	K832 A840	K832-E836 WeakPolarHBondContact CE-OE1 3.43Å; K832-E836 HydrophobicContact CG-CG 4.46Å; K832-E836 IonicContact NZ-OE1 3.8Å; K832-E836 WeakPolarHBondContact O-CB 3.27Å; K832-E836 WeakPolarHBondContact O-CG 3.37Å; K832-E836 PolarHBondContact O-N 2.88Å; E836-A840 VanDerWaalsContact O-CB 3.25Å; E836-A840 WeakPolarHBondContact O-CB 3.29Å; E836-A840 PolarHBondContact O-N 2.87Å
837	A	79.4	Confident	80.2	Confident	61 Å²	61	96.9 Å²	96.9	50%	0.504	51%	0.509	S	S	.	.	H	α-helix	trans	-71.2	-42	172.4	0	0	0	0	0	113.4	A833 K834 A840 A841	A833-A837 VanDerWaalsContact O-CB 3.31Å; A833-A837 WeakPolarHBondContact O-CB 3.48Å; A833-A837 PolarHBondContact O-N 2.86Å; K834-A837 CarbonylContact O-C 3.52Å; K834-A837 PolarHBondContact O-N 2.83Å; A837-A840 PolarHBondContact O-N 3.19Å; A837-A841 WeakPolarHBondContact O-CB 3.28Å; A837-A841 PolarHBondContact O-N 2.73Å
838	E	80.6	Confident	79.3	Confident	100 Å²	100	98 Å²	98	47%	0.467	51%	0.512	S	S	.	.	H	α-helix	trans	-66.9	-37.5	174.8	-77.3	174.1	154.4	0	0	111.1	K834 A841 A842	K834-E838 VanDerWaalsContact CE-OE1 3.23Å; K834-E838 WeakPolarHBondContact CE-OE1 3.42Å; K834-E838 HydrophobicContact CG-CG 4.4Å; K834-E838 IonicContact NZ-OE1 2.67Å; K834-E838 PolarHBondContact NZ-OE1 3.06Å; K834-E838 IonicContact NZ-OE2 3.6Å; K834-E838 PolarHBondContact NZ-OE2 2.57Å; K834-E838 WeakPolarHBondContact O-CB 3.49Å; K834-E838 WeakPolarHBondContact O-CG 3.34Å; K834-E838 PolarHBondContact O-N 2.84Å; E838-A841 PolarHBondContact O-N 3.18Å; E838-A842 VanDerWaalsContact O-CB 3.23Å; E838-A842 WeakPolarHBondContact O-CB 3.48Å; E838-A842 PolarHBondContact O-N 2.91Å
839	K	80.7	Confident	78.2	Confident	134 Å²	134	93.6 Å²	93.6	58%	0.583	50%	0.502	S	S	*	.	H	α-helix	trans	-67.2	-44.3	170.9	-177	175.3	176.5	-175.6	0	111.4	R835 A841 A842 D843	R835-K839 WeakPolarHBondContact O-CB 3.25Å; R835-K839 PolarHBondContact O-N 3.49Å; K839-A841 VanDerWaalsContact C-N 3.26Å; K839-A841 PolarHBondContact O-N 3.33Å; K839-A842 PolarHBondContact O-N 2.92Å; K839-D843 WeakPolarHBondContact CE-OD2 3.18Å; K839-D843 WeakPolarHBondContact CG-OD2 3.43Å; K839-D843 VanDerWaalsContact O-CB 3.27Å; K839-D843 WeakPolarHBondContact O-CB 3.33Å; K839-D843 VanDerWaalsContact O-CG 3.26Å; K839-D843 PolarHBondContact O-N 3.47Å
840	A	77.9	Confident	76.9	Confident	60 Å²	60	92.7 Å²	92.7	50%	0.496	50%	0.495	S	S	.	.	H	α-helix	trans	-61.9	-34.7	175.4	0	0	0	0	0	112.4	E836 A837 A844	E836-A840 VanDerWaalsContact O-CB 3.25Å; E836-A840 WeakPolarHBondContact O-CB 3.29Å; E836-A840 PolarHBondContact O-N 2.87Å; A837-A840 PolarHBondContact O-N 3.19Å; A840-A844 WeakPolarHBondContact O-CB 3.49Å; A840-A844 PolarHBondContact O-N 3.29Å; A840-A844 VanDerWaalsContact O-N 3.08Å
841	A	77.2	Confident	75.5	Confident	61 Å²	61	94.6 Å²	94.6	50%	0.504	51%	0.506	S	S	.	.	H	α-helix	trans	-69.8	-45.2	172.7	0	0	0	0	0	112.1	A837 E838 K839 A844 E845	A837-A841 WeakPolarHBondContact O-CB 3.28Å; A837-A841 PolarHBondContact O-N 2.73Å; E838-A841 PolarHBondContact O-N 3.18Å; K839-A841 VanDerWaalsContact C-N 3.26Å; K839-A841 PolarHBondContact O-N 3.33Å; A841-A844 CarbonylContact O-C 3.54Å; A841-A844 PolarHBondContact O-N 2.88Å; A841-E845 WeakPolarHBondContact O-CB 3.09Å; A841-E845 PolarHBondContact O-N 3.05Å
842	A	76.6	Confident	74.2	Confident	49 Å²	49	99.2 Å²	99.2	41%	0.405	53%	0.527	S	S	.	.	H	α-helix	trans	-66.9	-39.5	178.2	0	0	0	0	0	112.3	E838 K839 A844 E845 K846	E838-A842 VanDerWaalsContact O-CB 3.23Å; E838-A842 WeakPolarHBondContact O-CB 3.48Å; E838-A842 PolarHBondContact O-N 2.91Å; K839-A842 PolarHBondContact O-N 2.92Å; A842-A844 VanDerWaalsContact C-N 3.33Å; A842-E845 PolarHBondContact O-N 2.81Å; A842-K846 WeakPolarHBondContact O-CB 3.16Å; A842-K846 PolarHBondContact O-N 3.27Å
843	D	76.6	Confident	72.9	Confident	82 Å²	82	96.7 Å²	96.7	44%	0.439	53%	0.528	S	S	.	.	H	α-helix	trans	-67.3	-33.8	174	-70.7	-17.7	0	0	0	110.6	K839 A847	K839-D843 WeakPolarHBondContact CE-OD2 3.18Å; K839-D843 WeakPolarHBondContact CG-OD2 3.43Å; K839-D843 VanDerWaalsContact O-CB 3.27Å; K839-D843 WeakPolarHBondContact O-CB 3.33Å; K839-D843 VanDerWaalsContact O-CG 3.26Å; K839-D843 PolarHBondContact O-N 3.47Å; D843-A847 WeakPolarHBondContact O-CB 3.03Å; D843-A847 PolarHBondContact O-N 2.68Å
844	A	73.9	Confident	71.5	Confident	53 Å²	53	100.4 Å²	100.4	44%	0.438	54%	0.54	S	S	.	.	H	α-helix	trans	-74.3	-30.2	172.7	0	0	0	0	0	113.6	A840 A841 A842 K848	A840-A844 WeakPolarHBondContact O-CB 3.49Å; A840-A844 PolarHBondContact O-N 3.29Å; A840-A844 VanDerWaalsContact O-N 3.08Å; A841-A844 CarbonylContact O-C 3.54Å; A841-A844 PolarHBondContact O-N 2.88Å; A842-A844 VanDerWaalsContact C-N 3.33Å; A844-K848 PolarHBondContact O-N 3.48Å
845	E	72.7	Confident	69.8	Low	145 Å²	145	104.9 Å²	104.9	68%	0.678	56%	0.56	S	S	*	*	H	α-helix	trans	-73.6	-40.7	170.7	-173	166.3	-142.3	0	0	110.8	A841 A842 A847 K848 A849	A841-E845 WeakPolarHBondContact O-CB 3.09Å; A841-E845 PolarHBondContact O-N 3.05Å; A842-E845 PolarHBondContact O-N 2.81Å; E845-A847 PolarHBondContact O-N 3.12Å; E845-K848 PolarHBondContact O-N 3.08Å; E845-A849 WeakPolarHBondContact O-CB 3.47Å; E845-A849 PolarHBondContact O-N 2.89Å
846	K	72.4	Confident	68.2	Low	118 Å²	118	105 Å²	105	51%	0.513	57%	0.571	S	S	.	*	H	α-helix	trans	-59.9	-42.8	170.4	-120.7	175	165	-85.5	0	111.8	A842 K848 A849 E850	A842-K846 WeakPolarHBondContact O-CB 3.16Å; A842-K846 PolarHBondContact O-N 3.27Å; K846-K848 VanDerWaalsContact C-N 3.27Å; K846-K848 PolarHBondContact O-N 2.86Å; K846-A849 PolarHBondContact O-N 2.92Å; K846-E850 IonicContact NZ-OE1 3.67Å; K846-E850 PolarHBondContact NZ-OE1 3.48Å; K846-E850 VanDerWaalsContact O-CB 3.27Å; K846-E850 WeakPolarHBondContact O-CB 3.29Å; K846-E850 WeakPolarHBondContact O-CG 3.27Å; K846-E850 PolarHBondContact O-N 3.09Å
847	A	67.3	Low	66.3	Low	59 Å²	59	107.2 Å²	107.2	49%	0.488	58%	0.579	S	S	.	*	H	α-helix	trans	-57.9	-40.4	176.4	0	0	0	0	0	112	D843 E845 E851	D843-A847 WeakPolarHBondContact O-CB 3.03Å; D843-A847 PolarHBondContact O-N 2.68Å; E845-A847 PolarHBondContact O-N 3.12Å; A847-E851 WeakPolarHBondContact O-CB 3.41Å; A847-E851 PolarHBondContact O-N 3.43Å; A847-E851 VanDerWaalsContact O-N 3.07Å
848	K	67.8	Low	64.4	Low	150 Å²	150	110.8 Å²	110.8	65%	0.652	59%	0.585	S	S	*	*	H	α-helix	trans	-70.6	-44	174	-68.8	175.1	179.5	178.1	0	112.6	A844 E845 K846 E850 E851 E852	A844-K848 PolarHBondContact O-N 3.48Å; E845-K848 PolarHBondContact O-N 3.08Å; K846-K848 VanDerWaalsContact C-N 3.27Å; K846-K848 PolarHBondContact O-N 2.86Å; K848-E850 VanDerWaalsContact C-N 3.33Å; K848-E850 PolarHBondContact O-N 2.87Å; K848-E851 WeakPolarHBondContact O-CB 3.37Å; K848-E851 PolarHBondContact O-N 3.34Å; K848-E852 PolarHBondContact O-N 2.89Å; K848-E852 VanDerWaalsContact O-N 3.08Å
849	A	63	Low	62.6	Low	53 Å²	53	114.6 Å²	114.6	44%	0.438	60%	0.6	S	S	.	*	H	α-helix	trans	-65.3	-36.3	179.2	0	0	0	0	0	112.1	E845 K846 E852 A853	E845-A849 WeakPolarHBondContact O-CB 3.47Å; E845-A849 PolarHBondContact O-N 2.89Å; K846-A849 PolarHBondContact O-N 2.92Å; A849-E852 PolarHBondContact O-N 3.08Å; A849-A853 WeakPolarHBondContact O-CB 3.34Å; A849-A853 PolarHBondContact O-N 3.3Å
850	E	59.5	Low	60.7	Low	88 Å²	88	115.8 Å²	115.8	41%	0.411	61%	0.613	S	S	.	*	H	α-helix	trans	-75.4	-27.2	175.1	-70.3	174.4	-167	0	0	111.7	K846 K848 N854	K846-E850 IonicContact NZ-OE1 3.67Å; K846-E850 PolarHBondContact NZ-OE1 3.48Å; K846-E850 VanDerWaalsContact O-CB 3.27Å; K846-E850 WeakPolarHBondContact O-CB 3.29Å; K846-E850 WeakPolarHBondContact O-CG 3.27Å; K846-E850 PolarHBondContact O-N 3.09Å; K848-E850 VanDerWaalsContact C-N 3.33Å; K848-E850 PolarHBondContact O-N 2.87Å; E850-N854 VanDerWaalsContact O-CB 3.26Å; E850-N854 WeakPolarHBondContact O-CB 3.31Å; E850-N854 PolarHBondContact O-N 2.98Å; E850-N854 VanDerWaalsContact O-N 3.11Å; E850-N854 PolarHBondContact O-ND2 3.13Å
851	E	58	Low	59.1	Low	167 Å²	167	119.5 Å²	119.5	78%	0.78	63%	0.625	S	S	*	*	H	α-helix	trans	-67.5	-36.7	169.3	-169.6	168.8	-148.9	0	0	112.2	A847 K848	A847-E851 WeakPolarHBondContact O-CB 3.41Å; A847-E851 PolarHBondContact O-N 3.43Å; A847-E851 VanDerWaalsContact O-N 3.07Å; K848-E851 WeakPolarHBondContact O-CB 3.37Å; K848-E851 PolarHBondContact O-N 3.34Å
852	E	57	Low	57.7	Low	170 Å²	170	124 Å²	124	79%	0.794	63%	0.633	S	S	*	*	H	α-helix	trans	-78.5	-38.5	171.4	-70.1	-162.1	118.7	0	0	113.5	K848 A849	K848-E852 PolarHBondContact O-N 2.89Å; K848-E852 VanDerWaalsContact O-N 3.08Å; A849-E852 PolarHBondContact O-N 3.08Å
853	A	57.5	Low	56.4	Low	63 Å²	63	127.2 Å²	127.2	52%	0.521	65%	0.647	S	S	.	*	H	α-helix	trans	-81.9	-20.8	-171.7	0	0	0	0	0	115	A849 K855 L856	A849-A853 WeakPolarHBondContact O-CB 3.34Å; A849-A853 PolarHBondContact O-N 3.3Å; A853-K855 PolarHBondContact O-N 3.38Å; A853-L856 PolarHBondContact O-N 3.5Å
854	N	54.9	Low	55.2	Low	133 Å²	133	130.3 Å²	130.3	71%	0.711	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	3.5	-177.5	-98.1	-62.7	0	0	0	115.6	E850 L856	E850-N854 VanDerWaalsContact O-CB 3.26Å; E850-N854 WeakPolarHBondContact O-CB 3.31Å; E850-N854 PolarHBondContact O-N 2.98Å; E850-N854 VanDerWaalsContact O-N 3.11Å; E850-N854 PolarHBondContact O-ND2 3.13Å; N854-L856 VanDerWaalsContact C-N 3.34Å
855	K	49.9	Very low	53.8	Low	192 Å²	192	134.6 Å²	134.6	84%	0.835	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-14.3	165.6	-82.1	175.4	177.2	164.9	0	114.5	A853	A853-K855 PolarHBondContact O-N 3.38Å
856	L	47.7	Very low	52.3	Low	156 Å²	156	132.4 Å²	132.4	82%	0.817	67%	0.674	S	S	*	*	S	Bend	trans	-133	65.1	-174.5	-72.2	173.2	0	0	0	114.6	A853 N854	A853-L856 PolarHBondContact O-N 3.5Å; N854-L856 VanDerWaalsContact C-N 3.34Å
857	K	41.1	Very low	50.9	Low	157 Å²	157	135.3 Å²	135.3	68%	0.683	69%	0.689	S	S	*	*			trans	47.8	121.6	141.1	-83.8	176	154.9	-84.2	0	121.5
858	E	40.1	Very low	49.8	Very low	136 Å²	136	141.1 Å²	141.1	64%	0.636	70%	0.704	S	S	*	*			trans	68.7	110.2	131.1	-67.2	163.7	155.3	0	0	117.9
859	K	42.7	Very low	48.8	Very low	180 Å²	180	139.4 Å²	139.4	78%	0.783	71%	0.71	S	S	*	*				96.4	114.4	62.1	-92.4	-171.1	-178.3	-179.9	0	112
860	D	41.5	Very low	47.8	Very low	160 Å²	160	145.8 Å²	145.8	86%	0.856	73%	0.731	S	S	*	*				-178.9	160.5	109.6	-89.9	-14.8	0	0	0	110.3
861	D	44.6	Very low	47.1	Very low	138 Å²	138	150.2 Å²	150.2	74%	0.738	75%	0.752	S	S	*	*			trans	-152.4	145.5	-161.9	-167.5	23.4	0	0	0	114.1
862	K	47.5	Very low	46.5	Very low	156 Å²	156	150.8 Å²	150.8	68%	0.678	75%	0.752	S	S	*	*			trans	77	165.7	143.3	-111.5	178.6	-174	176	0	126.5
863	V	49.7	Very low	45.9	Very low	115 Å²	115	150.5 Å²	150.5	70%	0.697	75%	0.75	S	S	*	*			trans	82.2	144.4	147.9	155.4	0	0	0	0	119.5
864	E	50.1	Low	45.4	Very low	148 Å²	148	158.8 Å²	158.8	69%	0.692	77%	0.768	S	S	*	*			cis	164.9	150.5	-31.9	-96.5	146.6	-123.5	0	0	107.2
865	D	45.1	Very low	45.3	Very low	143 Å²	143	161.2 Å²	161.2	77%	0.765	78%	0.775	S	S	*	*			cis	-170.3	169.5	-14.1	-178.1	37.3	0	0	0	111.1
866	C	41.5	Very low	45.7	Very low	99 Å²	99	157 Å²	157	67%	0.669	77%	0.766	S	S	*	*			trans	89.9	176.9	139.2	-136.3	0	0	0	0	124.7
867	E	43.5	Very low	46.1	Very low	178 Å²	178	155.9 Å²	155.9	83%	0.832	77%	0.765	S	S	*	*			trans	85.7	156.6	172.5	-55.7	-156.5	138.8	0	0	121.2
868	K	43.6	Very low	47	Very low	182 Å²	182	155.4 Å²	155.4	79%	0.791	77%	0.77	S	S	*	*				-167.6	168.7	-62.2	-123.9	179.8	-179.1	174.4	0	113.2
869	S	45.5	Very low	47.6	Very low	113 Å²	113	153.8 Å²	153.8	79%	0.79	78%	0.78	S	S	*	*			trans	71.3	159.5	164.3	75.7	0	0	0	0	117.6
870	E	44	Very low	47.8	Very low	188 Å²	188	155.5 Å²	155.5	88%	0.879	81%	0.805	S	S	*	*			cis	-126.2	-174	7.4	-71	-172.8	114.8	0	0	113.4
871	E	44.1	Very low	48.2	Very low	181 Å²	181	155.3 Å²	155.3	85%	0.846	80%	0.803	S	S	*	*			trans	-121.7	-176.1	-171.2	-58.4	-177.1	126.3	0	0	114.4
872	K	44.1	Very low	48.4	Very low	179 Å²	179	156.2 Å²	156.2	78%	0.778	81%	0.806	S	S	*	*			trans	88.9	142.7	165	-66.2	-172.1	177.4	-169.5	0	118.3
873	E	44.3	Very low	48.4	Very low	163 Å²	163	156.2 Å²	156.2	76%	0.762	81%	0.813	S	S	*	*			cis	-159.8	150.4	-14.8	-175.4	156.1	-157.5	0	0	107.4
874	W	47.4	Very low	48.3	Very low	237 Å²	237	158.6 Å²	158.6	90%	0.898	82%	0.82	S	S	*	*			trans	-120.3	134.9	-172.5	-74.6	73.1	0	0	0	112.3
875	E	53.4	Low	48.2	Very low	184 Å²	184	159.3 Å²	159.3	86%	0.86	83%	0.828	S	S	*	*			trans	-110.5	134.7	162.6	-173.3	169	-149.2	0	0	109
876	V	59.2	Low	48.4	Very low	104 Å²	104	160.4 Å²	160.4	63%	0.63	83%	0.832	S	S	*	*			trans	-129.7	124.7	-177	177.1	0	0	0	0	109.3
877	V	55.5	Low	48.9	Very low	132 Å²	132	164.8 Å²	164.8	80%	0.8	84%	0.844	S	S	*	*			trans	-132.9	121.1	162.2	-178.2	0	0	0	0	107.1
878	D	59.9	Low	49.3	Very low	147 Å²	147	163.8 Å²	163.8	79%	0.786	85%	0.845	S	S	*	*			trans	-67.1	152.1	-176.4	-72.2	-61.2	0	0	0	113
879	A	52.7	Low	49.8	Very low	103 Å²	103	162.3 Å²	162.3	85%	0.851	85%	0.849	S	S	*	*			trans	-108.6	97.1	176.1	0	0	0	0	0	111.8
880	V	47.6	Very low	50.2	Low	216 Å²	216	166.7 Å²	166.7	100%	1.309	85%	0.854	S	S	*	*			trans	-142.3	0	156.4	-179	0	0	0	0	108.7

Retrieved 880 of 880 residues in 272.1 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).