A0A087Y5Z0_POEFO Loading...

Oxysterol-binding protein

Plays a role in regulating ADIPOQ and FABP4 levels in differentiating adipocytes and is also involved in regulation of adipocyte triglyceride storage. Weakly binds 25-hydroxycholesterol. Interacts with OSBPL9 to function as lipid transfer proteins. Together they form a heterodimer that localizes at the ER-trans-Golgi membrane contact sites, and exchanges phosphatidylserine (1,2-diacyl-sn-glycero-3-phospho-L-serine, PS) for phosphatidylinositol-4-phosphate (1,2-diacyl-sn-glycero-3-phospho-(1D-myo-inositol 4-phosphate), PI(4)P) between the two organelles, a step that is critical for sphingomyelin synthesis in the Golgi complex.

AlphaFold DB , UniProt , Accession A0A087Y5Z0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 718 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.8	Very low	27.3	Very low	236 Å²	236	140.1 Å²	140.1	100%	1.163	81%	0.807	S	S	*	*				0	97.5	0	-69.4	-178.4	179.8	0	0	105.8
2	Q	26.3	Very low	27.2	Very low	204 Å²	204	143.2 Å²	143.2	95%	0.953	81%	0.808	S	S	*	*				50.1	125.5	98.6	-77.6	-177.9	-6.7	0	0	111.5
3	G	27.9	Very low	27.2	Very low	67 Å²	67	140.7 Å²	140.7	69%	0.691	79%	0.792	S	S	*	*			cis	-165	159.9	4.8	0	0	0	0	0	106.5
4	E	28.4	Very low	27.3	Very low	186 Å²	186	143 Å²	143	87%	0.869	79%	0.793	S	S	*	*				45.2	129.5	97.5	-81.7	-171.3	160.6	0	0	113.4
5	T	28.6	Very low	27.3	Very low	121 Å²	121	138.1 Å²	138.1	74%	0.742	79%	0.788	S	S	*	*			cis	-176.5	157.4	34.1	12.1	0	0	0	0	110
6	A	26.4	Very low	27.2	Very low	96 Å²	96	142.5 Å²	142.5	79%	0.793	80%	0.796	S	S	*	*			trans	49.5	154.2	135	0	0	0	0	0	121.6
7	A	27.1	Very low	27.3	Very low	83 Å²	83	140.8 Å²	140.8	69%	0.686	79%	0.789	S	S	*	*			cis	173.5	-178.7	-16.2	0	0	0	0	0	105.6
8	V	25.7	Very low	27.2	Very low	132 Å²	132	139.7 Å²	139.7	80%	0.8	78%	0.781	S	S	*	*			trans	82.5	135.1	155.3	-179.8	0	0	0	0	115.6
9	R	25.6	Very low	27.1	Very low	216 Å²	216	140 Å²	140	82%	0.815	79%	0.787	S	S	*	*			cis	170.7	161.1	-15.9	-126.3	-179.8	-171.2	176	1.6	106
10	V	26.3	Very low	26.9	Very low	132 Å²	132	142.9 Å²	142.9	80%	0.8	79%	0.791	S	S	*	*			trans	76.7	139.2	144.2	170	0	0	0	0	117.1
11	A	25.9	Very low	28.2	Very low	68 Å²	68	141.2 Å²	141.2	56%	0.562	79%	0.787	S	S	*	*			cis	-172.9	160.8	-12.4	0	0	0	0	0	108
12	E	26.9	Very low	28.3	Very low	177 Å²	177	136.2 Å²	136.2	83%	0.827	77%	0.772	S	S	*	*			trans	38.9	141	133.6	-62.3	171	166.8	0	0	119.2
13	N	27	Very low	28.3	Very low	111 Å²	111	133.9 Å²	133.9	59%	0.594	77%	0.766	S	S	*	*			cis	-176.3	154.1	48.8	-149.9	13.1	0	0	0	112
14	E	28.3	Very low	28.2	Very low	173 Å²	173	142.4 Å²	142.4	81%	0.808	78%	0.777	S	S	*	*			trans	41	139.7	142.7	-74.7	167.3	172.3	0	0	121.7
15	G	26.6	Very low	28.1	Very low	70 Å²	70	139.7 Å²	139.7	72%	0.722	77%	0.774	S	S	*	*			cis	148.1	155.7	12.6	0	0	0	0	0	110.2
16	K	26.7	Very low	28.6	Very low	208 Å²	208	139.2 Å²	139.2	90%	0.904	77%	0.772	S	S	*	*			trans	83.7	144	167.5	-74.6	-176.7	171.7	174.6	0	120.3
17	V	28	Very low	28.6	Very low	113 Å²	113	140.4 Å²	140.4	69%	0.685	78%	0.775	S	S	*	*			cis	-171.8	140.5	-18.2	129.6	0	0	0	0	107.5
18	D	25.5	Very low	28.6	Very low	122 Å²	122	142.4 Å²	142.4	65%	0.652	78%	0.784	S	S	*	*			trans	25.2	134.2	152.2	-51	-39.4	0	0	0	124.5
19	T	25.2	Very low	28.6	Very low	145 Å²	145	139.2 Å²	139.2	89%	0.89	78%	0.778	S	S	*	*				-177.9	139.4	103	24.6	0	0	0	0	113.3
20	F	24.8	Very low	28.7	Very low	198 Å²	198	141.1 Å²	141.1	87%	0.868	79%	0.785	S	S	*	*			trans	-91	-173.1	-179.6	-80.4	-87.1	0	0	0	112.7
21	P	54.2	Low	29	Very low	108 Å²	108	140 Å²	140	70%	0.701	79%	0.79	S	S	*	*				-130.7	-171	-53.8	36.7	-18.8	0	0	0	111.5
22	P	32.9	Very low	29.2	Very low	130 Å²	130	140 Å²	140	84%	0.844	80%	0.797	S	S	*	*				-150.5	163.6	104.6	34.2	-14.5	0	0	0	117.4
23	N	26.5	Very low	29.3	Very low	155 Å²	155	135.4 Å²	135.4	83%	0.829	80%	0.796	S	S	*	*			trans	-64.5	144	176.2	-100.4	-27.2	0	0	0	115.6
24	R	26.2	Very low	29.4	Very low	246 Å²	246	139.8 Å²	139.8	93%	0.928	81%	0.81	S	S	*	*				177	135.5	119.4	-95.5	174.2	-177.5	-170.1	1.6	112.6
25	T	25.5	Very low	29.5	Very low	130 Å²	130	136.5 Å²	136.5	80%	0.798	81%	0.806	S	S	*	*			trans	-86.6	-172.2	-178	40.6	0	0	0	0	113.1
26	P	39.8	Very low	29.7	Very low	110 Å²	110	144.2 Å²	144.2	71%	0.714	81%	0.813	S	S	*	*			cis	-140.8	-175.2	-43.4	36.8	-18.1	0	0	0	115.5
27	S	25.6	Very low	30.1	Very low	122 Å²	122	142.5 Å²	142.5	85%	0.853	81%	0.808	S	S	*	*			trans	90.6	138.1	154	83.8	0	0	0	0	117.4
28	S	27.4	Very low	30.8	Very low	124 Å²	124	145.3 Å²	145.3	87%	0.867	81%	0.808	S	S	*	*			cis	-150.4	158.5	15.5	103.2	0	0	0	0	107.3
29	G	25.8	Very low	31.7	Very low	65 Å²	65	144 Å²	144	67%	0.67	81%	0.808	S	S	*	*			cis	166.2	148.5	7.3	0	0	0	0	0	107.9
30	R	28.1	Very low	32.6	Very low	257 Å²	257	143.2 Å²	143.2	97%	0.97	80%	0.799	S	S	*	*			trans	174.7	136.7	141.7	-112.6	177.7	168.8	174.3	-3.7	109.8	G32	R30-G32 PolarHBondContact O-N 3.37Å
31	A	32.6	Very low	33.9	Very low	109 Å²	109	140.4 Å²	140.4	90%	0.901	79%	0.788	S	S	*	*			trans	-64.3	122.3	-172.5	0	0	0	0	0	112.9
32	G	29.2	Very low	34	Very low	68 Å²	68	137.7 Å²	137.7	70%	0.701	77%	0.767	S	S	*	*			trans	-104.5	140.9	161.4	0	0	0	0	0	109.8	R30	R30-G32 PolarHBondContact O-N 3.37Å
33	G	28.9	Very low	35.5	Very low	79 Å²	79	137.9 Å²	137.9	81%	0.814	76%	0.756	S	S	*	*			trans	-52.7	136.8	-178.8	0	0	0	0	0	112.8	S35	G33-S35 PolarHBondContact O-N 3.02Å
34	K	30.5	Very low	37.6	Very low	203 Å²	203	134.3 Å²	134.3	88%	0.883	74%	0.737	S	S	*	*			trans	-70.4	94.7	174	-69.7	-175.6	176.7	-178.7	0	109	W36	K34-W36 PolarHBondContact O-N 3.27Å
35	S	29.4	Very low	40.6	Very low	104 Å²	104	123.4 Å²	123.4	73%	0.727	70%	0.697	S	S	*	*			trans	-57.9	121.2	152.9	-179.5	0	0	0	0	107.4	G33 Q37	G33-S35 PolarHBondContact O-N 3.02Å; S35-Q37 PolarHBondContact O-N 3.19Å
36	W	30.9	Very low	43.7	Very low	233 Å²	233	120.2 Å²	120.2	88%	0.883	68%	0.675	S	S	*	*			trans	-58.3	112.3	169.9	-69.1	93	0	0	0	107.8	K34 Y38	K34-W36 PolarHBondContact O-N 3.27Å; W36-Y38 PolarHBondContact O-N 3.26Å
37	Q	34.3	Very low	46.1	Very low	171 Å²	171	115.6 Å²	115.6	80%	0.799	65%	0.648	S	S	*	*			trans	-69.9	124.1	176.1	-80.6	175.3	-29.8	0	0	108.5	S35 S39	S35-Q37 PolarHBondContact O-N 3.19Å; Q37-S39 PolarHBondContact O-N 3.22Å; Q37-S39 VanDerWaalsContact O-N 3.13Å
38	Y	42.8	Very low	49.3	Very low	173 Å²	173	113.8 Å²	113.8	68%	0.678	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-5.8	-171.8	-169.9	-99.3	0	0	0	114.7	W36 M42	W36-Y38 PolarHBondContact O-N 3.26Å; Y38-M42 HydrophobicContact CE2-CE 4.22Å
39	S	45.9	Very low	52.4	Low	93 Å²	93	107.9 Å²	107.9	65%	0.65	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-22.6	-157.5	70.5	0	0	0	0	117.8	Q37	Q37-S39 PolarHBondContact O-N 3.22Å; Q37-S39 VanDerWaalsContact O-N 3.13Å
40	D	42.5	Very low	55.6	Low	130 Å²	130	106 Å²	106	70%	0.695	56%	0.556	S	S	*	*	S	Bend	trans	-118.4	0.9	-164.4	-70.2	12.2	0	0	0	115.3
41	H	53.3	Low	58.6	Low	138 Å²	138	94.6 Å²	94.6	64%	0.639	51%	0.513	S	S	*	.	S	Bend	trans	-124.3	4.4	-173.7	-72.7	-38.9	0	0	0	116.2
42	M	56.9	Low	61.1	Low	52 Å²	52	91.1 Å²	91.1	26%	0.256	48%	0.477	S	S	.	.			trans	-126.1	35.8	-173.1	-97.3	168.8	68.4	0	0	114.6	Y38 N44 N68	Y38-M42 HydrophobicContact CE2-CE 4.22Å; M42-N44 PolarHBondContact O-N 3.43Å; M42-N68 HydrophobicContact CE-CB 4.35Å; M42-N68 PolarHBondContact O-ND2 3.44Å
43	E	62.7	Low	63.7	Low	134 Å²	134	89.2 Å²	89.2	63%	0.626	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-63.6	135.5	171.8	-57.1	172	148.2	0	0	110.5	I45 N68 R134	E43-I45 PolarHBondContact O-N 2.76Å; E43-N68 PolarHBondContact O-ND2 3.16Å; E43-R134 PolarHBondContact O-NH1 2.87Å; E43-R134 IonicContact OE2-NH2 2.69Å; E43-R134 PolarHBondContact OE2-NH2 3.43Å
44	N	72.1	Confident	65.8	Low	80 Å²	80	86.7 Å²	86.7	43%	0.428	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-63.5	128.1	168.9	-68.8	-37.2	0	0	0	108.3	M42 L66 N68	M42-N44 PolarHBondContact O-N 3.43Å; N44-L66 WeakPolarHBondContact CB-O 3.31Å; N44-L66 PolarHBondContact OD1-O 2.88Å; N44-N68 WeakPolarHBondContact OD1-CB 3.47Å; N44-N68 PolarHBondContact OD1-N 3.17Å
45	I	87.8	Confident	67.4	Low	16 Å²	16	78.6 Å²	78.6	8%	0.082	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-98.8	129	173	-175.5	177.7	0	0	0	108	E43 L66 H130 W131 R134	E43-I45 PolarHBondContact O-N 2.76Å; I45-L66 HydrophobicContact CG2-CB 3.52Å; I45-L66 HydrophobicContact CG2-CD2 3.62Å; I45-L66 HydrophobicContact CG2-CG 4.18Å; I45-L66 WeakPolarHBondContact O-CB 3.45Å; I45-L66 PolarHBondContact O-N 2.86Å; I45-H130 WeakPolarHBondContact CD1-CD2 3.29Å; I45-W131 HydrophobicContact CD1-CD2 3.71Å; I45-W131 HydrophobicContact CD1-CE3 4.07Å; I45-W131 HydrophobicContact CD1-CG 4.11Å; I45-W131 HydrophobicContact CD1-CH2 4.35Å; I45-W131 HydrophobicContact CD1-CZ2 4.01Å; I45-W131 HydrophobicContact CD1-CZ3 4.38Å; I45-W131 HydrophobicContact CG1-CD2 4.42Å; I45-W131 HydrophobicContact CG1-CH2 4.02Å; I45-W131 HydrophobicContact CG1-CZ2 3.91Å; I45-W131 HydrophobicContact CG1-CZ3 4.32Å; I45-W131 HydrophobicContact CG2-CE3 4.05Å; I45-W131 HydrophobicContact CG2-CH2 4.17Å; I45-W131 HydrophobicContact CG2-CZ3 3.76Å; I45-R134 HydrophobicContact CD1-CG 4.45Å; I45-R134 HydrophobicContact CG2-CB 4.09Å; I45-R134 HydrophobicContact CG2-CG 4.35Å
46	D	90.4	Very high	69.2	Low	63 Å²	63	77.6 Å²	77.6	34%	0.337	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	154.8	168.4	60.4	-127.6	0	0	0	110.8	F63 F64 V65 R82	D46-F63 HydrophobicContact CB-CE1 3.96Å; D46-F63 HydrophobicContact CB-CZ 3.73Å; D46-F63 WeakPolarHBondContact OD2-CZ 3.37Å; D46-F64 CarbonylContact C-O 3.44Å; D46-F64 WeakPolarHBondContact CA-O 3.32Å; D46-F64 VanDerWaalsContact CB-O 3.28Å; D46-F64 WeakPolarHBondContact CB-O 3.38Å; D46-V65 HydrophobicContact CB-CB 4.32Å; D46-V65 HydrophobicContact CB-CG1 4.37Å; D46-V65 HydrophobicContact CB-CG2 3.91Å; D46-R82 IonicContact OD1-CZ 2.88Å; D46-R82 IonicContact OD1-NH1 2.6Å; D46-R82 PolarHBondContact OD1-NH1 2.83Å; D46-R82 IonicContact OD1-NH2 3.94Å; D46-R82 PolarHBondContact OD1-NH2 2.73Å
47	G	91.4	Very high	71.3	Confident	14 Å²	14	69.6 Å²	69.6	14%	0.144	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.4	169.8	-176.4	0	0	0	0	0	113.9	F64	G47-F64 PolarHBondContact N-O 3.18Å; G47-F64 PolarHBondContact O-N 3Å
48	Y	91.7	Very high	73.6	Confident	84 Å²	84	62.3 Å²	62.3	33%	0.329	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	123.3	179.6	-74.2	-84.3	0	0	0	111.2	R62 F63 E79	Y48-R62 WeakPolarHBondContact CA-O 3.36Å; Y48-F63 HydrophobicContact CD1-CB 4.3Å; Y48-F63 HydrophobicContact CD1-CD2 4.35Å; Y48-F63 AromaticContact CD2-CD2 3.91Å; Y48-F63 HydrophobicContact CD2-CD2 3.91Å; Y48-F63 HydrophobicContact CD2-CE2 4.43Å; Y48-F63 HydrophobicContact CE1-CB 4.02Å; Y48-F63 HydrophobicContact CE1-CD2 4.18Å; Y48-F63 AromaticContact CE2-CD2 3.7Å; Y48-F63 HydrophobicContact CE2-CD2 3.7Å; Y48-F63 HydrophobicContact CE2-CE2 4.21Å; Y48-F63 HydrophobicContact CG-CD2 4.23Å; Y48-F63 AromaticContact CZ-CD2 3.85Å; Y48-E79 HydrophobicContact CE2-CB 4.36Å; Y48-E79 WeakPolarHBondContact OH-CB 3.41Å; Y48-E79 PolarHBondContact OH-N 3.31Å; Y48-E79 VanDerWaalsContact OH-N 3.15Å
49	L	93	Very high	75.7	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	146.8	167.9	-61.1	174.7	0	0	0	109.2	K51 R62 F64 F107 L119 V121 W131	L49-K51 PolarHBondContact O-N 3.37Å; L49-R62 PolarHBondContact N-O 3.32Å; L49-R62 PolarHBondContact O-N 3Å; L49-R62 VanDerWaalsContact O-O 3.05Å; L49-F64 HydrophobicContact CB-CD2 3.61Å; L49-F64 HydrophobicContact CB-CE2 3.81Å; L49-F64 HydrophobicContact CB-CG 4.48Å; L49-F64 HydrophobicContact CD1-CB 4.21Å; L49-F64 HydrophobicContact CD1-CD2 3.98Å; L49-F64 HydrophobicContact CD1-CE2 4.49Å; L49-F64 HydrophobicContact CD1-CG 4.03Å; L49-F64 HydrophobicContact CG-CD2 4.09Å; L49-F107 HydrophobicContact CD1-CZ 4.05Å; L49-L119 HydrophobicContact CD1-CD1 3.99Å; L49-V121 HydrophobicContact CD2-CB 4.45Å; L49-V121 HydrophobicContact CD2-CG2 3.82Å; L49-W131 HydrophobicContact CD1-CD2 3.84Å; L49-W131 HydrophobicContact CD1-CE3 4.02Å; L49-W131 HydrophobicContact CD1-CG 4.35Å; L49-W131 HydrophobicContact CD1-CH2 4.3Å; L49-W131 HydrophobicContact CD1-CZ2 4.13Å; L49-W131 HydrophobicContact CD1-CZ3 4.24Å; L49-W131 HydrophobicContact CD2-CD2 4.34Å; L49-W131 HydrophobicContact CD2-CG 4.27Å; L49-W131 HydrophobicContact CG-CD2 4.43Å; L49-W131 HydrophobicContact CG-CZ2 4.19Å
50	M	92.1	Very high	77.7	Confident	25 Å²	25	56.4 Å²	56.4	12%	0.123	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	114.9	165.5	-68.7	-167.6	-70.6	0	0	108.2	W59 Q60 Y61 L119 R120	M50-W59 HydrophobicContact CB-CB 4.37Å; M50-W59 HydrophobicContact CB-CE3 3.88Å; M50-W59 VanDerWaalsContact O-CZ3 3.26Å; M50-W59 WeakPolarHBondContact O-CZ3 3.34Å; M50-W59 HydrophobicContact SD-CB 4.35Å; M50-Q60 CarbonylContact C-O 3.56Å; M50-Q60 WeakPolarHBondContact CA-O 3.46Å; M50-Y61 HydrophobicContact CG-CD1 4.03Å; M50-Y61 HydrophobicContact CG-CD2 4.26Å; M50-Y61 HydrophobicContact CG-CE1 3.81Å; M50-Y61 HydrophobicContact CG-CE2 4.04Å; M50-Y61 HydrophobicContact CG-CG 4.26Å; M50-Y61 HydrophobicContact SD-CE2 4.01Å; M50-L119 CarbonylContact O-C 3.55Å; M50-L119 WeakPolarHBondContact O-CA 2.93Å; M50-R120 HydrophobicContact CB-CB 4.23Å; M50-R120 WeakPolarHBondContact CB-O 3.24Å; M50-R120 HydrophobicContact CE-CB 4.25Å; M50-R120 HydrophobicContact CE-CG 3.74Å; M50-R120 PolarHBondContact N-O 2.98Å; M50-R120 PolarHBondContact O-N 2.83Å
51	K	91.7	Very high	80	Confident	18 Å²	18	56 Å²	56	8%	0.078	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	129.1	172	-173.7	-177.4	-174.6	-67.7	0	109.1	L49 T53 Q60 R62 F64 Y75 L119	L49-K51 PolarHBondContact O-N 3.37Å; K51-T53 PolarHBondContact O-N 3.05Å; K51-Q60 PolarHBondContact N-O 3.01Å; K51-Q60 PolarHBondContact O-N 3.33Å; K51-R62 HydrophobicContact CB-CB 4.37Å; K51-R62 HydrophobicContact CB-CG 3.96Å; K51-F64 HydrophobicContact CB-CE2 3.99Å; K51-F64 HydrophobicContact CB-CZ 3.9Å; K51-F64 HydrophobicContact CD-CZ 3.9Å; K51-F64 HydrophobicContact CG-CZ 4.05Å; K51-Y75 HydrophobicContact CD-CD1 4.14Å; K51-Y75 HydrophobicContact CD-CD2 4.26Å; K51-Y75 HydrophobicContact CD-CE1 3.84Å; K51-Y75 HydrophobicContact CD-CE2 3.99Å; K51-Y75 HydrophobicContact CD-CG 4.34Å; K51-Y75 VanDerWaalsContact CE-CE1 3.49Å; K51-L119 HydrophobicContact CB-CD2 3.97Å; K51-L119 HydrophobicContact CG-CD2 3.86Å
52	Y	86.2	Confident	81.9	Confident	36 Å²	36	51.6 Å²	51.6	14%	0.141	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	121.5	166.9	-168.1	-100.8	0	0	0	109.3	L55 W59 K118	Y52-L55 WeakPolarHBondContact OH-CA 3.38Å; Y52-L55 WeakPolarHBondContact OH-CD2 3.48Å; Y52-W59 AromaticContact CD2-CD2 4Å; Y52-W59 HydrophobicContact CD2-CD2 4Å; Y52-W59 AromaticContact CD2-CE2 3.86Å; Y52-W59 HydrophobicContact CD2-CG 4.22Å; Y52-W59 HydrophobicContact CD2-CZ2 4.38Å; Y52-W59 AromaticContact CD2-NE1 3.91Å; Y52-K118 PolarHBondContact N-O 3.4Å
53	T	82.5	Confident	83.6	Confident	28 Å²	28	49.3 Å²	49.3	17%	0.172	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-60.6	-176	39.5	0	0	0	0	111.8	K51 T57 G58 Q60	K51-T53 PolarHBondContact O-N 3.05Å; T53-T57 WeakPolarHBondContact CB-OG1 3.4Å; T53-T57 PolarHBondContact OG1-OG1 2.95Å; T53-G58 PolarHBondContact N-O 3.47Å; T53-G58 PolarHBondContact OG1-O 3.44Å; T53-Q60 HydrophobicContact CG2-CB 4.1Å; T53-Q60 HydrophobicContact CG2-CG 4.01Å; T53-Q60 WeakPolarHBondContact OG1-CG 3.12Å
54	N	73	Confident	85.2	Confident	26 Å²	26	42.9 Å²	42.9	14%	0.139	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	177.3	174.2	60.6	28.8	0	0	0	109.2	V56 T57 G58 S362 L364	N54-V56 PolarHBondContact O-N 3.26Å; N54-V56 PolarHBondContact OD1-N 2.66Å; N54-V56 VanDerWaalsContact OD1-N 3.12Å; N54-T57 VanDerWaalsContact CG-OG1 3.31Å; N54-T57 WeakPolarHBondContact OD1-CB 3.22Å; N54-T57 PolarHBondContact OD1-N 3.23Å; N54-T57 PolarHBondContact OD1-OG1 3.14Å; N54-G58 VanDerWaalsContact O-CA 3.27Å; N54-G58 WeakPolarHBondContact O-CA 3.29Å; N54-G58 PolarHBondContact O-N 2.68Å; N54-S362 PolarHBondContact ND2-O 2.99Å; N54-L364 WeakPolarHBondContact CB-O 3.44Å
55	L	64.8	Low	86.2	Confident	33 Å²	33	39.5 Å²	39.5	17%	0.173	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-30.7	179.6	-76.3	170.2	0	0	0	113.7	Y52 L361 F510 G512 M513 L547	Y52-L55 WeakPolarHBondContact OH-CA 3.38Å; Y52-L55 WeakPolarHBondContact OH-CD2 3.48Å; L55-L361 HydrophobicContact CD1-CB 4.14Å; L55-L361 HydrophobicContact CD1-CD1 3.86Å; L55-L361 HydrophobicContact CD1-CD2 4.06Å; L55-L361 HydrophobicContact CD1-CG 4.25Å; L55-F510 HydrophobicContact CD1-CE2 4.21Å; L55-F510 HydrophobicContact CD1-CZ 3.61Å; L55-F510 HydrophobicContact CG-CZ 4.03Å; L55-G512 WeakPolarHBondContact CD1-O 3.43Å; L55-M513 HydrophobicContact CD2-CG 4Å; L55-L547 HydrophobicContact CD1-CD1 4.11Å; L55-L547 HydrophobicContact CD1-CD2 4.31Å; L55-L547 HydrophobicContact CD1-CG 4.2Å; L55-L547 HydrophobicContact CD2-CD1 4.05Å
56	V	66.1	Low	86.4	Confident	83 Å²	83	38.8 Å²	38.8	50%	0.503	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-44.1	-173.8	176.8	0	0	0	0	112.2	N54	N54-V56 PolarHBondContact O-N 3.26Å; N54-V56 PolarHBondContact OD1-N 2.66Å; N54-V56 VanDerWaalsContact OD1-N 3.12Å
57	T	75.2	Confident	86.3	Confident	64 Å²	64	37.9 Å²	37.9	39%	0.393	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-16.1	-178.5	57.4	0	0	0	0	112.5	T53 N54 Q60	T53-T57 WeakPolarHBondContact CB-OG1 3.4Å; T53-T57 PolarHBondContact OG1-OG1 2.95Å; N54-T57 VanDerWaalsContact CG-OG1 3.31Å; N54-T57 WeakPolarHBondContact OD1-CB 3.22Å; N54-T57 PolarHBondContact OD1-N 3.23Å; N54-T57 PolarHBondContact OD1-OG1 3.14Å; T57-Q60 PolarHBondContact O-NE2 3.23Å
58	G	82.5	Confident	86	Confident	18 Å²	18	37.6 Å²	37.6	19%	0.186	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	63.6	-134.9	173.7	0	0	0	0	0	113.5	T53 N54	T53-G58 PolarHBondContact N-O 3.47Å; T53-G58 PolarHBondContact OG1-O 3.44Å; N54-G58 VanDerWaalsContact O-CA 3.27Å; N54-G58 WeakPolarHBondContact O-CA 3.29Å; N54-G58 PolarHBondContact O-N 2.68Å
59	W	86.9	Confident	85.7	Confident	75 Å²	75	40.9 Å²	40.9	28%	0.284	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	132.7	176.3	-68	98	0	0	0	110.5	M50 Y52 T106 K118 R120	M50-W59 HydrophobicContact CB-CB 4.37Å; M50-W59 HydrophobicContact CB-CE3 3.88Å; M50-W59 VanDerWaalsContact O-CZ3 3.26Å; M50-W59 WeakPolarHBondContact O-CZ3 3.34Å; M50-W59 HydrophobicContact SD-CB 4.35Å; Y52-W59 AromaticContact CD2-CD2 4Å; Y52-W59 HydrophobicContact CD2-CD2 4Å; Y52-W59 AromaticContact CD2-CE2 3.86Å; Y52-W59 HydrophobicContact CD2-CG 4.22Å; Y52-W59 HydrophobicContact CD2-CZ2 4.38Å; Y52-W59 AromaticContact CD2-NE1 3.91Å; W59-T106 HydrophobicContact CH2-CG2 4.03Å; W59-K118 HydrophobicContact CH2-CD 4.2Å; W59-K118 HydrophobicContact CH2-CG 3.71Å; W59-K118 HydrophobicContact CZ2-CD 4.33Å; W59-K118 HydrophobicContact CZ2-CG 4.34Å; W59-K118 HydrophobicContact CZ3-CG 4.43Å; W59-K118 WeakPolarHBondContact CZ3-O 3.44Å; W59-R120 HydrophobicContact CD2-CB 4.47Å; W59-R120 HydrophobicContact CE3-CB 3.87Å; W59-R120 HydrophobicContact CH2-CB 3.52Å; W59-R120 HydrophobicContact CZ2-CB 4.2Å; W59-R120 HydrophobicContact CZ3-CB 3.36Å
60	Q	88.8	Confident	85.3	Confident	67 Å²	67	43.3 Å²	43.3	31%	0.313	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	131.7	-176.8	-67.9	-70.3	-48.9	0	0	109.9	M50 K51 T53 T57 R62	M50-Q60 CarbonylContact C-O 3.56Å; M50-Q60 WeakPolarHBondContact CA-O 3.46Å; K51-Q60 PolarHBondContact N-O 3.01Å; K51-Q60 PolarHBondContact O-N 3.33Å; T53-Q60 HydrophobicContact CG2-CB 4.1Å; T53-Q60 HydrophobicContact CG2-CG 4.01Å; T53-Q60 WeakPolarHBondContact OG1-CG 3.12Å; T57-Q60 PolarHBondContact O-NE2 3.23Å; Q60-R62 PolarHBondContact O-N 3.49Å
61	Y	91.4	Very high	85.2	Confident	122 Å²	122	42.3 Å²	42.3	48%	0.478	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	126.4	171.9	-81	-82.9	0	0	0	110.1	M50 A122	M50-Y61 HydrophobicContact CG-CD1 4.03Å; M50-Y61 HydrophobicContact CG-CD2 4.26Å; M50-Y61 HydrophobicContact CG-CE1 3.81Å; M50-Y61 HydrophobicContact CG-CE2 4.04Å; M50-Y61 HydrophobicContact CG-CG 4.26Å; M50-Y61 HydrophobicContact SD-CE2 4.01Å; Y61-A122 HydrophobicContact CE1-CB 3.94Å; Y61-A122 WeakPolarHBondContact OH-CB 3.49Å
62	R	93.2	Very high	85.2	Confident	45 Å²	45	43.6 Å²	43.6	17%	0.17	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	144.2	175	-62.9	-64	177.7	-103.6	-0.8	108.4	Y48 L49 K51 Q60 F64 Y75 F76	Y48-R62 WeakPolarHBondContact CA-O 3.36Å; L49-R62 PolarHBondContact N-O 3.32Å; L49-R62 PolarHBondContact O-N 3Å; L49-R62 VanDerWaalsContact O-O 3.05Å; K51-R62 HydrophobicContact CB-CB 4.37Å; K51-R62 HydrophobicContact CB-CG 3.96Å; Q60-R62 PolarHBondContact O-N 3.49Å; R62-F64 HydrophobicContact CB-CD2 4.15Å; R62-F64 HydrophobicContact CB-CE2 3.69Å; R62-F64 HydrophobicContact CB-CZ 4.48Å; R62-Y75 HydrophobicContact CB-CD2 3.93Å; R62-Y75 HydrophobicContact CG-CD2 3.86Å; R62-Y75 HydrophobicContact CG-CE2 4.22Å; R62-F76 WeakPolarHBondContact CA-O 3.21Å; R62-F76 WeakPolarHBondContact CB-O 3.22Å; R62-F76 WeakPolarHBondContact CD-O 3.43Å
63	F	92.8	Very high	85.6	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.018	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	115.5	175.2	-172.5	-101.1	0	0	0	108.3	D46 Y48 V65 Y75 F76 E79	D46-F63 HydrophobicContact CB-CE1 3.96Å; D46-F63 HydrophobicContact CB-CZ 3.73Å; D46-F63 WeakPolarHBondContact OD2-CZ 3.37Å; Y48-F63 HydrophobicContact CD1-CB 4.3Å; Y48-F63 HydrophobicContact CD1-CD2 4.35Å; Y48-F63 AromaticContact CD2-CD2 3.91Å; Y48-F63 HydrophobicContact CD2-CD2 3.91Å; Y48-F63 HydrophobicContact CD2-CE2 4.43Å; Y48-F63 HydrophobicContact CE1-CB 4.02Å; Y48-F63 HydrophobicContact CE1-CD2 4.18Å; Y48-F63 AromaticContact CE2-CD2 3.7Å; Y48-F63 HydrophobicContact CE2-CD2 3.7Å; Y48-F63 HydrophobicContact CE2-CE2 4.21Å; Y48-F63 HydrophobicContact CG-CD2 4.23Å; Y48-F63 AromaticContact CZ-CD2 3.85Å; F63-V65 HydrophobicContact CD1-CG2 3.92Å; F63-V65 HydrophobicContact CE1-CG2 3.64Å; F63-Y75 CarbonylContact O-C 3.56Å; F63-Y75 VanDerWaalsContact O-CA 3.27Å; F63-Y75 WeakPolarHBondContact O-CA 3.23Å; F63-F76 HydrophobicContact CD1-CD2 4.5Å; F63-F76 PolarHBondContact N-O 3.29Å; F63-F76 VanDerWaalsContact N-O 3.08Å; F63-F76 PolarHBondContact O-N 3.19Å; F63-E79 HydrophobicContact CD1-CB 4.24Å; F63-E79 HydrophobicContact CD1-CG 4.46Å; F63-E79 HydrophobicContact CD2-CB 3.75Å; F63-E79 HydrophobicContact CD2-CG 4.19Å; F63-E79 HydrophobicContact CE1-CB 4.37Å; F63-E79 HydrophobicContact CE1-CG 4.1Å; F63-E79 HydrophobicContact CE2-CB 3.89Å; F63-E79 HydrophobicContact CE2-CG 3.8Å; F63-E79 HydrophobicContact CG-CB 3.92Å; F63-E79 HydrophobicContact CG-CG 4.49Å; F63-E79 HydrophobicContact CZ-CB 4.19Å; F63-E79 HydrophobicContact CZ-CG 3.75Å
64	F	94.8	Very high	86.1	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	144.8	-180	-79.6	-99	0	0	0	110.5	D46 G47 L49 K51 R62 L73 E74 Y75 Y117 L119 W131	D46-F64 CarbonylContact C-O 3.44Å; D46-F64 WeakPolarHBondContact CA-O 3.32Å; D46-F64 VanDerWaalsContact CB-O 3.28Å; D46-F64 WeakPolarHBondContact CB-O 3.38Å; G47-F64 PolarHBondContact N-O 3.18Å; G47-F64 PolarHBondContact O-N 3Å; L49-F64 HydrophobicContact CB-CD2 3.61Å; L49-F64 HydrophobicContact CB-CE2 3.81Å; L49-F64 HydrophobicContact CB-CG 4.48Å; L49-F64 HydrophobicContact CD1-CB 4.21Å; L49-F64 HydrophobicContact CD1-CD2 3.98Å; L49-F64 HydrophobicContact CD1-CE2 4.49Å; L49-F64 HydrophobicContact CD1-CG 4.03Å; L49-F64 HydrophobicContact CG-CD2 4.09Å; K51-F64 HydrophobicContact CB-CE2 3.99Å; K51-F64 HydrophobicContact CB-CZ 3.9Å; K51-F64 HydrophobicContact CD-CZ 3.9Å; K51-F64 HydrophobicContact CG-CZ 4.05Å; R62-F64 HydrophobicContact CB-CD2 4.15Å; R62-F64 HydrophobicContact CB-CE2 3.69Å; R62-F64 HydrophobicContact CB-CZ 4.48Å; F64-L73 HydrophobicContact CB-CD1 4.4Å; F64-L73 HydrophobicContact CD1-CD1 3.82Å; F64-L73 HydrophobicContact CD1-CD2 4.26Å; F64-L73 HydrophobicContact CD1-CG 3.95Å; F64-L73 HydrophobicContact CE1-CD2 4.41Å; F64-L73 HydrophobicContact CE1-CG 4.41Å; F64-E74 CarbonylContact C-O 3.6Å; F64-E74 VanDerWaalsContact CA-O 3.31Å; F64-E74 WeakPolarHBondContact CA-O 3.48Å; F64-Y75 HydrophobicContact CE1-CD1 4.06Å; F64-Y75 HydrophobicContact CE1-CG 4.04Å; F64-Y75 HydrophobicContact CZ-CD1 4.28Å; F64-Y75 HydrophobicContact CZ-CG 4.04Å; F64-Y117 HydrophobicContact CE1-CD2 4.15Å; F64-L119 HydrophobicContact CE1-CD1 4.09Å; F64-L119 HydrophobicContact CE1-CD2 3.9Å; F64-L119 HydrophobicContact CE2-CD2 3.87Å; F64-L119 HydrophobicContact CZ-CD1 4.24Å; F64-L119 HydrophobicContact CZ-CD2 3.28Å; F64-L119 HydrophobicContact CZ-CG 4.42Å; F64-W131 HydrophobicContact CB-CH2 3.83Å; F64-W131 HydrophobicContact CB-CZ3 4.27Å
65	V	93	Very high	87.1	Confident	9 Å²	9	42.3 Å²	42.3	6%	0.055	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	119.8	174.5	-177.2	0	0	0	0	107.4	D46 F63 E74 F76	D46-V65 HydrophobicContact CB-CB 4.32Å; D46-V65 HydrophobicContact CB-CG1 4.37Å; D46-V65 HydrophobicContact CB-CG2 3.91Å; F63-V65 HydrophobicContact CD1-CG2 3.92Å; F63-V65 HydrophobicContact CE1-CG2 3.64Å; V65-E74 PolarHBondContact N-O 2.86Å; V65-E74 PolarHBondContact O-N 2.89Å; V65-F76 HydrophobicContact CB-CE2 4.29Å; V65-F76 HydrophobicContact CG2-CD2 4.11Å; V65-F76 HydrophobicContact CG2-CE2 3.81Å
66	L	92.6	Very high	88.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	111.6	168.6	179.3	57.8	0	0	0	108.6	N44 I45 N68 L92 R134 L135 C138	N44-L66 WeakPolarHBondContact CB-O 3.31Å; N44-L66 PolarHBondContact OD1-O 2.88Å; I45-L66 HydrophobicContact CG2-CB 3.52Å; I45-L66 HydrophobicContact CG2-CD2 3.62Å; I45-L66 HydrophobicContact CG2-CG 4.18Å; I45-L66 WeakPolarHBondContact O-CB 3.45Å; I45-L66 PolarHBondContact O-N 2.86Å; L66-N68 WeakPolarHBondContact CD2-OD1 3.42Å; L66-N68 WeakPolarHBondContact CG-OD1 3.38Å; L66-N68 PolarHBondContact O-N 3.3Å; L66-L92 HydrophobicContact CD1-CD1 3.27Å; L66-R134 HydrophobicContact CD2-CB 4.07Å; L66-L135 HydrophobicContact CD1-CD2 3.76Å; L66-L135 HydrophobicContact CD2-CD2 4.17Å; L66-L135 HydrophobicContact CG-CD2 4.47Å; L66-C138 HydrophobicContact CD1-CB 4.25Å; L66-C138 HydrophobicContact CD2-CB 4.19Å
67	N	89	Confident	89.4	Confident	45 Å²	45	41 Å²	41	24%	0.241	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	97.9	173.4	-172.7	-25.8	0	0	0	109.1	E69 A70 G71 L72	N67-E69 VanDerWaalsContact C-N 3.29Å; N67-E69 PolarHBondContact O-N 3.01Å; N67-E69 PolarHBondContact OD1-N 3.27Å; N67-A70 HydrophobicContact CB-CB 4.31Å; N67-A70 PolarHBondContact OD1-N 3.36Å; N67-G71 WeakPolarHBondContact O-CA 3.49Å; N67-G71 PolarHBondContact O-N 3.02Å; N67-L72 HydrophobicContact CB-CB 4.48Å; N67-L72 PolarHBondContact N-O 2.93Å; N67-L72 PolarHBondContact O-N 3.04Å
68	N	85.8	Confident	90.1	Very high	8 Å²	8	40.8 Å²	40.8	4%	0.043	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-26.9	-178.2	-71.3	-26.8	0	0	0	113.2	M42 E43 N44 L66 H142	M42-N68 HydrophobicContact CE-CB 4.35Å; M42-N68 PolarHBondContact O-ND2 3.44Å; E43-N68 PolarHBondContact O-ND2 3.16Å; N44-N68 WeakPolarHBondContact OD1-CB 3.47Å; N44-N68 PolarHBondContact OD1-N 3.17Å; L66-N68 WeakPolarHBondContact CD2-OD1 3.42Å; L66-N68 WeakPolarHBondContact CG-OD1 3.38Å; L66-N68 PolarHBondContact O-N 3.3Å; N68-H142 PolarHBondContact O-NE2 3.32Å
69	E	84.9	Confident	90.4	Very high	152 Å²	152	44.4 Å²	44.4	71%	0.71	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-43.9	179.7	-64.7	-175.7	172.5	0	0	111.2	N67 H142	N67-E69 VanDerWaalsContact C-N 3.29Å; N67-E69 PolarHBondContact O-N 3.01Å; N67-E69 PolarHBondContact OD1-N 3.27Å; E69-H142 PolarHBondContact O-CE1 3.1Å; E69-H142 VanDerWaalsContact O-CE1 3.3Å
70	A	85	Confident	90.4	Very high	52 Å²	52	47.3 Å²	47.3	43%	0.43	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-15.2	179.7	0	0	0	0	0	113.7	N67 L72	N67-A70 HydrophobicContact CB-CB 4.31Å; N67-A70 PolarHBondContact OD1-N 3.36Å; A70-L72 VanDerWaalsContact C-N 3.33Å; A70-L72 HydrophobicContact CB-CB 4.4Å; A70-L72 HydrophobicContact CB-CD1 3.94Å; A70-L72 HydrophobicContact CB-CG 3.88Å
71	G	88.9	Confident	90.2	Very high	4 Å²	4	44.7 Å²	44.7	4%	0.041	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.6	33.4	-174.6	0	0	0	0	0	112.7	N67 L92 H142	N67-G71 WeakPolarHBondContact O-CA 3.49Å; N67-G71 PolarHBondContact O-N 3.02Å; G71-L92 WeakPolarHBondContact O-CB 3.47Å; G71-L92 PolarHBondContact O-N 2.56Å; G71-H142 VanDerWaalsContact CA-CD2 3.41Å; G71-H142 WeakPolarHBondContact CA-CD2 3.31Å; G71-H142 VanDerWaalsContact CA-NE2 3.31Å; G71-H142 WeakPolarHBondContact CA-NE2 3.12Å; G71-H142 PolarHBondContact N-CE1 3.06Å; G71-H142 PolarHBondContact N-NE2 3.45Å
72	L	91.6	Very high	89.8	Confident	44 Å²	44	44.3 Å²	44.3	23%	0.23	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	138.3	-175.5	-60.8	179.1	0	0	0	111	N67 A70 E74 P91	N67-L72 HydrophobicContact CB-CB 4.48Å; N67-L72 PolarHBondContact N-O 2.93Å; N67-L72 PolarHBondContact O-N 3.04Å; A70-L72 VanDerWaalsContact C-N 3.33Å; A70-L72 HydrophobicContact CB-CB 4.4Å; A70-L72 HydrophobicContact CB-CD1 3.94Å; A70-L72 HydrophobicContact CB-CG 3.88Å; L72-E74 HydrophobicContact CB-CG 4.11Å; L72-P91 HydrophobicContact CD2-CB 4.22Å; L72-P91 HydrophobicContact CD2-CG 4.22Å
73	L	93.9	Very high	89	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	110.7	163.9	179.5	61.8	0	0	0	109.1	F64 S89 L90 L92 V109 L119 W131 L135	F64-L73 HydrophobicContact CB-CD1 4.4Å; F64-L73 HydrophobicContact CD1-CD1 3.82Å; F64-L73 HydrophobicContact CD1-CD2 4.26Å; F64-L73 HydrophobicContact CD1-CG 3.95Å; F64-L73 HydrophobicContact CE1-CD2 4.41Å; F64-L73 HydrophobicContact CE1-CG 4.41Å; L73-S89 CarbonylContact O-C 3.43Å; L73-S89 WeakPolarHBondContact O-CA 3.44Å; L73-L90 HydrophobicContact CB-CB 4.41Å; L73-L90 PolarHBondContact N-O 2.76Å; L73-L90 PolarHBondContact O-N 2.83Å; L73-L92 HydrophobicContact CB-CD1 4.18Å; L73-L92 HydrophobicContact CB-CD2 4.03Å; L73-L92 HydrophobicContact CB-CG 4.19Å; L73-V109 HydrophobicContact CD2-CG2 4.26Å; L73-L119 HydrophobicContact CD2-CD1 4.28Å; L73-W131 HydrophobicContact CD1-CZ3 4.38Å; L73-L135 HydrophobicContact CB-CD2 4.44Å; L73-L135 HydrophobicContact CD1-CD2 4.01Å; L73-L135 HydrophobicContact CD2-CD1 4.44Å; L73-L135 HydrophobicContact CD2-CD2 3.95Å; L73-L135 HydrophobicContact CG-CD2 4.36Å
74	E	93.9	Very high	88.7	Confident	38 Å²	38	54 Å²	54	18%	0.178	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	150.4	-176.5	-57.7	-176.3	118.9	0	0	110.5	F64 V65 L72 F76 P86 G88	F64-E74 CarbonylContact C-O 3.6Å; F64-E74 VanDerWaalsContact CA-O 3.31Å; F64-E74 WeakPolarHBondContact CA-O 3.48Å; V65-E74 PolarHBondContact N-O 2.86Å; V65-E74 PolarHBondContact O-N 2.89Å; L72-E74 HydrophobicContact CB-CG 4.11Å; E74-F76 HydrophobicContact CB-CE2 4.17Å; E74-P86 HydrophobicContact CB-CB 4.2Å; E74-G88 WeakPolarHBondContact CA-O 3.37Å
75	Y	93.8	Very high	88.2	Confident	25 Å²	25	63.2 Å²	63.2	10%	0.098	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	150.2	172.6	79.3	-91.1	0	0	0	113.7	K51 R62 F63 F64 R87 G88 Y117	K51-Y75 HydrophobicContact CD-CD1 4.14Å; K51-Y75 HydrophobicContact CD-CD2 4.26Å; K51-Y75 HydrophobicContact CD-CE1 3.84Å; K51-Y75 HydrophobicContact CD-CE2 3.99Å; K51-Y75 HydrophobicContact CD-CG 4.34Å; K51-Y75 VanDerWaalsContact CE-CE1 3.49Å; R62-Y75 HydrophobicContact CB-CD2 3.93Å; R62-Y75 HydrophobicContact CG-CD2 3.86Å; R62-Y75 HydrophobicContact CG-CE2 4.22Å; F63-Y75 CarbonylContact O-C 3.56Å; F63-Y75 VanDerWaalsContact O-CA 3.27Å; F63-Y75 WeakPolarHBondContact O-CA 3.23Å; F64-Y75 HydrophobicContact CE1-CD1 4.06Å; F64-Y75 HydrophobicContact CE1-CG 4.04Å; F64-Y75 HydrophobicContact CZ-CD1 4.28Å; F64-Y75 HydrophobicContact CZ-CG 4.04Å; Y75-R87 HydrophobicContact CD2-CB 4.05Å; Y75-R87 HydrophobicContact CE2-CB 3.61Å; Y75-R87 HydrophobicContact CE2-CG 3.65Å; Y75-R87 PolarHBondContact O-N 3.43Å; Y75-G88 PolarHBondContact N-O 3.43Å; Y75-G88 PolarHBondContact O-N 2.71Å; Y75-Y117 AromaticContact CD1-CE2 3.89Å; Y75-Y117 HydrophobicContact CD1-CE2 3.89Å; Y75-Y117 AromaticContact CE1-CE2 4Å; Y75-Y117 HydrophobicContact CE1-CE2 4Å; Y75-Y117 AromaticContact CE1-CZ 3.86Å
76	F	92.4	Very high	88	Confident	10 Å²	10	64.4 Å²	64.4	4%	0.044	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	162.3	-175.3	-58.1	-91.6	0	0	0	109.7	R62 F63 V65 E74 N78 S81 Q84 P86	R62-F76 WeakPolarHBondContact CA-O 3.21Å; R62-F76 WeakPolarHBondContact CB-O 3.22Å; R62-F76 WeakPolarHBondContact CD-O 3.43Å; F63-F76 HydrophobicContact CD1-CD2 4.5Å; F63-F76 PolarHBondContact N-O 3.29Å; F63-F76 VanDerWaalsContact N-O 3.08Å; F63-F76 PolarHBondContact O-N 3.19Å; V65-F76 HydrophobicContact CB-CE2 4.29Å; V65-F76 HydrophobicContact CG2-CD2 4.11Å; V65-F76 HydrophobicContact CG2-CE2 3.81Å; E74-F76 HydrophobicContact CB-CE2 4.17Å; F76-N78 VanDerWaalsContact C-N 3.29Å; F76-N78 WeakPolarHBondContact CB-O 3.36Å; F76-S81 WeakPolarHBondContact CB-OG 3.23Å; F76-S81 VanDerWaalsContact CD1-O 3.27Å; F76-S81 WeakPolarHBondContact CD1-O 3.15Å; F76-Q84 WeakPolarHBondContact CE1-O 3.17Å; F76-P86 HydrophobicContact CD1-CB 4.31Å; F76-P86 VanDerWaalsContact CE1-CA 3.44Å; F76-P86 HydrophobicContact CE1-CB 3.71Å; F76-P86 HydrophobicContact CE1-CG 4.5Å; F76-P86 HydrophobicContact CE2-CB 4.4Å; F76-P86 HydrophobicContact CZ-CB 3.76Å; F76-P86 HydrophobicContact CZ-CG 4.49Å
77	V	87.4	Confident	87.7	Confident	79 Å²	79	73.2 Å²	73.2	48%	0.479	36%	0.363	S	S	.	.	S	Bend	trans	-64.1	-42.8	178.5	177.9	0	0	0	0	109.7	S81	V77-S81 PolarHBondContact N-OG 3.41Å
78	N	89	Confident	87.7	Confident	59 Å²	59	71.8 Å²	71.8	32%	0.316	36%	0.358	S	S	.	.	S	Bend	trans	-150.4	170.8	175	57.7	25.2	0	0	0	109.9	F76 Q80 S81	F76-N78 VanDerWaalsContact C-N 3.29Å; F76-N78 WeakPolarHBondContact CB-O 3.36Å; N78-Q80 VanDerWaalsContact C-N 3.27Å; N78-Q80 PolarHBondContact ND2-OE1 2.63Å; N78-Q80 PolarHBondContact O-N 2.89Å; N78-Q80 PolarHBondContact OD1-N 2.9Å; N78-Q80 PolarHBondContact OD1-OE1 3.39Å; N78-S81 PolarHBondContact N-OG 3Å; N78-S81 PolarHBondContact O-N 3.22Å; N78-S81 PolarHBondContact O-OG 2.86Å; N78-S81 VanDerWaalsContact OD1-CB 3.28Å; N78-S81 WeakPolarHBondContact OD1-CB 3.15Å; N78-S81 PolarHBondContact OD1-N 3.42Å; N78-S81 PolarHBondContact OD1-OG 3.12Å
79	E	89.4	Confident	87.9	Confident	94 Å²	94	74 Å²	74	44%	0.439	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-59.9	-36	179.1	-177.4	177.9	179.3	0	0	112.9	Y48 F63 S81 R82	Y48-E79 HydrophobicContact CE2-CB 4.36Å; Y48-E79 WeakPolarHBondContact OH-CB 3.41Å; Y48-E79 PolarHBondContact OH-N 3.31Å; Y48-E79 VanDerWaalsContact OH-N 3.15Å; F63-E79 HydrophobicContact CD1-CB 4.24Å; F63-E79 HydrophobicContact CD1-CG 4.46Å; F63-E79 HydrophobicContact CD2-CB 3.75Å; F63-E79 HydrophobicContact CD2-CG 4.19Å; F63-E79 HydrophobicContact CE1-CB 4.37Å; F63-E79 HydrophobicContact CE1-CG 4.1Å; F63-E79 HydrophobicContact CE2-CB 3.89Å; F63-E79 HydrophobicContact CE2-CG 3.8Å; F63-E79 HydrophobicContact CG-CB 3.92Å; F63-E79 HydrophobicContact CG-CG 4.49Å; F63-E79 HydrophobicContact CZ-CB 4.19Å; F63-E79 HydrophobicContact CZ-CG 3.75Å; E79-S81 PolarHBondContact O-N 3.44Å; E79-R82 VanDerWaalsContact O-CB 3.27Å; E79-R82 WeakPolarHBondContact O-CB 3.11Å; E79-R82 PolarHBondContact O-N 3.07Å; E79-R82 VanDerWaalsContact O-N 3.13Å
80	Q	86.4	Confident	88.2	Confident	137 Å²	137	66.8 Å²	66.8	64%	0.64	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-65.3	-24.9	-180	-58.1	82.8	11.9	0	0	112.6	N78 R82	N78-Q80 VanDerWaalsContact C-N 3.27Å; N78-Q80 PolarHBondContact ND2-OE1 2.63Å; N78-Q80 PolarHBondContact O-N 2.89Å; N78-Q80 PolarHBondContact OD1-N 2.9Å; N78-Q80 PolarHBondContact OD1-OE1 3.39Å; Q80-R82 VanDerWaalsContact C-N 3.26Å; Q80-R82 PolarHBondContact O-N 3.21Å
81	S	85.6	Confident	88.4	Confident	12 Å²	12	67.3 Å²	67.3	8%	0.084	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-82.4	7.3	177.3	63.2	0	0	0	0	114.5	F76 V77 N78 E79 S83 Q84	F76-S81 WeakPolarHBondContact CB-OG 3.23Å; F76-S81 VanDerWaalsContact CD1-O 3.27Å; F76-S81 WeakPolarHBondContact CD1-O 3.15Å; V77-S81 PolarHBondContact N-OG 3.41Å; N78-S81 PolarHBondContact N-OG 3Å; N78-S81 PolarHBondContact O-N 3.22Å; N78-S81 PolarHBondContact O-OG 2.86Å; N78-S81 VanDerWaalsContact OD1-CB 3.28Å; N78-S81 WeakPolarHBondContact OD1-CB 3.15Å; N78-S81 PolarHBondContact OD1-N 3.42Å; N78-S81 PolarHBondContact OD1-OG 3.12Å; E79-S81 PolarHBondContact O-N 3.44Å; S81-S83 PolarHBondContact O-N 2.73Å; S81-Q84 WeakPolarHBondContact O-CB 3.38Å; S81-Q84 PolarHBondContact O-N 2.95Å
82	R	82.3	Confident	88.5	Confident	114 Å²	114	67.1 Å²	67.1	43%	0.43	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-59.8	-27.7	178	-170.8	178.9	-173.1	157	6.9	113.8	D46 E79 Q80 Q84	D46-R82 IonicContact OD1-CZ 2.88Å; D46-R82 IonicContact OD1-NH1 2.6Å; D46-R82 PolarHBondContact OD1-NH1 2.83Å; D46-R82 IonicContact OD1-NH2 3.94Å; D46-R82 PolarHBondContact OD1-NH2 2.73Å; E79-R82 VanDerWaalsContact O-CB 3.27Å; E79-R82 WeakPolarHBondContact O-CB 3.11Å; E79-R82 PolarHBondContact O-N 3.07Å; E79-R82 VanDerWaalsContact O-N 3.13Å; Q80-R82 VanDerWaalsContact C-N 3.26Å; Q80-R82 PolarHBondContact O-N 3.21Å; R82-Q84 VanDerWaalsContact C-N 3.27Å
83	S	77.4	Confident	88.2	Confident	116 Å²	116	66.3 Å²	66.3	81%	0.811	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-78.6	-9.2	175.9	58.1	0	0	0	0	113.8	S81	S81-S83 PolarHBondContact O-N 2.73Å
84	Q	85.3	Confident	87.5	Confident	136 Å²	136	67.8 Å²	67.8	64%	0.636	35%	0.352	S	S	*	.	S	Bend	trans	-94.2	172.8	176.7	-58.1	-177.2	-4.1	0	0	110.7	F76 S81 R82	F76-Q84 WeakPolarHBondContact CE1-O 3.17Å; S81-Q84 WeakPolarHBondContact O-CB 3.38Å; S81-Q84 PolarHBondContact O-N 2.95Å; R82-Q84 VanDerWaalsContact C-N 3.27Å
85	K	84.6	Confident	87	Confident	193 Å²	193	66.4 Å²	66.4	84%	0.839	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-62	133.3	173.4	-171.8	177.2	179.9	175.5	0	110.1
86	P	88.4	Confident	86.6	Confident	35 Å²	35	69.3 Å²	69.3	23%	0.227	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-58.4	144.7	178.2	22.9	-33.5	0	0	0	111.3	E74 F76 G88	E74-P86 HydrophobicContact CB-CB 4.2Å; F76-P86 HydrophobicContact CD1-CB 4.31Å; F76-P86 VanDerWaalsContact CE1-CA 3.44Å; F76-P86 HydrophobicContact CE1-CB 3.71Å; F76-P86 HydrophobicContact CE1-CG 4.5Å; F76-P86 HydrophobicContact CE2-CB 4.4Å; F76-P86 HydrophobicContact CZ-CB 3.76Å; F76-P86 HydrophobicContact CZ-CG 4.49Å; P86-G88 VanDerWaalsContact C-N 3.25Å; P86-G88 PolarHBondContact O-N 3.44Å
87	R	87.3	Confident	86.4	Confident	185 Å²	185	69.5 Å²	69.5	70%	0.698	37%	0.369	S	S	*	.	S	Bend	trans	-72.2	-25.8	179	-172.5	61.4	172	-171.9	0.3	111.5	Y75	Y75-R87 HydrophobicContact CD2-CB 4.05Å; Y75-R87 HydrophobicContact CE2-CB 3.61Å; Y75-R87 HydrophobicContact CE2-CG 3.65Å; Y75-R87 PolarHBondContact O-N 3.43Å
88	G	88.3	Confident	86.4	Confident	14 Å²	14	67.9 Å²	67.9	14%	0.144	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	151.2	166.7	0	0	0	0	0	110.3	E74 Y75 P86	E74-G88 WeakPolarHBondContact CA-O 3.37Å; Y75-G88 PolarHBondContact N-O 3.43Å; Y75-G88 PolarHBondContact O-N 2.71Å; P86-G88 VanDerWaalsContact C-N 3.25Å; P86-G88 PolarHBondContact O-N 3.44Å
89	S	90.9	Very high	86.2	Confident	55 Å²	55	67.5 Å²	67.5	39%	0.385	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	138.1	175.4	55.5	0	0	0	0	108.5	L73	L73-S89 CarbonylContact O-C 3.43Å; L73-S89 WeakPolarHBondContact O-CA 3.44Å
90	L	90.6	Very high	85.8	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	117.7	-176.8	-168.2	74.3	0	0	0	109.6	L73 L92 V109 A111 E115 Y117	L73-L90 HydrophobicContact CB-CB 4.41Å; L73-L90 PolarHBondContact N-O 2.76Å; L73-L90 PolarHBondContact O-N 2.83Å; L90-L92 PolarHBondContact O-N 3.12Å; L90-V109 HydrophobicContact CD2-CB 4.08Å; L90-V109 HydrophobicContact CD2-CG1 3.57Å; L90-A111 HydrophobicContact CD1-CB 3.58Å; L90-A111 HydrophobicContact CD2-CB 4.4Å; L90-A111 HydrophobicContact CG-CB 3.93Å; L90-E115 HydrophobicContact CD1-CB 3.72Å; L90-Y117 HydrophobicContact CB-CD2 4.25Å; L90-Y117 HydrophobicContact CB-CE2 3.68Å; L90-Y117 HydrophobicContact CD1-CE1 4.34Å; L90-Y117 HydrophobicContact CD2-CD2 3.9Å; L90-Y117 HydrophobicContact CD2-CE2 4.15Å; L90-Y117 HydrophobicContact CD2-CG 4.14Å; L90-Y117 HydrophobicContact CG-CE2 4.36Å
91	P	88.8	Confident	85.2	Confident	63 Å²	63	65.7 Å²	65.7	41%	0.409	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	129.8	172.7	-19.8	32.2	0	0	0	111.5	L72	L72-P91 HydrophobicContact CD2-CB 4.22Å; L72-P91 HydrophobicContact CD2-CG 4.22Å
92	L	90.3	Very high	84.2	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	38%	0.382	C	S	.	.			trans	-93.2	-13.3	-179.1	-65.5	178.5	0	0	0	113.3	L66 G71 L73 L90 G94 A95 V109 L135 C138 T139	L66-L92 HydrophobicContact CD1-CD1 3.27Å; G71-L92 WeakPolarHBondContact O-CB 3.47Å; G71-L92 PolarHBondContact O-N 2.56Å; L73-L92 HydrophobicContact CB-CD1 4.18Å; L73-L92 HydrophobicContact CB-CD2 4.03Å; L73-L92 HydrophobicContact CB-CG 4.19Å; L90-L92 PolarHBondContact O-N 3.12Å; L92-G94 PolarHBondContact O-N 3.27Å; L92-G94 VanDerWaalsContact O-N 3.08Å; L92-A95 HydrophobicContact CD2-CB 4.34Å; L92-A95 WeakPolarHBondContact O-CB 3.31Å; L92-A95 PolarHBondContact O-N 3.03Å; L92-V109 HydrophobicContact CD2-CG1 3.84Å; L92-L135 HydrophobicContact CD1-CD2 3.84Å; L92-L135 HydrophobicContact CD2-CD2 4.31Å; L92-C138 HydrophobicContact CD1-CB 4.23Å; L92-T139 WeakPolarHBondContact O-CG2 3.22Å; L92-T139 PolarHBondContact O-OG1 2.97Å
93	A	86.1	Confident	84.1	Confident	28 Å²	28	67.6 Å²	67.6	23%	0.231	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	116	174.4	0	0	0	0	0	110.6	A95 H142	A93-A95 VanDerWaalsContact C-N 3.25Å; A93-A95 PolarHBondContact O-N 3.32Å; A93-H142 HydrophobicContact CB-CB 4.21Å
94	G	79.4	Confident	84.4	Confident	30 Å²	30	64.4 Å²	64.4	31%	0.309	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	9.7	-177.6	0	0	0	0	0	114.7	L92 T143	L92-G94 PolarHBondContact O-N 3.27Å; L92-G94 VanDerWaalsContact O-N 3.08Å; G94-T143 WeakPolarHBondContact CA-OG1 3.25Å; G94-T143 PolarHBondContact N-OG1 2.79Å
95	A	83.9	Confident	84.4	Confident	9 Å²	9	60.5 Å²	60.5	7%	0.074	34%	0.335	C	S	.	.			trans	-72	150.8	176.5	0	0	0	0	0	112	L92 A93 N110 T139	L92-A95 HydrophobicContact CD2-CB 4.34Å; L92-A95 WeakPolarHBondContact O-CB 3.31Å; L92-A95 PolarHBondContact O-N 3.03Å; A93-A95 VanDerWaalsContact C-N 3.25Å; A93-A95 PolarHBondContact O-N 3.32Å; A95-N110 CarbonylContact C-O 3.59Å; A95-N110 WeakPolarHBondContact CA-O 3.28Å; A95-N110 WeakPolarHBondContact CB-O 3.49Å; A95-T139 HydrophobicContact CB-CG2 4.26Å; A95-T139 WeakPolarHBondContact O-CG2 3.5Å
96	V	84	Confident	84.7	Confident	86 Å²	86	51.5 Å²	51.5	52%	0.521	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	119.4	175.3	-178.8	0	0	0	0	109	N110	V96-N110 HydrophobicContact CB-CB 4.42Å; V96-N110 PolarHBondContact N-O 3.08Å; V96-N110 WeakPolarHBondContact O-CB 3.18Å; V96-N110 PolarHBondContact O-N 3.45Å; V96-N110 PolarHBondContact O-ND2 2.96Å
97	I	90	Very high	84.8	Confident	14 Å²	14	49.8 Å²	49.8	7%	0.072	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	115	178	-60.3	85.7	0	0	0	108.1	F107 T108 V109 V132 L135 Q136 T139	I97-F107 HydrophobicContact CG2-CD2 4.36Å; I97-T108 WeakPolarHBondContact CA-O 3.44Å; I97-V109 HydrophobicContact CG1-CG1 4.26Å; I97-V109 HydrophobicContact CG1-CG2 4.41Å; I97-V132 HydrophobicContact CG2-CB 4.44Å; I97-V132 HydrophobicContact CG2-CG1 4.06Å; I97-V132 HydrophobicContact CG2-CG2 4.26Å; I97-L135 HydrophobicContact CD1-CB 4.42Å; I97-L135 HydrophobicContact CG1-CB 3.98Å; I97-Q136 HydrophobicContact CB-CG 3.96Å; I97-Q136 HydrophobicContact CD1-CG 4.31Å; I97-Q136 HydrophobicContact CG1-CG 4.45Å; I97-Q136 HydrophobicContact CG2-CG 4.4Å; I97-T139 HydrophobicContact CD1-CG2 4.18Å; I97-T139 WeakPolarHBondContact CD1-OG1 3.23Å
98	S	86.6	Confident	85	Confident	46 Å²	46	42.3 Å²	42.3	32%	0.322	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	106.3	-176.1	-54.9	0	0	0	0	109.5	F107 T108	S98-F107 WeakPolarHBondContact O-CA 3.16Å; S98-T108 PolarHBondContact N-O 2.92Å; S98-T108 PolarHBondContact O-N 2.92Å; S98-T108 PolarHBondContact O-OG1 2.83Å
99	P	85.3	Confident	85.1	Confident	51 Å²	51	41.6 Å²	41.6	33%	0.331	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55	146.4	166.3	-23.2	35.1	0	0	0	110.8	V132	P99-V132 HydrophobicContact CG-CG1 3.87Å; P99-V132 HydrophobicContact CG-CG2 4.25Å
100	S	80.9	Confident	84.9	Confident	22 Å²	22	40.8 Å²	40.8	15%	0.154	24%	0.244	C	C	.	.			trans	-73.3	133.6	173.6	-167.6	0	0	0	0	110.5	E102 D103 T106 R128	S100-E102 VanDerWaalsContact C-N 3.28Å; S100-E102 WeakPolarHBondContact OG-CB 3.34Å; S100-E102 PolarHBondContact OG-N 2.83Å; S100-E102 VanDerWaalsContact OG-N 3.16Å; S100-D103 VanDerWaalsContact O-O 3.13Å; S100-T106 WeakPolarHBondContact CB-O 3.49Å; S100-T106 PolarHBondContact N-O 3.16Å; S100-R128 PolarHBondContact O-NH1 2.92Å
101	D	72.9	Confident	84.6	Confident	171 Å²	171	41.2 Å²	41.2	91%	0.914	25%	0.248	S	C	*	.	S	Bend	trans	-80.9	-13.7	167	-61.7	-35.2	0	0	0	111.5
102	E	64.9	Low	83.9	Confident	109 Å²	109	44.9 Å²	44.9	51%	0.509	26%	0.263	S	S	.	.	S	Bend	trans	-79	-32.9	-177.3	-56.9	174.5	169.8	0	0	112.9	S100 F578	S100-E102 VanDerWaalsContact C-N 3.28Å; S100-E102 WeakPolarHBondContact OG-CB 3.34Å; S100-E102 PolarHBondContact OG-N 2.83Å; S100-E102 VanDerWaalsContact OG-N 3.16Å; E102-F578 HydrophobicContact CG-CZ 4.45Å; E102-F578 WeakPolarHBondContact OE1-CE1 3.27Å; E102-F578 WeakPolarHBondContact OE1-CZ 3.36Å
103	D	80.9	Confident	83	Confident	57 Å²	57	48.9 Å²	48.9	31%	0.305	29%	0.29	S	S	.	.			trans	-154	167.4	-176	74.6	62.9	0	0	0	112	S100 H105 T106 R128	S100-D103 VanDerWaalsContact O-O 3.13Å; D103-H105 WeakPolarHBondContact OD1-CA 3.14Å; D103-H105 PolarHBondContact OD1-N 3.21Å; D103-T106 VanDerWaalsContact CG-OG1 3.27Å; D103-T106 VanDerWaalsContact OD1-CB 3.28Å; D103-T106 WeakPolarHBondContact OD1-CB 3.26Å; D103-T106 PolarHBondContact OD1-N 3.2Å; D103-T106 PolarHBondContact OD1-OG1 3.21Å; D103-T106 VanDerWaalsContact OD2-CB 3.26Å; D103-T106 WeakPolarHBondContact OD2-CB 3.32Å; D103-T106 PolarHBondContact OD2-OG1 2.89Å; D103-R128 PolarHBondContact O-NH1 3.07Å
104	S	83.2	Confident	82	Confident	49 Å²	49	49.6 Å²	49.6	34%	0.343	30%	0.301	S	S	.	.	S	Bend	trans	-90.2	3.3	-176.3	76.6	0	0	0	0	115.3	A125 R128	S104-A125 WeakPolarHBondContact O-CA 3.09Å; S104-A125 WeakPolarHBondContact O-CB 3.46Å; S104-R128 VanDerWaalsContact C-CZ 3.45Å; S104-R128 VanDerWaalsContact O-CD 3.24Å; S104-R128 WeakPolarHBondContact O-CD 3.34Å; S104-R128 VanDerWaalsContact O-CZ 3.25Å; S104-R128 PolarHBondContact O-NE 3.23Å
105	H	85.9	Confident	82	Confident	54 Å²	54	53 Å²	53	25%	0.25	31%	0.309	C	S	.	.	S	Bend	trans	-120.3	-16.3	-171.1	-56.4	-66.8	0	0	0	113.8	D103 R120 V121	D103-H105 WeakPolarHBondContact OD1-CA 3.14Å; D103-H105 PolarHBondContact OD1-N 3.21Å; H105-R120 HydrophobicContact CB-CG 4.07Å; H105-R120 WeakPolarHBondContact O-CA 3.47Å; H105-V121 PolarHBondContact O-N 2.77Å
106	T	89.6	Confident	82	Confident	3 Å²	3	54.6 Å²	54.6	2%	0.018	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	146.2	-173.4	-56.1	0	0	0	0	111.6	W59 S100 D103 K118 L119 R128	W59-T106 HydrophobicContact CH2-CG2 4.03Å; S100-T106 WeakPolarHBondContact CB-O 3.49Å; S100-T106 PolarHBondContact N-O 3.16Å; D103-T106 VanDerWaalsContact CG-OG1 3.27Å; D103-T106 VanDerWaalsContact OD1-CB 3.28Å; D103-T106 WeakPolarHBondContact OD1-CB 3.26Å; D103-T106 PolarHBondContact OD1-N 3.2Å; D103-T106 PolarHBondContact OD1-OG1 3.21Å; D103-T106 VanDerWaalsContact OD2-CB 3.26Å; D103-T106 WeakPolarHBondContact OD2-CB 3.32Å; D103-T106 PolarHBondContact OD2-OG1 2.89Å; T106-K118 HydrophobicContact CG2-CG 4.19Å; T106-L119 CarbonylContact C-O 3.53Å; T106-L119 WeakPolarHBondContact CA-O 3.27Å; T106-L119 WeakPolarHBondContact CG2-O 3.43Å; T106-R128 WeakPolarHBondContact O-CD 3.32Å; T106-R128 PolarHBondContact O-NH1 3.35Å
107	F	91.3	Very high	82.4	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	163.5	170.6	64.7	-79.1	0	0	0	110.4	L49 I97 S98 V109 L119 V121 R128 W131 V132 L135	L49-F107 HydrophobicContact CD1-CZ 4.05Å; I97-F107 HydrophobicContact CG2-CD2 4.36Å; S98-F107 WeakPolarHBondContact O-CA 3.16Å; F107-V109 HydrophobicContact CD2-CG2 4.16Å; F107-V109 HydrophobicContact CE2-CG2 3.96Å; F107-L119 HydrophobicContact CD1-CB 4.29Å; F107-L119 HydrophobicContact CD2-CB 4.45Å; F107-L119 HydrophobicContact CE1-CB 3.84Å; F107-L119 HydrophobicContact CE2-CB 4Å; F107-L119 HydrophobicContact CE2-CD1 3.74Å; F107-L119 HydrophobicContact CE2-CG 4.36Å; F107-L119 HydrophobicContact CZ-CB 3.69Å; F107-L119 HydrophobicContact CZ-CD1 3.78Å; F107-L119 HydrophobicContact CZ-CG 4.34Å; F107-L119 PolarHBondContact N-O 2.6Å; F107-L119 PolarHBondContact O-N 2.65Å; F107-V121 HydrophobicContact CD1-CG2 4.49Å; F107-V121 HydrophobicContact CE1-CG2 3.92Å; F107-R128 HydrophobicContact CD1-CG 3.91Å; F107-W131 HydrophobicContact CE1-CB 4.28Å; F107-W131 HydrophobicContact CZ-CB 3.94Å; F107-V132 HydrophobicContact CB-CG2 3.86Å; F107-V132 HydrophobicContact CD1-CG2 4.3Å; F107-V132 HydrophobicContact CD2-CG2 3.99Å; F107-V132 HydrophobicContact CG-CG2 3.8Å; F107-L135 HydrophobicContact CE2-CD1 3.63Å; F107-L135 HydrophobicContact CZ-CD1 4.31Å
108	T	91	Very high	82.4	Confident	27 Å²	27	53.7 Å²	53.7	17%	0.166	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	144.7	176.9	61.1	0	0	0	0	111.1	I97 S98 Y117 K118	I97-T108 WeakPolarHBondContact CA-O 3.44Å; S98-T108 PolarHBondContact N-O 2.92Å; S98-T108 PolarHBondContact O-N 2.92Å; S98-T108 PolarHBondContact O-OG1 2.83Å; T108-Y117 CarbonylContact C-O 3.55Å; T108-Y117 VanDerWaalsContact CA-O 3.29Å; T108-Y117 WeakPolarHBondContact CA-O 3.23Å; T108-K118 HydrophobicContact CG2-CB 4.17Å; T108-K118 HydrophobicContact CG2-CG 4.11Å
109	V	90.8	Very high	82.7	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	114.4	172.7	-173.1	0	0	0	0	107.2	L73 L90 L92 I97 F107 Q116 Y117 L119 L135	L73-V109 HydrophobicContact CD2-CG2 4.26Å; L90-V109 HydrophobicContact CD2-CB 4.08Å; L90-V109 HydrophobicContact CD2-CG1 3.57Å; L92-V109 HydrophobicContact CD2-CG1 3.84Å; I97-V109 HydrophobicContact CG1-CG1 4.26Å; I97-V109 HydrophobicContact CG1-CG2 4.41Å; F107-V109 HydrophobicContact CD2-CG2 4.16Å; F107-V109 HydrophobicContact CE2-CG2 3.96Å; V109-Q116 WeakPolarHBondContact O-CA 3.34Å; V109-Y117 PolarHBondContact N-O 3.14Å; V109-Y117 PolarHBondContact O-N 3.33Å; V109-L119 HydrophobicContact CG2-CD1 4.2Å; V109-L135 HydrophobicContact CG2-CD1 3.95Å
110	N	86.6	Confident	83	Confident	38 Å²	38	53.7 Å²	53.7	20%	0.203	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	107.9	-177.4	-56.6	-63.2	0	0	0	109.1	A95 V96 Q116	A95-N110 CarbonylContact C-O 3.59Å; A95-N110 WeakPolarHBondContact CA-O 3.28Å; A95-N110 WeakPolarHBondContact CB-O 3.49Å; V96-N110 HydrophobicContact CB-CB 4.42Å; V96-N110 PolarHBondContact N-O 3.08Å; V96-N110 WeakPolarHBondContact O-CB 3.18Å; V96-N110 PolarHBondContact O-N 3.45Å; V96-N110 PolarHBondContact O-ND2 2.96Å; N110-Q116 WeakPolarHBondContact OD1-CG 3.3Å; N110-Q116 PolarHBondContact OD1-NE2 2.99Å
111	A	85	Confident	83.4	Confident	9 Å²	9	52.7 Å²	52.7	7%	0.074	28%	0.282	C	S	.	.			trans	-74.5	157.5	176	0	0	0	0	0	111.6	L90 S113 G114 E115	L90-A111 HydrophobicContact CD1-CB 3.58Å; L90-A111 HydrophobicContact CD2-CB 4.4Å; L90-A111 HydrophobicContact CG-CB 3.93Å; A111-S113 WeakPolarHBondContact CB-OG 3.41Å; A111-S113 PolarHBondContact O-N 3.15Å; A111-G114 PolarHBondContact O-N 3.2Å; A111-E115 PolarHBondContact N-O 3.06Å
112	I	73.1	Confident	83.4	Confident	140 Å²	140	47.1 Å²	47.1	72%	0.718	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-24.1	174.6	-165.7	168	0	0	0	112.7	G114	I112-G114 PolarHBondContact O-N 2.99Å
113	S	71.6	Confident	83.6	Confident	83 Å²	83	46.1 Å²	46.1	58%	0.58	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-12.1	173	60	0	0	0	0	113.6	A111 E115	A111-S113 WeakPolarHBondContact CB-OG 3.41Å; A111-S113 PolarHBondContact O-N 3.15Å; S113-E115 PolarHBondContact OG-N 3.3Å
114	G	65	Low	83.2	Confident	44 Å²	44	46.7 Å²	46.7	45%	0.454	27%	0.268	S	S	.	.	S	Bend	trans	89.8	-5.6	-173.2	0	0	0	0	0	114.1	A111 I112	A111-G114 PolarHBondContact O-N 3.2Å; I112-G114 PolarHBondContact O-N 2.99Å
115	E	78.6	Confident	83	Confident	101 Å²	101	45.8 Å²	45.8	47%	0.472	26%	0.263	S	S	.	.			trans	-68.7	136.5	172.5	-68.5	-165.9	149.3	0	0	111.5	L90 A111 S113	L90-E115 HydrophobicContact CD1-CB 3.72Å; A111-E115 PolarHBondContact N-O 3.06Å; S113-E115 PolarHBondContact OG-N 3.3Å
116	Q	85.2	Confident	82.9	Confident	43 Å²	43	50.9 Å²	50.9	20%	0.201	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	128.4	-177.6	176	176.4	54.6	0	0	111.6	V109 N110 L366	V109-Q116 WeakPolarHBondContact O-CA 3.34Å; N110-Q116 WeakPolarHBondContact OD1-CG 3.3Å; N110-Q116 PolarHBondContact OD1-NE2 2.99Å; Q116-L366 HydrophobicContact CG-CD2 4.45Å
117	Y	92	Very high	82.7	Confident	20 Å²	20	53.5 Å²	53.5	8%	0.078	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	119.4	167.1	-68.3	-3	0	0	0	110.1	F64 Y75 L90 T108 V109	F64-Y117 HydrophobicContact CE1-CD2 4.15Å; Y75-Y117 AromaticContact CD1-CE2 3.89Å; Y75-Y117 HydrophobicContact CD1-CE2 3.89Å; Y75-Y117 AromaticContact CE1-CE2 4Å; Y75-Y117 HydrophobicContact CE1-CE2 4Å; Y75-Y117 AromaticContact CE1-CZ 3.86Å; L90-Y117 HydrophobicContact CB-CD2 4.25Å; L90-Y117 HydrophobicContact CB-CE2 3.68Å; L90-Y117 HydrophobicContact CD1-CE1 4.34Å; L90-Y117 HydrophobicContact CD2-CD2 3.9Å; L90-Y117 HydrophobicContact CD2-CE2 4.15Å; L90-Y117 HydrophobicContact CD2-CG 4.14Å; L90-Y117 HydrophobicContact CG-CE2 4.36Å; T108-Y117 CarbonylContact C-O 3.55Å; T108-Y117 VanDerWaalsContact CA-O 3.29Å; T108-Y117 WeakPolarHBondContact CA-O 3.23Å; V109-Y117 PolarHBondContact N-O 3.14Å; V109-Y117 PolarHBondContact O-N 3.33Å
118	K	89.8	Confident	82.5	Confident	60 Å²	60	55.2 Å²	55.2	26%	0.261	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	116.8	168	-176.3	174.5	-174.3	170.9	0	108.5	Y52 W59 T106 T108 L366	Y52-K118 PolarHBondContact N-O 3.4Å; W59-K118 HydrophobicContact CH2-CD 4.2Å; W59-K118 HydrophobicContact CH2-CG 3.71Å; W59-K118 HydrophobicContact CZ2-CD 4.33Å; W59-K118 HydrophobicContact CZ2-CG 4.34Å; W59-K118 HydrophobicContact CZ3-CG 4.43Å; W59-K118 WeakPolarHBondContact CZ3-O 3.44Å; T106-K118 HydrophobicContact CG2-CG 4.19Å; T108-K118 HydrophobicContact CG2-CB 4.17Å; T108-K118 HydrophobicContact CG2-CG 4.11Å; K118-L366 HydrophobicContact CB-CD2 3.83Å; K118-L366 HydrophobicContact CD-CD2 4.16Å
119	L	93.1	Very high	82.3	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	143.7	-170.7	-56.8	-178.5	0	0	0	110	L49 M50 K51 F64 L73 T106 F107 V109	L49-L119 HydrophobicContact CD1-CD1 3.99Å; M50-L119 CarbonylContact O-C 3.55Å; M50-L119 WeakPolarHBondContact O-CA 2.93Å; K51-L119 HydrophobicContact CB-CD2 3.97Å; K51-L119 HydrophobicContact CG-CD2 3.86Å; F64-L119 HydrophobicContact CE1-CD1 4.09Å; F64-L119 HydrophobicContact CE1-CD2 3.9Å; F64-L119 HydrophobicContact CE2-CD2 3.87Å; F64-L119 HydrophobicContact CZ-CD1 4.24Å; F64-L119 HydrophobicContact CZ-CD2 3.28Å; F64-L119 HydrophobicContact CZ-CG 4.42Å; L73-L119 HydrophobicContact CD2-CD1 4.28Å; T106-L119 CarbonylContact C-O 3.53Å; T106-L119 WeakPolarHBondContact CA-O 3.27Å; T106-L119 WeakPolarHBondContact CG2-O 3.43Å; F107-L119 HydrophobicContact CD1-CB 4.29Å; F107-L119 HydrophobicContact CD2-CB 4.45Å; F107-L119 HydrophobicContact CE1-CB 3.84Å; F107-L119 HydrophobicContact CE2-CB 4Å; F107-L119 HydrophobicContact CE2-CD1 3.74Å; F107-L119 HydrophobicContact CE2-CG 4.36Å; F107-L119 HydrophobicContact CZ-CB 3.69Å; F107-L119 HydrophobicContact CZ-CD1 3.78Å; F107-L119 HydrophobicContact CZ-CG 4.34Å; F107-L119 PolarHBondContact N-O 2.6Å; F107-L119 PolarHBondContact O-N 2.65Å; V109-L119 HydrophobicContact CG2-CD1 4.2Å
120	R	91.6	Very high	82.2	Confident	97 Å²	97	63.2 Å²	63.2	37%	0.366	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	134.4	176.8	178.1	175.5	174.5	-177.4	4.7	109.5	M50 W59 H105	M50-R120 HydrophobicContact CB-CB 4.23Å; M50-R120 WeakPolarHBondContact CB-O 3.24Å; M50-R120 HydrophobicContact CE-CB 4.25Å; M50-R120 HydrophobicContact CE-CG 3.74Å; M50-R120 PolarHBondContact N-O 2.98Å; M50-R120 PolarHBondContact O-N 2.83Å; W59-R120 HydrophobicContact CD2-CB 4.47Å; W59-R120 HydrophobicContact CE3-CB 3.87Å; W59-R120 HydrophobicContact CH2-CB 3.52Å; W59-R120 HydrophobicContact CZ2-CB 4.2Å; W59-R120 HydrophobicContact CZ3-CB 3.36Å; H105-R120 HydrophobicContact CB-CG 4.07Å; H105-R120 WeakPolarHBondContact O-CA 3.47Å
121	V	89.1	Confident	82.5	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.012	33%	0.33	C	S	.	.			trans	-85.3	139.6	175.2	-171.7	0	0	0	0	109.4	L49 H105 F107 E127 R128	L49-V121 HydrophobicContact CD2-CB 4.45Å; L49-V121 HydrophobicContact CD2-CG2 3.82Å; H105-V121 PolarHBondContact O-N 2.77Å; F107-V121 HydrophobicContact CD1-CG2 4.49Å; F107-V121 HydrophobicContact CE1-CG2 3.92Å; V121-E127 HydrophobicContact CG1-CB 3.66Å; V121-E127 HydrophobicContact CG1-CG 3.43Å; V121-E127 VanDerWaalsContact CG1-CG 3.43Å; V121-E127 WeakPolarHBondContact CG1-OE2 3.32Å; V121-R128 HydrophobicContact CB-CB 4.48Å; V121-R128 HydrophobicContact CG2-CB 3.84Å; V121-R128 HydrophobicContact CG2-CG 4.44Å
122	A	72.9	Confident	82.7	Confident	54 Å²	54	61.2 Å²	61.2	45%	0.446	33%	0.326	S	S	.	.	S	Bend	trans	-82	-27.2	-173.9	0	0	0	0	0	113.9	Y61	Y61-A122 HydrophobicContact CE1-CB 3.94Å; Y61-A122 WeakPolarHBondContact OH-CB 3.49Å
123	S	68.3	Low	83.4	Confident	87 Å²	87	56.8 Å²	56.8	61%	0.608	31%	0.308	S	S	*	.	S	Bend	trans	-108.4	-57.4	-164.2	81	0	0	0	0	115.1	E127	S123-E127 PolarHBondContact OG-OE2 3.43Å
124	D	74.1	Confident	84.2	Confident	70 Å²	70	54.4 Å²	54.4	37%	0.374	29%	0.286	S	S	.	.			trans	-149.8	151.3	-169.2	-169	3.3	0	0	0	113	K126 E127 R128	D124-K126 PolarHBondContact O-N 2.67Å; D124-K126 PolarHBondContact OD1-N 2.68Å; D124-E127 PolarHBondContact O-N 2.94Å; D124-E127 VanDerWaalsContact O-N 3.16Å; D124-R128 PolarHBondContact O-N 2.86Å
125	A	78.2	Confident	85.5	Confident	30 Å²	30	52.3 Å²	52.3	25%	0.248	27%	0.265	C	S	.	.	H	α-helix	trans	-61.2	-27.6	172.6	0	0	0	0	0	112.8	S104 R128 Q129	S104-A125 WeakPolarHBondContact O-CA 3.09Å; S104-A125 WeakPolarHBondContact O-CB 3.46Å; A125-R128 WeakPolarHBondContact O-CB 3.48Å; A125-R128 PolarHBondContact O-N 2.48Å; A125-Q129 PolarHBondContact O-N 2.66Å
126	K	83.8	Confident	85.9	Confident	161 Å²	161	51.6 Å²	51.6	70%	0.7	26%	0.261	S	S	*	.	H	α-helix	trans	-65	-41.1	172.9	-68.3	-178.9	-175.6	169.1	0	112.3	D124 R128 Q129 H130	D124-K126 PolarHBondContact O-N 2.67Å; D124-K126 PolarHBondContact OD1-N 2.68Å; K126-R128 VanDerWaalsContact C-N 3.33Å; K126-Q129 PolarHBondContact O-N 3.31Å; K126-H130 WeakPolarHBondContact O-CB 3.5Å; K126-H130 PolarHBondContact O-N 3.22Å
127	E	85.7	Confident	86	Confident	58 Å²	58	52.8 Å²	52.8	27%	0.271	27%	0.268	S	S	.	.	H	α-helix	trans	-68	-36.8	178.2	-179.2	-173.7	-172.5	0	0	110.4	V121 S123 D124 Q129 H130 W131	V121-E127 HydrophobicContact CG1-CB 3.66Å; V121-E127 HydrophobicContact CG1-CG 3.43Å; V121-E127 VanDerWaalsContact CG1-CG 3.43Å; V121-E127 WeakPolarHBondContact CG1-OE2 3.32Å; S123-E127 PolarHBondContact OG-OE2 3.43Å; D124-E127 PolarHBondContact O-N 2.94Å; D124-E127 VanDerWaalsContact O-N 3.16Å; E127-Q129 PolarHBondContact O-N 2.79Å; E127-H130 WeakPolarHBondContact O-CB 3.24Å; E127-H130 PolarHBondContact O-N 2.64Å; E127-W131 PolarHBondContact O-N 3.41Å
128	R	87.6	Confident	85.8	Confident	36 Å²	36	52.1 Å²	52.1	14%	0.136	27%	0.266	C	S	.	.	H	α-helix	trans	-56.3	-51.5	168.2	-178.1	-172	70.5	165.2	-2.8	111.9	S100 D103 S104 T106 F107 V121 D124 A125 K126 H130 W131 V132	S100-R128 PolarHBondContact O-NH1 2.92Å; D103-R128 PolarHBondContact O-NH1 3.07Å; S104-R128 VanDerWaalsContact C-CZ 3.45Å; S104-R128 VanDerWaalsContact O-CD 3.24Å; S104-R128 WeakPolarHBondContact O-CD 3.34Å; S104-R128 VanDerWaalsContact O-CZ 3.25Å; S104-R128 PolarHBondContact O-NE 3.23Å; T106-R128 WeakPolarHBondContact O-CD 3.32Å; T106-R128 PolarHBondContact O-NH1 3.35Å; F107-R128 HydrophobicContact CD1-CG 3.91Å; V121-R128 HydrophobicContact CB-CB 4.48Å; V121-R128 HydrophobicContact CG2-CB 3.84Å; V121-R128 HydrophobicContact CG2-CG 4.44Å; D124-R128 PolarHBondContact O-N 2.86Å; A125-R128 WeakPolarHBondContact O-CB 3.48Å; A125-R128 PolarHBondContact O-N 2.48Å; K126-R128 VanDerWaalsContact C-N 3.33Å; R128-H130 PolarHBondContact O-N 3.28Å; R128-W131 PolarHBondContact O-N 2.95Å; R128-V132 HydrophobicContact CG-CG2 4.24Å; R128-V132 WeakPolarHBondContact O-CB 3.06Å; R128-V132 WeakPolarHBondContact O-CG2 3.26Å; R128-V132 PolarHBondContact O-N 2.97Å
129	Q	86.1	Confident	85.6	Confident	105 Å²	105	49.7 Å²	49.7	49%	0.491	26%	0.257	S	S	.	.	H	α-helix	trans	-61.6	-35.6	-179.3	-169.6	62.3	25	0	0	111.5	A125 K126 E127 S133	A125-Q129 PolarHBondContact O-N 2.66Å; K126-Q129 PolarHBondContact O-N 3.31Å; E127-Q129 PolarHBondContact O-N 2.79Å; Q129-S133 WeakPolarHBondContact O-CB 3.09Å; Q129-S133 PolarHBondContact O-N 3.3Å
130	H	89.3	Confident	85.2	Confident	90 Å²	90	55.2 Å²	55.2	42%	0.417	28%	0.282	S	S	.	.	H	α-helix	trans	-62.9	-52.8	175.4	-170.7	64.3	0	0	0	111.6	I45 K126 E127 R128 V132 S133 R134	I45-H130 WeakPolarHBondContact CD1-CD2 3.29Å; K126-H130 WeakPolarHBondContact O-CB 3.5Å; K126-H130 PolarHBondContact O-N 3.22Å; E127-H130 WeakPolarHBondContact O-CB 3.24Å; E127-H130 PolarHBondContact O-N 2.64Å; R128-H130 PolarHBondContact O-N 3.28Å; H130-V132 PolarHBondContact O-N 2.9Å; H130-S133 PolarHBondContact O-N 3.42Å; H130-R134 WeakPolarHBondContact O-CG 3.38Å; H130-R134 PolarHBondContact O-N 3.33Å
131	W	91.3	Very high	85	Confident	4 Å²	4	54.5 Å²	54.5	2%	0.015	28%	0.283	C	S	.	.	H	α-helix	trans	-58.4	-48.5	176.2	-86	100.4	0	0	0	112.7	I45 L49 F64 L73 F107 E127 R128 S133 R134 L135	I45-W131 HydrophobicContact CD1-CD2 3.71Å; I45-W131 HydrophobicContact CD1-CE3 4.07Å; I45-W131 HydrophobicContact CD1-CG 4.11Å; I45-W131 HydrophobicContact CD1-CH2 4.35Å; I45-W131 HydrophobicContact CD1-CZ2 4.01Å; I45-W131 HydrophobicContact CD1-CZ3 4.38Å; I45-W131 HydrophobicContact CG1-CD2 4.42Å; I45-W131 HydrophobicContact CG1-CH2 4.02Å; I45-W131 HydrophobicContact CG1-CZ2 3.91Å; I45-W131 HydrophobicContact CG1-CZ3 4.32Å; I45-W131 HydrophobicContact CG2-CE3 4.05Å; I45-W131 HydrophobicContact CG2-CH2 4.17Å; I45-W131 HydrophobicContact CG2-CZ3 3.76Å; L49-W131 HydrophobicContact CD1-CD2 3.84Å; L49-W131 HydrophobicContact CD1-CE3 4.02Å; L49-W131 HydrophobicContact CD1-CG 4.35Å; L49-W131 HydrophobicContact CD1-CH2 4.3Å; L49-W131 HydrophobicContact CD1-CZ2 4.13Å; L49-W131 HydrophobicContact CD1-CZ3 4.24Å; L49-W131 HydrophobicContact CD2-CD2 4.34Å; L49-W131 HydrophobicContact CD2-CG 4.27Å; L49-W131 HydrophobicContact CG-CD2 4.43Å; L49-W131 HydrophobicContact CG-CZ2 4.19Å; F64-W131 HydrophobicContact CB-CH2 3.83Å; F64-W131 HydrophobicContact CB-CZ3 4.27Å; L73-W131 HydrophobicContact CD1-CZ3 4.38Å; F107-W131 HydrophobicContact CE1-CB 4.28Å; F107-W131 HydrophobicContact CZ-CB 3.94Å; E127-W131 PolarHBondContact O-N 3.41Å; R128-W131 PolarHBondContact O-N 2.95Å; W131-S133 PolarHBondContact O-N 3Å; W131-R134 PolarHBondContact O-N 3.26Å; W131-L135 HydrophobicContact CE3-CD1 4.48Å; W131-L135 WeakPolarHBondContact O-CB 3.37Å; W131-L135 VanDerWaalsContact O-CG 3.24Å; W131-L135 WeakPolarHBondContact O-CG 3.37Å; W131-L135 PolarHBondContact O-N 3.25Å
132	V	89.6	Confident	84.8	Confident	1 Å²	1	56 Å²	56	1%	0.006	29%	0.29	C	S	.	.	H	α-helix	trans	-58.1	-48.9	178.8	167	0	0	0	0	110.9	I97 P99 F107 R128 H130 R134 L135 Q136	I97-V132 HydrophobicContact CG2-CB 4.44Å; I97-V132 HydrophobicContact CG2-CG1 4.06Å; I97-V132 HydrophobicContact CG2-CG2 4.26Å; P99-V132 HydrophobicContact CG-CG1 3.87Å; P99-V132 HydrophobicContact CG-CG2 4.25Å; F107-V132 HydrophobicContact CB-CG2 3.86Å; F107-V132 HydrophobicContact CD1-CG2 4.3Å; F107-V132 HydrophobicContact CD2-CG2 3.99Å; F107-V132 HydrophobicContact CG-CG2 3.8Å; R128-V132 HydrophobicContact CG-CG2 4.24Å; R128-V132 WeakPolarHBondContact O-CB 3.06Å; R128-V132 WeakPolarHBondContact O-CG2 3.26Å; R128-V132 PolarHBondContact O-N 2.97Å; H130-V132 PolarHBondContact O-N 2.9Å; V132-R134 PolarHBondContact O-N 3.06Å; V132-L135 PolarHBondContact O-N 3.35Å; V132-Q136 HydrophobicContact CG1-CG 4.38Å; V132-Q136 WeakPolarHBondContact O-CB 3.16Å; V132-Q136 VanDerWaalsContact O-CG 3.29Å; V132-Q136 WeakPolarHBondContact O-CG 3.38Å; V132-Q136 PolarHBondContact O-N 2.79Å
133	S	87.7	Confident	85.3	Confident	47 Å²	47	56.2 Å²	56.2	33%	0.329	29%	0.285	S	S	.	.	H	α-helix	trans	-59.9	-47.7	-179.5	-179.8	0	0	0	0	111.5	Q129 H130 W131 L135 Q136 I137	Q129-S133 WeakPolarHBondContact O-CB 3.09Å; Q129-S133 PolarHBondContact O-N 3.3Å; H130-S133 PolarHBondContact O-N 3.42Å; W131-S133 PolarHBondContact O-N 3Å; S133-L135 PolarHBondContact O-N 2.88Å; S133-Q136 PolarHBondContact O-N 3.17Å; S133-I137 WeakPolarHBondContact O-CD1 3.34Å; S133-I137 VanDerWaalsContact O-CG1 3.26Å; S133-I137 WeakPolarHBondContact O-CG1 3.07Å; S133-I137 PolarHBondContact O-N 3.31Å
134	R	89.6	Confident	85.8	Confident	33 Å²	33	56.2 Å²	56.2	13%	0.125	28%	0.276	C	S	.	.	H	α-helix	trans	-63	-42.9	178.9	-67	-51.6	-152.2	97.9	9.8	112.6	E43 I45 L66 H130 W131 V132 I137 C138	E43-R134 PolarHBondContact O-NH1 2.87Å; E43-R134 IonicContact OE2-NH2 2.69Å; E43-R134 PolarHBondContact OE2-NH2 3.43Å; I45-R134 HydrophobicContact CD1-CG 4.45Å; I45-R134 HydrophobicContact CG2-CB 4.09Å; I45-R134 HydrophobicContact CG2-CG 4.35Å; L66-R134 HydrophobicContact CD2-CB 4.07Å; H130-R134 WeakPolarHBondContact O-CG 3.38Å; H130-R134 PolarHBondContact O-N 3.33Å; W131-R134 PolarHBondContact O-N 3.26Å; V132-R134 PolarHBondContact O-N 3.06Å; R134-I137 PolarHBondContact O-N 3.47Å; R134-C138 WeakPolarHBondContact O-CB 3.49Å; R134-C138 PolarHBondContact O-N 3.13Å
135	L	91.3	Very high	86	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.9	-40.4	177.5	-70.7	168.8	0	0	0	112	L66 L73 L92 I97 F107 V109 W131 V132 S133 C138 T139	L66-L135 HydrophobicContact CD1-CD2 3.76Å; L66-L135 HydrophobicContact CD2-CD2 4.17Å; L66-L135 HydrophobicContact CG-CD2 4.47Å; L73-L135 HydrophobicContact CB-CD2 4.44Å; L73-L135 HydrophobicContact CD1-CD2 4.01Å; L73-L135 HydrophobicContact CD2-CD1 4.44Å; L73-L135 HydrophobicContact CD2-CD2 3.95Å; L73-L135 HydrophobicContact CG-CD2 4.36Å; L92-L135 HydrophobicContact CD1-CD2 3.84Å; L92-L135 HydrophobicContact CD2-CD2 4.31Å; I97-L135 HydrophobicContact CD1-CB 4.42Å; I97-L135 HydrophobicContact CG1-CB 3.98Å; F107-L135 HydrophobicContact CE2-CD1 3.63Å; F107-L135 HydrophobicContact CZ-CD1 4.31Å; V109-L135 HydrophobicContact CG2-CD1 3.95Å; W131-L135 HydrophobicContact CE3-CD1 4.48Å; W131-L135 WeakPolarHBondContact O-CB 3.37Å; W131-L135 VanDerWaalsContact O-CG 3.24Å; W131-L135 WeakPolarHBondContact O-CG 3.37Å; W131-L135 PolarHBondContact O-N 3.25Å; V132-L135 PolarHBondContact O-N 3.35Å; S133-L135 PolarHBondContact O-N 2.88Å; L135-C138 PolarHBondContact O-N 3Å; L135-T139 VanDerWaalsContact O-CB 3.29Å; L135-T139 WeakPolarHBondContact O-CB 3.25Å; L135-T139 PolarHBondContact O-N 3.32Å; L135-T139 PolarHBondContact O-OG1 3.44Å
136	Q	87.8	Confident	85.8	Confident	86 Å²	86	58.6 Å²	58.6	40%	0.402	29%	0.29	S	S	.	.	H	α-helix	trans	-63.7	-43.7	175.8	-75.6	175.5	-21.3	0	0	111.9	I97 V132 S133 T139 Q140	I97-Q136 HydrophobicContact CB-CG 3.96Å; I97-Q136 HydrophobicContact CD1-CG 4.31Å; I97-Q136 HydrophobicContact CG1-CG 4.45Å; I97-Q136 HydrophobicContact CG2-CG 4.4Å; V132-Q136 HydrophobicContact CG1-CG 4.38Å; V132-Q136 WeakPolarHBondContact O-CB 3.16Å; V132-Q136 VanDerWaalsContact O-CG 3.29Å; V132-Q136 WeakPolarHBondContact O-CG 3.38Å; V132-Q136 PolarHBondContact O-N 2.79Å; S133-Q136 PolarHBondContact O-N 3.17Å; Q136-T139 PolarHBondContact O-N 2.95Å; Q136-Q140 WeakPolarHBondContact O-CB 3.36Å; Q136-Q140 PolarHBondContact O-N 3.27Å
137	I	86.6	Confident	84.6	Confident	68 Å²	68	53.1 Å²	53.1	35%	0.349	28%	0.28	S	S	.	.	H	α-helix	trans	-60.2	-49.2	176.1	-68.3	163.7	0	0	0	110.7	S133 R134 T139 Q140 H141	S133-I137 WeakPolarHBondContact O-CD1 3.34Å; S133-I137 VanDerWaalsContact O-CG1 3.26Å; S133-I137 WeakPolarHBondContact O-CG1 3.07Å; S133-I137 PolarHBondContact O-N 3.31Å; R134-I137 PolarHBondContact O-N 3.47Å; I137-T139 PolarHBondContact O-N 2.99Å; I137-Q140 PolarHBondContact O-N 3.24Å; I137-H141 WeakPolarHBondContact O-CB 3.45Å; I137-H141 PolarHBondContact O-N 3.35Å
138	C	87.8	Confident	83.6	Confident	5 Å²	5	58.2 Å²	58.2	3%	0.034	30%	0.301	C	S	.	.	H	α-helix	trans	-61.3	-45	178.9	-177.4	0	0	0	0	111.6	L66 L92 R134 L135 H141 H142	L66-C138 HydrophobicContact CD1-CB 4.25Å; L66-C138 HydrophobicContact CD2-CB 4.19Å; L92-C138 HydrophobicContact CD1-CB 4.23Å; R134-C138 WeakPolarHBondContact O-CB 3.49Å; R134-C138 PolarHBondContact O-N 3.13Å; L135-C138 PolarHBondContact O-N 3Å; C138-H141 PolarHBondContact O-N 3.06Å; C138-H142 PolarHBondContact O-CD2 3.36Å; C138-H142 VanDerWaalsContact O-CD2 3.3Å; C138-H142 PolarHBondContact O-N 3.2Å
139	T	87.1	Confident	82.2	Confident	10 Å²	10	60.4 Å²	60.4	6%	0.061	32%	0.322	C	S	.	.	H	α-helix	trans	-58.8	-50.4	176.6	-59.1	0	0	0	0	111.4	L92 A95 I97 L135 Q136 I137 H141 H142 T143	L92-T139 WeakPolarHBondContact O-CG2 3.22Å; L92-T139 PolarHBondContact O-OG1 2.97Å; A95-T139 HydrophobicContact CB-CG2 4.26Å; A95-T139 WeakPolarHBondContact O-CG2 3.5Å; I97-T139 HydrophobicContact CD1-CG2 4.18Å; I97-T139 WeakPolarHBondContact CD1-OG1 3.23Å; L135-T139 VanDerWaalsContact O-CB 3.29Å; L135-T139 WeakPolarHBondContact O-CB 3.25Å; L135-T139 PolarHBondContact O-N 3.32Å; L135-T139 PolarHBondContact O-OG1 3.44Å; Q136-T139 PolarHBondContact O-N 2.95Å; I137-T139 PolarHBondContact O-N 2.99Å; T139-H141 PolarHBondContact O-N 3.48Å; T139-H142 PolarHBondContact O-N 2.91Å; T139-T143 WeakPolarHBondContact O-CB 3.49Å; T139-T143 PolarHBondContact O-N 2.87Å; T139-T143 PolarHBondContact O-OG1 2.95Å
140	Q	84.1	Confident	80.4	Confident	116 Å²	116	61.7 Å²	61.7	54%	0.542	33%	0.332	S	S	.	.	H	α-helix	trans	-58.7	-48.1	179.6	-179.1	178.6	-2.6	0	0	111.3	Q136 I137 H142 T143 E144	Q136-Q140 WeakPolarHBondContact O-CB 3.36Å; Q136-Q140 PolarHBondContact O-N 3.27Å; I137-Q140 PolarHBondContact O-N 3.24Å; Q140-H142 PolarHBondContact O-N 3.42Å; Q140-T143 PolarHBondContact O-N 3.11Å; Q140-E144 HydrophobicContact CG-CG 4.44Å; Q140-E144 VanDerWaalsContact CG-OE1 3.27Å; Q140-E144 WeakPolarHBondContact CG-OE1 3.41Å; Q140-E144 PolarHBondContact NE2-OE1 2.75Å; Q140-E144 WeakPolarHBondContact O-CB 3.15Å; Q140-E144 VanDerWaalsContact O-CG 3.32Å; Q140-E144 WeakPolarHBondContact O-CG 3.17Å; Q140-E144 PolarHBondContact O-N 2.91Å
141	H	86.4	Confident	78	Confident	81 Å²	81	62.8 Å²	62.8	38%	0.375	35%	0.347	S	S	.	.	H	α-helix	trans	-57.4	-48	179.5	176.9	-93	0	0	0	112.2	I137 C138 T139 E144 A145	I137-H141 WeakPolarHBondContact O-CB 3.45Å; I137-H141 PolarHBondContact O-N 3.35Å; C138-H141 PolarHBondContact O-N 3.06Å; T139-H141 PolarHBondContact O-N 3.48Å; H141-E144 PolarHBondContact O-N 2.81Å; H141-A145 WeakPolarHBondContact O-CB 3.2Å; H141-A145 PolarHBondContact O-N 2.96Å
142	H	85.1	Confident	75.2	Confident	34 Å²	34	66.7 Å²	66.7	16%	0.157	38%	0.38	C	S	.	.	H	α-helix	trans	-73.6	-33.4	-178.7	-80.5	-78.7	0	0	0	113.2	N68 E69 G71 A93 C138 T139 Q140 A145 L146	N68-H142 PolarHBondContact O-NE2 3.32Å; E69-H142 PolarHBondContact O-CE1 3.1Å; E69-H142 VanDerWaalsContact O-CE1 3.3Å; G71-H142 VanDerWaalsContact CA-CD2 3.41Å; G71-H142 WeakPolarHBondContact CA-CD2 3.31Å; G71-H142 VanDerWaalsContact CA-NE2 3.31Å; G71-H142 WeakPolarHBondContact CA-NE2 3.12Å; G71-H142 PolarHBondContact N-CE1 3.06Å; G71-H142 PolarHBondContact N-NE2 3.45Å; A93-H142 HydrophobicContact CB-CB 4.21Å; C138-H142 PolarHBondContact O-CD2 3.36Å; C138-H142 VanDerWaalsContact O-CD2 3.3Å; C138-H142 PolarHBondContact O-N 3.2Å; T139-H142 PolarHBondContact O-N 2.91Å; Q140-H142 PolarHBondContact O-N 3.42Å; H142-A145 PolarHBondContact O-N 2.82Å; H142-L146 WeakPolarHBondContact O-CB 3.16Å; H142-L146 PolarHBondContact O-N 2.88Å
143	T	83.4	Confident	72.5	Confident	58 Å²	58	72.7 Å²	72.7	36%	0.356	42%	0.419	S	S	.	.	H	α-helix	trans	-63.7	-43.2	171.1	-65.1	0	0	0	0	111.6	G94 T139 Q140 L146 G147	G94-T143 WeakPolarHBondContact CA-OG1 3.25Å; G94-T143 PolarHBondContact N-OG1 2.79Å; T139-T143 WeakPolarHBondContact O-CB 3.49Å; T139-T143 PolarHBondContact O-N 2.87Å; T139-T143 PolarHBondContact O-OG1 2.95Å; Q140-T143 PolarHBondContact O-N 3.11Å; T143-L146 PolarHBondContact O-N 2.97Å; T143-G147 PolarHBondContact O-N 3.45Å
144	E	78.7	Confident	69.7	Low	88 Å²	88	76.1 Å²	76.1	41%	0.411	44%	0.443	S	S	.	.	H	α-helix	trans	-67.3	-38.2	177.2	-73.6	178.6	-162.9	0	0	112.2	Q140 H141 L146 G147 K148	Q140-E144 HydrophobicContact CG-CG 4.44Å; Q140-E144 VanDerWaalsContact CG-OE1 3.27Å; Q140-E144 WeakPolarHBondContact CG-OE1 3.41Å; Q140-E144 PolarHBondContact NE2-OE1 2.75Å; Q140-E144 WeakPolarHBondContact O-CB 3.15Å; Q140-E144 VanDerWaalsContact O-CG 3.32Å; Q140-E144 WeakPolarHBondContact O-CG 3.17Å; Q140-E144 PolarHBondContact O-N 2.91Å; H141-E144 PolarHBondContact O-N 2.81Å; E144-L146 VanDerWaalsContact C-N 3.35Å; E144-G147 PolarHBondContact O-N 2.85Å; E144-K148 WeakPolarHBondContact O-CG 3.49Å; E144-K148 PolarHBondContact O-N 3.31Å; E144-K148 VanDerWaalsContact O-N 3.13Å
145	A	78.5	Confident	66.9	Low	45 Å²	45	85.2 Å²	85.2	37%	0.372	48%	0.477	S	S	.	.	H	α-helix	trans	-63	-41.8	173.8	0	0	0	0	0	111.6	H141 H142 K148 S149	H141-A145 WeakPolarHBondContact O-CB 3.2Å; H141-A145 PolarHBondContact O-N 2.96Å; H142-A145 PolarHBondContact O-N 2.82Å; A145-K148 PolarHBondContact O-N 3.03Å; A145-S149 PolarHBondContact O-N 3.34Å; A145-S149 PolarHBondContact O-OG 2.91Å
146	L	73.5	Confident	63.8	Low	105 Å²	105	96.3 Å²	96.3	55%	0.55	52%	0.519	S	S	.	.	H	α-helix	trans	-64.5	-39	175.5	-167.5	73.4	0	0	0	112.2	H142 T143 E144 K148 S149 N150	H142-L146 WeakPolarHBondContact O-CB 3.16Å; H142-L146 PolarHBondContact O-N 2.88Å; T143-L146 PolarHBondContact O-N 2.97Å; E144-L146 VanDerWaalsContact C-N 3.35Å; L146-K148 VanDerWaalsContact C-N 3.3Å; L146-K148 PolarHBondContact O-N 3.45Å; L146-S149 PolarHBondContact O-N 3.24Å; L146-S149 PolarHBondContact O-OG 3.3Å; L146-S149 VanDerWaalsContact O-OG 3.09Å; L146-N150 PolarHBondContact O-N 3.49Å
147	G	59.8	Low	60.9	Low	46 Å²	46	102.1 Å²	102.1	47%	0.474	54%	0.539	S	S	.	.	H	α-helix	trans	-69.1	-24.6	176.6	0	0	0	0	0	114.2	T143 E144	T143-G147 PolarHBondContact O-N 3.45Å; E144-G147 PolarHBondContact O-N 2.85Å
148	K	64.3	Low	58	Low	164 Å²	164	104.8 Å²	104.8	71%	0.713	56%	0.564	S	S	*	*	H	α-helix	trans	-83.5	-29.5	176.2	-71.9	168.6	-173	165.1	0	112.9	E144 A145 L146	E144-K148 WeakPolarHBondContact O-CG 3.49Å; E144-K148 PolarHBondContact O-N 3.31Å; E144-K148 VanDerWaalsContact O-N 3.13Å; A145-K148 PolarHBondContact O-N 3.03Å; L146-K148 VanDerWaalsContact C-N 3.3Å; L146-K148 PolarHBondContact O-N 3.45Å
149	S	58.4	Low	55.1	Low	83 Å²	83	111.5 Å²	111.5	58%	0.58	60%	0.604	S	S	*	*	H	α-helix	trans	-82	-17.9	176.8	60.1	0	0	0	0	113.5	A145 L146	A145-S149 PolarHBondContact O-N 3.34Å; A145-S149 PolarHBondContact O-OG 2.91Å; L146-S149 PolarHBondContact O-N 3.24Å; L146-S149 PolarHBondContact O-OG 3.3Å; L146-S149 VanDerWaalsContact O-OG 3.09Å
150	N	47.7	Very low	52.2	Low	131 Å²	131	115.4 Å²	115.4	70%	0.701	64%	0.638	S	S	*	*	S	Bend	trans	-138.7	92.8	175.1	-108.6	-6.4	0	0	0	111.3	L146 A152	L146-N150 PolarHBondContact O-N 3.49Å; N150-A152 PolarHBondContact O-N 2.77Å
151	P	38.8	Very low	49.6	Very low	114 Å²	114	115.6 Å²	115.6	74%	0.74	65%	0.652	S	S	*	*			trans	-73	110	174.6	27.4	-30.2	0	0	0	110.5
152	A	33.8	Very low	46.9	Very low	86 Å²	86	120.5 Å²	120.5	71%	0.711	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-71.5	146.4	165.9	0	0	0	0	0	110.6	N150 S154	N150-A152 PolarHBondContact O-N 2.77Å; A152-S154 PolarHBondContact O-N 2.97Å
153	P	33.3	Very low	44	Very low	127 Å²	127	124.6 Å²	124.6	83%	0.825	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-67.8	133.2	-173.7	23.8	-29.1	0	0	0	112.1	R155	P153-R155 PolarHBondContact O-N 2.81Å
154	S	28	Very low	41.3	Very low	119 Å²	119	127.4 Å²	127.4	83%	0.832	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-61	118.4	-175.6	-48.4	0	0	0	0	113	A152	A152-S154 PolarHBondContact O-N 2.97Å
155	R	29.6	Very low	38.8	Very low	223 Å²	223	127.9 Å²	127.9	84%	0.842	75%	0.748	S	S	*	*			trans	-97.4	114.2	155.2	-96.4	-176	-179	178.2	0.4	109.3	P153	P153-R155 PolarHBondContact O-N 2.81Å
156	R	27.1	Very low	36.3	Very low	233 Å²	233	131.3 Å²	131.3	88%	0.879	77%	0.77	S	S	*	*			trans	-65.2	131.7	172.1	-75.9	177.2	-114.9	179.4	-3.3	110
157	Y	27.2	Very low	34	Very low	208 Å²	208	132.1 Å²	132.1	82%	0.816	78%	0.784	S	S	*	*			trans	-129.7	127.4	150.4	-78	-74.7	0	0	0	109.5
158	S	25.4	Very low	32.7	Very low	124 Å²	124	136.2 Å²	136.2	87%	0.867	80%	0.802	S	S	*	*			trans	-75.9	153.3	-176.5	-58.7	0	0	0	0	112.2
159	V	26.8	Very low	30.7	Very low	146 Å²	146	136.8 Å²	136.8	89%	0.885	81%	0.812	S	S	*	*			trans	-92.2	139.1	-174	-176	0	0	0	0	111.7
160	A	26.6	Very low	29.2	Very low	93 Å²	93	138.6 Å²	138.6	77%	0.769	83%	0.825	S	S	*	*			trans	166	140.4	142.2	0	0	0	0	0	107.9
161	S	28.9	Very low	28.3	Very low	119 Å²	119	141.1 Å²	141.1	83%	0.832	84%	0.835	S	S	*	*			cis	-163.1	162.1	14.5	43.4	0	0	0	0	110.5
162	Q	30.1	Very low	27.6	Very low	185 Å²	185	147.4 Å²	147.4	86%	0.864	84%	0.844	S	S	*	*			trans	-79.5	176.4	-171.3	-65.1	174.4	-13.2	0	0	116.5
163	S	24.8	Very low	27.2	Very low	119 Å²	119	155.1 Å²	155.1	83%	0.832	85%	0.854	S	S	*	*			trans	100.3	132.9	166.5	76.9	0	0	0	0	113.9
164	S	26.2	Very low	27.1	Very low	117 Å²	117	154.3 Å²	154.3	82%	0.818	85%	0.849	S	S	*	*			cis	-157	149.5	24.4	44.7	0	0	0	0	111.8
165	A	25.9	Very low	27	Very low	98 Å²	98	153.6 Å²	153.6	81%	0.81	84%	0.844	S	S	*	*			trans	-83.9	149.9	177.6	0	0	0	0	0	113.5
166	S	26.7	Very low	26.9	Very low	118 Å²	118	152.4 Å²	152.4	83%	0.825	85%	0.848	S	S	*	*			trans	-176.6	120.3	139.8	47.3	0	0	0	0	112.3
167	S	23.6	Very low	26.9	Very low	121 Å²	121	146.7 Å²	146.7	85%	0.846	84%	0.844	S	S	*	*			trans	-144.2	131.3	156.7	-69.5	0	0	0	0	107.8
168	P	32.6	Very low	26.9	Very low	133 Å²	133	141.6 Å²	141.6	86%	0.864	85%	0.845	S	S	*	*			trans	-90.4	144.2	-177.5	33.7	-30.4	0	0	0	112.7
169	L	22.9	Very low	26.9	Very low	175 Å²	175	141.1 Å²	141.1	92%	0.916	84%	0.842	S	S	*	*			trans	-69.2	148.8	170.2	-72.9	136.8	0	0	0	112.1
170	S	28	Very low	27	Very low	121 Å²	121	138.2 Å²	138.2	85%	0.846	83%	0.833	S	S	*	*			trans	-143	105.3	151	-164.4	0	0	0	0	113.1
171	M	27.8	Very low	27	Very low	184 Å²	184	140.7 Å²	140.7	91%	0.906	83%	0.832	S	S	*	*			trans	11.6	126.3	146.7	-61	-114	-167.9	0	0	121.1
172	R	25.3	Very low	26.9	Very low	246 Å²	246	144.4 Å²	144.4	93%	0.928	83%	0.834	S	S	*	*			trans	-74.8	149.7	155.6	-80.8	176.3	167.2	172.3	-3.6	112
173	R	25.2	Very low	26.5	Very low	248 Å²	248	138.9 Å²	138.9	94%	0.936	83%	0.827	S	S	*	*			trans	-139.7	155.4	146.8	-95.4	-170.1	179.4	-176.3	0.6	111.6
174	P	29.6	Very low	26.5	Very low	111 Å²	111	145.9 Å²	145.9	72%	0.721	84%	0.835	S	S	*	*			trans	-114.3	156.8	-160	37.9	-24.4	0	0	0	116.2
175	S	26	Very low	26.5	Very low	104 Å²	104	146.6 Å²	146.6	73%	0.727	84%	0.835	S	S	*	*			trans	42.1	133.7	147.3	69.5	0	0	0	0	122.2
176	Q	28.3	Very low	26.7	Very low	197 Å²	197	151.7 Å²	151.7	92%	0.921	84%	0.842	S	S	*	*				-164	142.7	121.6	-104.3	171.4	38.2	0	0	111.4
177	S	26.8	Very low	26.6	Very low	113 Å²	113	152.6 Å²	152.6	79%	0.79	84%	0.837	S	S	*	*			trans	-91.7	162.1	178.3	63.4	0	0	0	0	111.9
178	A	26.5	Very low	27	Very low	102 Å²	102	154.8 Å²	154.8	84%	0.843	83%	0.834	S	S	*	*			trans	-161	141.5	141.1	0	0	0	0	0	110.3
179	S	26.9	Very low	26.8	Very low	114 Å²	114	158.7 Å²	158.7	80%	0.797	84%	0.837	S	S	*	*			trans	-106	156.6	-171.3	-39	0	0	0	0	111.4
180	A	27.9	Very low	26.9	Very low	85 Å²	85	154.3 Å²	154.3	70%	0.702	83%	0.834	S	S	*	*				112.2	147	128.2	0	0	0	0	0	121.1
181	L	26.2	Very low	26.8	Very low	144 Å²	144	154.2 Å²	154.2	75%	0.754	83%	0.833	S	S	*	*			trans	86.4	126.8	156.7	-47.5	177.6	0	0	0	115.7
182	F	27.3	Very low	27.1	Very low	198 Å²	198	151.8 Å²	151.8	87%	0.868	83%	0.829	S	S	*	*			cis	-146.6	154.7	40.6	-80.1	-94.8	0	0	0	113.5
183	G	21.9	Very low	27.3	Very low	69 Å²	69	151.2 Å²	151.2	71%	0.711	83%	0.828	S	S	*	*			trans	-107.8	164.5	165.8	0	0	0	0	0	112.5
184	W	25.4	Very low	27.7	Very low	266 Å²	266	145.1 Å²	145.1	100%	1.008	82%	0.823	S	S	*	*			trans	-147.5	133.8	154.9	-117	-9.8	0	0	0	111.6
185	T	26.4	Very low	27.7	Very low	132 Å²	132	144.7 Å²	144.7	81%	0.81	82%	0.823	S	S	*	*			trans	-98.1	142.5	174.6	49.6	0	0	0	0	110.2
186	Q	28.9	Very low	27.8	Very low	205 Å²	205	151 Å²	151	96%	0.958	83%	0.831	S	S	*	*			trans	-146.6	144.2	155.2	-127.6	-176.3	4.3	0	0	112.3
187	N	25.9	Very low	28.3	Very low	137 Å²	137	151.4 Å²	151.4	73%	0.733	83%	0.83	S	S	*	*			trans	-117.5	140	-162.4	-142	16.6	0	0	0	111.2
188	H	30.6	Very low	28.7	Very low	166 Å²	166	150.6 Å²	150.6	77%	0.769	82%	0.824	S	S	*	*			trans	38.9	131.8	154.3	-64.6	-55.5	0	0	0	124.9
189	K	27.9	Very low	29.9	Very low	216 Å²	216	152.4 Å²	152.4	94%	0.939	82%	0.819	S	S	*	*				-166	141.4	116.3	-103.6	175.5	-174.2	-179.5	0	111.4
190	G	26.4	Very low	30.9	Very low	82 Å²	82	151.1 Å²	151.1	85%	0.845	80%	0.801	S	S	*	*			trans	-103	-173.5	-163	0	0	0	0	0	118
191	S	25.6	Very low	32.4	Very low	119 Å²	119	150.2 Å²	150.2	83%	0.832	79%	0.788	S	S	*	*			trans	-159.7	136	159.1	-172.3	0	0	0	0	110.4
192	V	33.9	Very low	33.9	Very low	134 Å²	134	149 Å²	149	81%	0.812	78%	0.783	S	S	*	*			trans	-97	118.6	177.9	172.4	0	0	0	0	108
193	Y	28.8	Very low	35.8	Very low	234 Å²	234	146.7 Å²	146.7	92%	0.918	77%	0.774	S	S	*	*			trans	-151.9	115.8	149.8	-106.5	-82.5	0	0	0	109.2
194	S	33.4	Very low	38.3	Very low	119 Å²	119	145.3 Å²	145.3	83%	0.832	75%	0.75	S	S	*	*			trans	-79.7	123.7	176.3	158.8	0	0	0	0	110.4
195	S	30.5	Very low	40.7	Very low	102 Å²	102	136.6 Å²	136.6	71%	0.713	72%	0.723	S	S	*	*			trans	-158.7	119.8	149.1	-161.2	0	0	0	0	112.2
196	R	28.9	Very low	43.3	Very low	238 Å²	238	134 Å²	134	90%	0.898	70%	0.704	S	S	*	*			trans	64.5	112.2	163.8	-67.8	-179.2	-175.8	171.8	1.9	118.7	S198	R196-S198 PolarHBondContact O-N 2.92Å
197	K	38.7	Very low	45.6	Very low	205 Å²	205	125.4 Å²	125.4	89%	0.891	67%	0.668	S	S	*	*			trans	-43.8	122.9	170.2	-69.2	172.9	173	177.9	0	113.2
198	S	34.5	Very low	48.3	Very low	95 Å²	95	126.5 Å²	126.5	66%	0.664	66%	0.662	S	S	*	*			trans	-93	118.1	157.2	175.6	0	0	0	0	108.4	R196 M200	R196-S198 PolarHBondContact O-N 2.92Å; S198-M200 PolarHBondContact O-N 2.87Å
199	L	52.1	Low	50.9	Low	141 Å²	141	124.3 Å²	124.3	74%	0.738	65%	0.652	S	S	*	*			trans	-85.7	80.4	171	-87.5	144.1	0	0	0	108.7	Q272	L199-Q272 PolarHBondContact O-NE2 3.14Å; L199-Q272 VanDerWaalsContact O-NE2 3.16Å
200	M	48.2	Very low	53.6	Low	86 Å²	86	119.7 Å²	119.7	42%	0.424	64%	0.636	S	S	.	*			trans	-123.2	127	165.7	-71.2	-66.9	159.8	0	0	107.8	S198 D202 L205 Q268	S198-M200 PolarHBondContact O-N 2.87Å; M200-D202 PolarHBondContact O-N 3.01Å; M200-L205 HydrophobicContact CB-CD1 4.04Å; M200-L205 HydrophobicContact CB-CD2 4.43Å; M200-L205 HydrophobicContact CB-CG 4.16Å; M200-Q268 PolarHBondContact SD-NE2 3.19Å; M200-Q268 VanDerWaalsContact SD-NE2 3.42Å
201	P	58.7	Low	56.6	Low	67 Å²	67	116.9 Å²	116.9	44%	0.435	60%	0.6	S	S	.	*			trans	-60	127.9	170.3	-19.4	30.4	0	0	0	109.4	H203 L204	P201-H203 PolarHBondContact O-N 2.9Å; P201-L204 PolarHBondContact O-N 2.75Å
202	D	58.8	Low	59.5	Low	119 Å²	119	114.8 Å²	114.8	64%	0.636	59%	0.586	S	S	*	*	H	α-helix	trans	-48.3	-37.2	-174.3	-68.9	-35.7	0	0	0	112.9	M200 L204 L205 D206	M200-D202 PolarHBondContact O-N 3.01Å; D202-L204 VanDerWaalsContact C-N 3.34Å; D202-L204 PolarHBondContact O-N 3.16Å; D202-L205 WeakPolarHBondContact O-CB 3.24Å; D202-L205 PolarHBondContact O-N 3.27Å; D202-D206 PolarHBondContact O-N 2.85Å; D202-D206 VanDerWaalsContact O-N 3.09Å
203	H	66.8	Low	62.1	Low	149 Å²	149	113.7 Å²	113.7	69%	0.69	57%	0.572	S	S	*	*	H	α-helix	trans	-65.8	-25	-178.4	-56.3	-49.6	0	0	0	116.2	P201 D206 A207	P201-H203 PolarHBondContact O-N 2.9Å; H203-D206 IonicContact ND1-OD2 3.44Å; H203-A207 WeakPolarHBondContact O-CB 3.44Å; H203-A207 PolarHBondContact O-N 3.13Å
204	L	73.4	Confident	64.8	Low	40 Å²	40	103.9 Å²	103.9	21%	0.209	54%	0.539	C	S	.	.	H	α-helix	trans	-84.2	-24.4	177.4	-76.7	170.4	0	0	0	112.2	P201 D202 R208 L264 Q268	P201-L204 PolarHBondContact O-N 2.75Å; D202-L204 VanDerWaalsContact C-N 3.34Å; D202-L204 PolarHBondContact O-N 3.16Å; L204-R208 WeakPolarHBondContact O-CB 3.36Å; L204-R208 PolarHBondContact O-N 2.93Å; L204-R208 VanDerWaalsContact O-N 3.08Å; L204-L264 HydrophobicContact CD2-CB 4.01Å; L204-L264 HydrophobicContact CD2-CD1 4.28Å; L204-Q268 HydrophobicContact CD1-CB 4.45Å
205	L	77.1	Confident	67.4	Low	82 Å²	82	102.9 Å²	102.9	43%	0.429	52%	0.521	S	S	.	.	H	α-helix	trans	-69.8	-45.3	167.9	-65.8	171.6	0	0	0	109.7	M200 D202 A207 R208 E209	M200-L205 HydrophobicContact CB-CD1 4.04Å; M200-L205 HydrophobicContact CB-CD2 4.43Å; M200-L205 HydrophobicContact CB-CG 4.16Å; D202-L205 WeakPolarHBondContact O-CB 3.24Å; D202-L205 PolarHBondContact O-N 3.27Å; L205-A207 VanDerWaalsContact C-N 3.34Å; L205-A207 PolarHBondContact O-N 3.18Å; L205-R208 WeakPolarHBondContact O-CB 3.4Å; L205-R208 PolarHBondContact O-N 2.84Å; L205-R208 VanDerWaalsContact O-N 3.15Å; L205-E209 PolarHBondContact O-N 2.82Å
206	D	79.4	Confident	70.2	Confident	77 Å²	77	98.9 Å²	98.9	41%	0.412	50%	0.496	S	S	.	.	H	α-helix	trans	-58	-45.9	174.7	-60.5	-24.2	0	0	0	111.5	D202 H203 R208 E209 M210	D202-D206 PolarHBondContact O-N 2.85Å; D202-D206 VanDerWaalsContact O-N 3.09Å; H203-D206 IonicContact ND1-OD2 3.44Å; D206-R208 VanDerWaalsContact C-N 3.33Å; D206-R208 PolarHBondContact O-N 3.16Å; D206-E209 PolarHBondContact O-N 3.48Å; D206-M210 WeakPolarHBondContact O-CG 3.35Å; D206-M210 PolarHBondContact O-N 3.32Å
207	A	78.8	Confident	73	Confident	26 Å²	26	94.3 Å²	94.3	22%	0.215	49%	0.485	C	S	.	.	H	α-helix	trans	-63	-38.1	177.2	0	0	0	0	0	112.6	H203 L205 M211 L261	H203-A207 WeakPolarHBondContact O-CB 3.44Å; H203-A207 PolarHBondContact O-N 3.13Å; L205-A207 VanDerWaalsContact C-N 3.34Å; L205-A207 PolarHBondContact O-N 3.18Å; A207-M211 WeakPolarHBondContact O-CB 3.28Å; A207-M211 VanDerWaalsContact O-CG 3.29Å; A207-M211 WeakPolarHBondContact O-CG 3.31Å; A207-M211 PolarHBondContact O-N 3.04Å; A207-L261 HydrophobicContact CB-CD1 4.2Å
208	R	81.9	Confident	75.5	Confident	160 Å²	160	86 Å²	86	60%	0.604	45%	0.449	S	S	*	.	H	α-helix	trans	-67.7	-38.9	176	-175.8	-180	178.6	174.6	0.2	111.7	L204 L205 D206 M211 S212 L261	L204-R208 WeakPolarHBondContact O-CB 3.36Å; L204-R208 PolarHBondContact O-N 2.93Å; L204-R208 VanDerWaalsContact O-N 3.08Å; L205-R208 WeakPolarHBondContact O-CB 3.4Å; L205-R208 PolarHBondContact O-N 2.84Å; L205-R208 VanDerWaalsContact O-N 3.15Å; D206-R208 VanDerWaalsContact C-N 3.33Å; D206-R208 PolarHBondContact O-N 3.16Å; R208-M211 PolarHBondContact O-N 2.74Å; R208-S212 PolarHBondContact O-N 2.82Å; R208-L261 HydrophobicContact CB-CD2 4.41Å
209	E	85.1	Confident	78.1	Confident	119 Å²	119	89.2 Å²	89.2	56%	0.556	45%	0.447	S	S	*	.	H	α-helix	trans	-67.4	-45.8	176.9	-172.5	170.5	-175.4	0	0	111.4	L205 D206 M211 S212 Q213	L205-E209 PolarHBondContact O-N 2.82Å; D206-E209 PolarHBondContact O-N 3.48Å; E209-M211 VanDerWaalsContact C-N 3.29Å; E209-M211 PolarHBondContact O-N 2.9Å; E209-S212 WeakPolarHBondContact O-CB 3.47Å; E209-S212 PolarHBondContact O-N 3.18Å; E209-S212 VanDerWaalsContact O-N 3.14Å; E209-Q213 WeakPolarHBondContact O-CG 3.38Å; E209-Q213 PolarHBondContact O-N 2.84Å
210	M	85.4	Confident	80	Confident	120 Å²	120	86.4 Å²	86.4	59%	0.591	43%	0.432	S	S	*	.	H	α-helix	trans	-59.3	-40.1	173.6	-72.5	-172.1	-70.5	0	0	112	D206 Q213 A214	D206-M210 WeakPolarHBondContact O-CG 3.35Å; D206-M210 PolarHBondContact O-N 3.32Å; M210-Q213 PolarHBondContact O-N 2.82Å; M210-A214 WeakPolarHBondContact O-CB 3.4Å; M210-A214 PolarHBondContact O-N 2.98Å
211	M	87.8	Confident	81.9	Confident	22 Å²	22	85 Å²	85	11%	0.108	43%	0.426	C	S	.	.	H	α-helix	trans	-64	-41.1	174.8	-81.5	-61.8	-66.3	0	0	112.7	A207 R208 E209 Q213 A214 Q215 M254 L257 L261	A207-M211 WeakPolarHBondContact O-CB 3.28Å; A207-M211 VanDerWaalsContact O-CG 3.29Å; A207-M211 WeakPolarHBondContact O-CG 3.31Å; A207-M211 PolarHBondContact O-N 3.04Å; R208-M211 PolarHBondContact O-N 2.74Å; E209-M211 VanDerWaalsContact C-N 3.29Å; E209-M211 PolarHBondContact O-N 2.9Å; M211-Q213 VanDerWaalsContact C-N 3.33Å; M211-A214 PolarHBondContact O-N 2.99Å; M211-Q215 WeakPolarHBondContact O-CB 3.21Å; M211-Q215 VanDerWaalsContact O-CG 3.31Å; M211-Q215 WeakPolarHBondContact O-CG 3.38Å; M211-Q215 PolarHBondContact O-N 2.69Å; M211-M254 HydrophobicContact CE-CE 3.93Å; M211-L257 HydrophobicContact CE-CB 3.61Å; M211-L257 HydrophobicContact SD-CB 3.53Å; M211-L257 VanDerWaalsContact SD-CB 3.53Å; M211-L257 HydrophobicContact SD-CD1 4.18Å; M211-L257 HydrophobicContact SD-CG 4.41Å; M211-L261 HydrophobicContact CB-CD2 4.26Å; M211-L261 HydrophobicContact CG-CD2 4.08Å
212	S	86.4	Confident	83.4	Confident	76 Å²	76	83.2 Å²	83.2	53%	0.531	41%	0.413	S	S	.	.	H	α-helix	trans	-64	-39.2	175.4	-175.5	0	0	0	0	111.9	R208 E209 G216	R208-S212 PolarHBondContact O-N 2.82Å; E209-S212 WeakPolarHBondContact O-CB 3.47Å; E209-S212 PolarHBondContact O-N 3.18Å; E209-S212 VanDerWaalsContact O-N 3.14Å; S212-G216 PolarHBondContact O-N 3.05Å; S212-G216 VanDerWaalsContact O-N 3.1Å
213	Q	88.8	Confident	84.9	Confident	111 Å²	111	83.8 Å²	83.8	52%	0.519	41%	0.412	S	S	.	.	H	α-helix	trans	-66.5	-45.1	175.9	-68.7	175.4	14.7	0	0	111.3	E209 M210 M211 Q215 G216 Q217	E209-Q213 WeakPolarHBondContact O-CG 3.38Å; E209-Q213 PolarHBondContact O-N 2.84Å; M210-Q213 PolarHBondContact O-N 2.82Å; M211-Q213 VanDerWaalsContact C-N 3.33Å; Q213-Q215 VanDerWaalsContact C-N 3.35Å; Q213-Q215 PolarHBondContact O-N 2.97Å; Q213-G216 PolarHBondContact O-N 3.45Å; Q213-G216 VanDerWaalsContact O-N 3.14Å; Q213-Q217 PolarHBondContact O-N 3.31Å
214	A	86.9	Confident	85.9	Confident	27 Å²	27	80.4 Å²	80.4	22%	0.223	41%	0.405	C	S	.	.	H	α-helix	trans	-63.2	-38.4	176.8	0	0	0	0	0	112.4	M210 M211 G216 Q217 H218 M254	M210-A214 WeakPolarHBondContact O-CB 3.4Å; M210-A214 PolarHBondContact O-N 2.98Å; M211-A214 PolarHBondContact O-N 2.99Å; A214-G216 VanDerWaalsContact C-N 3.32Å; A214-G216 PolarHBondContact O-N 3.3Å; A214-Q217 PolarHBondContact O-N 2.93Å; A214-H218 VanDerWaalsContact O-CB 3.32Å; A214-H218 WeakPolarHBondContact O-CB 3.43Å; A214-H218 PolarHBondContact O-N 3.47Å; A214-M254 HydrophobicContact CB-CE 4.02Å; A214-M254 HydrophobicContact CB-SD 4.05Å
215	Q	87.6	Confident	86.6	Confident	99 Å²	99	78.9 Å²	78.9	46%	0.463	40%	0.397	S	S	.	.	H	α-helix	trans	-62	-39.1	172.2	-78	178.8	-25.5	0	0	112.2	M211 Q213 R219 M254	M211-Q215 WeakPolarHBondContact O-CB 3.21Å; M211-Q215 VanDerWaalsContact O-CG 3.31Å; M211-Q215 WeakPolarHBondContact O-CG 3.38Å; M211-Q215 PolarHBondContact O-N 2.69Å; Q213-Q215 VanDerWaalsContact C-N 3.35Å; Q213-Q215 PolarHBondContact O-N 2.97Å; Q215-R219 WeakPolarHBondContact O-CB 3.46Å; Q215-R219 PolarHBondContact O-N 2.76Å; Q215-M254 HydrophobicContact CB-CE 4.15Å; Q215-M254 HydrophobicContact CG-CE 3.32Å
216	G	88.3	Confident	87	Confident	18 Å²	18	80.5 Å²	80.5	19%	0.186	40%	0.402	C	S	.	.	H	α-helix	trans	-60.7	-52	173.2	0	0	0	0	0	111.8	S212 Q213 A214 H218 R219 D220	S212-G216 PolarHBondContact O-N 3.05Å; S212-G216 VanDerWaalsContact O-N 3.1Å; Q213-G216 PolarHBondContact O-N 3.45Å; Q213-G216 VanDerWaalsContact O-N 3.14Å; A214-G216 VanDerWaalsContact C-N 3.32Å; A214-G216 PolarHBondContact O-N 3.3Å; G216-H218 VanDerWaalsContact C-N 3.33Å; G216-H218 PolarHBondContact O-N 2.91Å; G216-R219 WeakPolarHBondContact O-CB 3.15Å; G216-R219 PolarHBondContact O-N 2.83Å; G216-R219 VanDerWaalsContact O-N 3.16Å; G216-D220 VanDerWaalsContact O-CG 3.23Å; G216-D220 PolarHBondContact O-N 2.82Å
217	Q	88.6	Confident	87.2	Confident	141 Å²	141	79.9 Å²	79.9	66%	0.659	41%	0.414	S	S	*	.	H	α-helix	trans	-61.6	-39	178.8	-68.6	177.6	-9.8	0	0	112.7	Q213 A214 D220 L221	Q213-Q217 PolarHBondContact O-N 3.31Å; A214-Q217 PolarHBondContact O-N 2.93Å; Q217-D220 PolarHBondContact O-N 3.36Å; Q217-L221 WeakPolarHBondContact O-CB 3.15Å; Q217-L221 PolarHBondContact O-N 3.19Å
218	H	90.3	Very high	87.5	Confident	30 Å²	30	81 Å²	81	14%	0.139	42%	0.416	C	S	.	.	H	α-helix	trans	-62.2	-43.5	174.6	175	65.9	0	0	0	112	A214 G216 L221 I222 S250 M251 M254	A214-H218 VanDerWaalsContact O-CB 3.32Å; A214-H218 WeakPolarHBondContact O-CB 3.43Å; A214-H218 PolarHBondContact O-N 3.47Å; G216-H218 VanDerWaalsContact C-N 3.33Å; G216-H218 PolarHBondContact O-N 2.91Å; H218-L221 WeakPolarHBondContact O-CB 3.3Å; H218-L221 PolarHBondContact O-N 2.89Å; H218-I222 VanDerWaalsContact CE1-CD1 3.42Å; H218-I222 WeakPolarHBondContact CE1-CD1 3.34Å; H218-I222 WeakPolarHBondContact NE2-CD1 3.39Å; H218-I222 WeakPolarHBondContact O-CG1 3.34Å; H218-I222 PolarHBondContact O-N 2.81Å; H218-S250 PolarHBondContact ND1-OG 3.28Å; H218-M251 VanDerWaalsContact CE1-CA 3.5Å; H218-M251 WeakPolarHBondContact CE1-CA 3.41Å; H218-M251 PolarHBondContact CE1-N 3.17Å; H218-M254 HydrophobicContact CB-CG 3.92Å; H218-M254 HydrophobicContact CB-SD 4.45Å
219	R	90.6	Very high	87.3	Confident	164 Å²	164	77.9 Å²	77.9	62%	0.619	42%	0.416	S	S	*	.	H	α-helix	trans	-64	-43.8	176.7	-175.1	-177.6	63.9	-151.3	-4.4	111.5	Q215 G216 L221 I222 Q223	Q215-R219 WeakPolarHBondContact O-CB 3.46Å; Q215-R219 PolarHBondContact O-N 2.76Å; G216-R219 WeakPolarHBondContact O-CB 3.15Å; G216-R219 PolarHBondContact O-N 2.83Å; G216-R219 VanDerWaalsContact O-N 3.16Å; R219-L221 VanDerWaalsContact C-N 3.31Å; R219-L221 PolarHBondContact O-N 2.89Å; R219-I222 PolarHBondContact O-N 2.89Å; R219-Q223 WeakPolarHBondContact O-CB 3.31Å; R219-Q223 PolarHBondContact O-N 3.01Å
220	D	90.5	Very high	86.3	Confident	81 Å²	81	78 Å²	78	43%	0.433	43%	0.425	S	S	.	.	H	α-helix	trans	-65.6	-36.6	179.2	-62.1	-13.1	0	0	0	111.3	G216 Q217 Q223 S224	G216-D220 VanDerWaalsContact O-CG 3.23Å; G216-D220 PolarHBondContact O-N 2.82Å; Q217-D220 PolarHBondContact O-N 3.36Å; D220-Q223 PolarHBondContact O-N 3.06Å; D220-S224 WeakPolarHBondContact O-CB 3.42Å; D220-S224 PolarHBondContact O-N 2.76Å; D220-S224 PolarHBondContact O-OG 3.19Å
221	L	88.5	Confident	85.2	Confident	56 Å²	56	75.5 Å²	75.5	29%	0.293	42%	0.424	S	S	.	.	H	α-helix	trans	-61.4	-48.7	172	177	65	0	0	0	111.7	Q217 H218 R219 Q223 S224 I225 L246	Q217-L221 WeakPolarHBondContact O-CB 3.15Å; Q217-L221 PolarHBondContact O-N 3.19Å; H218-L221 WeakPolarHBondContact O-CB 3.3Å; H218-L221 PolarHBondContact O-N 2.89Å; R219-L221 VanDerWaalsContact C-N 3.31Å; R219-L221 PolarHBondContact O-N 2.89Å; L221-Q223 PolarHBondContact O-N 3.37Å; L221-S224 PolarHBondContact O-N 3.4Å; L221-I225 HydrophobicContact CD1-CD1 4.07Å; L221-I225 HydrophobicContact CD1-CG1 4.49Å; L221-I225 HydrophobicContact CG-CD1 4.05Å; L221-I225 WeakPolarHBondContact O-CG1 3.32Å; L221-I225 PolarHBondContact O-N 2.8Å; L221-L246 HydrophobicContact CD1-CD2 4.37Å
222	I	89.8	Confident	83.7	Confident	30 Å²	30	81.3 Å²	81.3	15%	0.154	46%	0.463	C	S	.	.	H	α-helix	trans	-61.7	-45.6	178.3	-70.8	176.6	0	0	0	110.7	H218 R219 S224 I225 E226 K247	H218-I222 VanDerWaalsContact CE1-CD1 3.42Å; H218-I222 WeakPolarHBondContact CE1-CD1 3.34Å; H218-I222 WeakPolarHBondContact NE2-CD1 3.39Å; H218-I222 WeakPolarHBondContact O-CG1 3.34Å; H218-I222 PolarHBondContact O-N 2.81Å; R219-I222 PolarHBondContact O-N 2.89Å; I222-S224 VanDerWaalsContact C-N 3.26Å; I222-S224 PolarHBondContact O-N 3.24Å; I222-I225 PolarHBondContact O-N 2.73Å; I222-E226 HydrophobicContact CG2-CG 4.2Å; I222-E226 WeakPolarHBondContact CG2-OE1 3.37Å; I222-E226 WeakPolarHBondContact O-CB 3.18Å; I222-E226 WeakPolarHBondContact O-CG 3.42Å; I222-E226 PolarHBondContact O-N 2.97Å; I222-K247 HydrophobicContact CG1-CD 4.48Å; I222-K247 HydrophobicContact CG1-CG 4.2Å
223	Q	90.1	Very high	82.5	Confident	131 Å²	131	79.9 Å²	79.9	61%	0.612	46%	0.46	S	S	*	.	H	α-helix	trans	-63.3	-34.3	179.2	-170	172.3	8.5	0	0	111.9	R219 D220 L221 G227	R219-Q223 WeakPolarHBondContact O-CB 3.31Å; R219-Q223 PolarHBondContact O-N 3.01Å; D220-Q223 PolarHBondContact O-N 3.06Å; L221-Q223 PolarHBondContact O-N 3.37Å; Q223-G227 PolarHBondContact O-N 2.64Å
224	S	89.1	Confident	81.1	Confident	79 Å²	79	81.9 Å²	81.9	55%	0.552	48%	0.483	S	S	*	.	H	α-helix	trans	-68.7	-39.1	174.9	-59.4	0	0	0	0	112.3	D220 L221 I222	D220-S224 WeakPolarHBondContact O-CB 3.42Å; D220-S224 PolarHBondContact O-N 2.76Å; D220-S224 PolarHBondContact O-OG 3.19Å; L221-S224 PolarHBondContact O-N 3.4Å; I222-S224 VanDerWaalsContact C-N 3.26Å; I222-S224 PolarHBondContact O-N 3.24Å
225	I	87.3	Confident	80	Confident	8 Å²	8	83.3 Å²	83.3	4%	0.041	50%	0.5	C	S	.	.	H	α-helix	trans	-69.8	-43.2	177	-66.6	167.5	0	0	0	110.7	L221 I222 G227 L228 P238 L243 K247	L221-I225 HydrophobicContact CD1-CD1 4.07Å; L221-I225 HydrophobicContact CD1-CG1 4.49Å; L221-I225 HydrophobicContact CG-CD1 4.05Å; L221-I225 WeakPolarHBondContact O-CG1 3.32Å; L221-I225 PolarHBondContact O-N 2.8Å; I222-I225 PolarHBondContact O-N 2.73Å; I225-G227 VanDerWaalsContact C-N 3.33Å; I225-L228 PolarHBondContact O-N 3.12Å; I225-P238 WeakPolarHBondContact O-CB 3.45Å; I225-L243 HydrophobicContact CG2-CB 4.21Å; I225-K247 HydrophobicContact CD1-CB 4.3Å
226	E	85.5	Confident	79.2	Confident	116 Å²	116	83.8 Å²	83.8	54%	0.542	51%	0.505	S	S	.	.	H	α-helix	trans	-73.3	-24.8	179.8	-69.9	178.3	175.9	0	0	113	I222 L228 K247	I222-E226 HydrophobicContact CG2-CG 4.2Å; I222-E226 WeakPolarHBondContact CG2-OE1 3.37Å; I222-E226 WeakPolarHBondContact O-CB 3.18Å; I222-E226 WeakPolarHBondContact O-CG 3.42Å; I222-E226 PolarHBondContact O-N 2.97Å; E226-L228 VanDerWaalsContact C-N 3.28Å; E226-L228 PolarHBondContact O-N 2.7Å; E226-K247 IonicContact OE1-NZ 3.3Å; E226-K247 PolarHBondContact OE1-NZ 3.27Å
227	G	84.3	Confident	78.8	Confident	63 Å²	63	84.5 Å²	84.5	65%	0.649	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-1.8	176.4	0	0	0	0	0	114.9	Q223 I225	Q223-G227 PolarHBondContact O-N 2.64Å; I225-G227 VanDerWaalsContact C-N 3.33Å
228	L	85.3	Confident	78.3	Confident	49 Å²	49	79 Å²	79	26%	0.257	48%	0.483	S	S	.	.	S	Bend	trans	-68.7	142.2	177.8	-69.4	170.6	0	0	0	111.2	I225 E226 V230 L236 P238 L243	I225-L228 PolarHBondContact O-N 3.12Å; E226-L228 VanDerWaalsContact C-N 3.28Å; E226-L228 PolarHBondContact O-N 2.7Å; L228-V230 PolarHBondContact O-N 3.13Å; L228-L236 HydrophobicContact CD1-CB 4.24Å; L228-P238 HydrophobicContact CB-CG 3.81Å; L228-P238 VanDerWaalsContact O-CG 3.28Å; L228-P238 WeakPolarHBondContact O-CG 3.23Å; L228-L243 HydrophobicContact CD1-CD1 3.5Å; L228-L243 VanDerWaalsContact CD1-CD1 3.5Å
229	P	76.5	Confident	77.8	Confident	95 Å²	95	84 Å²	84	62%	0.617	51%	0.51	S	S	*	.			trans	-67.3	133.2	-178.3	26.3	-32.4	0	0	0	111.5	A231	P229-A231 PolarHBondContact O-N 3.06Å
230	V	65.3	Low	77.5	Confident	122 Å²	122	78.7 Å²	78.7	74%	0.739	50%	0.495	S	S	*	.			trans	-79.4	21.6	-177.6	-168	0	0	0	0	112.4	L228 P238	L228-V230 PolarHBondContact O-N 3.13Å; V230-P238 HydrophobicContact CG2-CG 4.44Å
231	A	61.8	Low	77	Confident	68 Å²	68	82.6 Å²	82.6	56%	0.562	51%	0.51	S	S	*	.			trans	-80.7	146.4	-170.3	0	0	0	0	0	112.9	P229 G233	P229-A231 PolarHBondContact O-N 3.06Å; A231-G233 PolarHBondContact O-N 3.39Å
232	P	55.8	Low	76.7	Confident	144 Å²	144	85 Å²	85	94%	0.935	52%	0.524	S	S	*	.	S	Bend	trans	-81.6	55.8	-177.2	34.8	-35.4	0	0	0	112.1
233	G	61.9	Low	76.5	Confident	45 Å²	45	85 Å²	85	46%	0.464	52%	0.524	S	S	.	.	S	Bend	trans	-118.7	174.6	173.4	0	0	0	0	0	111.8	A231 G235	A231-G233 PolarHBondContact O-N 3.39Å; G233-G235 PolarHBondContact O-N 2.89Å
234	P	59.3	Low	76.1	Confident	153 Å²	153	82.5 Å²	82.5	99%	0.994	51%	0.514	S	S	*	.	S	Bend	trans	-74.8	26.7	-177.6	32.2	-35.2	0	0	0	113.9
235	G	64.4	Low	75.8	Confident	57 Å²	57	84 Å²	84	59%	0.588	51%	0.514	S	S	*	.	S	Bend	trans	-94.8	159.9	177.9	0	0	0	0	0	112.2	G233 S237	G233-G235 PolarHBondContact O-N 2.89Å; G235-S237 PolarHBondContact O-N 3.22Å
236	L	70.1	Confident	75.7	Confident	110 Å²	110	87.5 Å²	87.5	58%	0.576	53%	0.532	S	S	*	.			trans	-60.1	126.9	174.4	-70.3	165.6	0	0	0	110.3	L228 L243	L228-L236 HydrophobicContact CD1-CB 4.24Å; L236-L243 HydrophobicContact CB-CD1 4.3Å; L236-L243 HydrophobicContact CD2-CD1 4.38Å
237	S	80.1	Confident	75.7	Confident	33 Å²	33	84.4 Å²	84.4	23%	0.231	52%	0.517	C	S	.	.			trans	-106.5	151	-179.9	168.2	0	0	0	0	110.4	G235 L239 D240	G235-S237 PolarHBondContact O-N 3.22Å; S237-L239 PolarHBondContact O-N 3.33Å; S237-L239 PolarHBondContact OG-N 2.95Å; S237-D240 WeakPolarHBondContact O-CB 3.41Å; S237-D240 PolarHBondContact O-N 3.42Å
238	P	77.1	Confident	75.4	Confident	24 Å²	24	83.9 Å²	83.9	16%	0.156	51%	0.506	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-19.5	170.5	-20	28.2	0	0	0	114.4	I225 L228 V230	I225-P238 WeakPolarHBondContact O-CB 3.45Å; L228-P238 HydrophobicContact CB-CG 3.81Å; L228-P238 VanDerWaalsContact O-CG 3.28Å; L228-P238 WeakPolarHBondContact O-CG 3.23Å; V230-P238 HydrophobicContact CG2-CG 4.44Å
239	L	81.2	Confident	75.2	Confident	135 Å²	135	85 Å²	85	71%	0.707	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	7.2	179.1	-61.5	174.8	0	0	0	113.3	S237 Q241	S237-L239 PolarHBondContact O-N 3.33Å; S237-L239 PolarHBondContact OG-N 2.95Å; L239-Q241 PolarHBondContact O-N 2.88Å
240	D	84.4	Confident	75.7	Confident	54 Å²	54	81.7 Å²	81.7	29%	0.289	49%	0.494	S	S	.	.			trans	-62.1	133.1	175.8	-176.9	-84.7	0	0	0	111	S237 D242 L243 L244	S237-D240 WeakPolarHBondContact O-CB 3.41Å; S237-D240 PolarHBondContact O-N 3.42Å; D240-D242 VanDerWaalsContact C-N 3.3Å; D240-D242 PolarHBondContact O-N 3.03Å; D240-D242 WeakPolarHBondContact OD1-CB 3.3Å; D240-D242 PolarHBondContact OD1-N 3.09Å; D240-L243 HydrophobicContact CB-CB 4.16Å; D240-L243 HydrophobicContact CB-CD1 4.06Å; D240-L243 HydrophobicContact CB-CG 4.08Å; D240-L243 PolarHBondContact O-N 3.31Å; D240-L243 PolarHBondContact OD1-N 3.46Å; D240-L244 WeakPolarHBondContact O-CB 3.26Å; D240-L244 WeakPolarHBondContact O-CG 3.47Å; D240-L244 PolarHBondContact O-N 3.37Å
241	Q	80.3	Confident	76.7	Confident	163 Å²	163	81.1 Å²	81.1	76%	0.762	49%	0.485	S	S	*	.	H	α-helix	trans	-63	-35.8	-171.9	-173.8	173.6	-5.8	0	0	112.5	L239 M245	L239-Q241 PolarHBondContact O-N 2.88Å; Q241-M245 VanDerWaalsContact O-CB 3.3Å; Q241-M245 WeakPolarHBondContact O-CB 3.31Å; Q241-M245 PolarHBondContact O-N 3.23Å
242	D	81.4	Confident	77.6	Confident	107 Å²	107	80.8 Å²	80.8	57%	0.572	48%	0.482	S	S	*	.	H	α-helix	trans	-75.5	-36.4	179.8	-69.5	-26.1	0	0	0	110.9	D240 M245 L246	D240-D242 VanDerWaalsContact C-N 3.3Å; D240-D242 PolarHBondContact O-N 3.03Å; D240-D242 WeakPolarHBondContact OD1-CB 3.3Å; D240-D242 PolarHBondContact OD1-N 3.09Å; D242-M245 PolarHBondContact O-N 3.31Å; D242-L246 VanDerWaalsContact O-CB 3.31Å; D242-L246 WeakPolarHBondContact O-CB 3.44Å; D242-L246 PolarHBondContact O-N 3.1Å
243	L	85.4	Confident	79	Confident	30 Å²	30	77.6 Å²	77.6	16%	0.157	46%	0.46	C	S	.	.	H	α-helix	trans	-68.7	-38.1	173.6	-65.2	-177.1	0	0	0	112.5	I225 L228 L236 D240 L246 K247	I225-L243 HydrophobicContact CG2-CB 4.21Å; L228-L243 HydrophobicContact CD1-CD1 3.5Å; L228-L243 VanDerWaalsContact CD1-CD1 3.5Å; L236-L243 HydrophobicContact CB-CD1 4.3Å; L236-L243 HydrophobicContact CD2-CD1 4.38Å; D240-L243 HydrophobicContact CB-CB 4.16Å; D240-L243 HydrophobicContact CB-CD1 4.06Å; D240-L243 HydrophobicContact CB-CG 4.08Å; D240-L243 PolarHBondContact O-N 3.31Å; D240-L243 PolarHBondContact OD1-N 3.46Å; L243-L246 PolarHBondContact O-N 3.41Å; L243-K247 WeakPolarHBondContact O-CB 3.4Å; L243-K247 PolarHBondContact O-N 3.31Å
244	L	82.4	Confident	80.4	Confident	78 Å²	78	76.5 Å²	76.5	41%	0.408	44%	0.443	S	S	.	.	H	α-helix	trans	-66.6	-40.6	174	-72.2	175.3	0	0	0	111.6	D240 K247 A248	D240-L244 WeakPolarHBondContact O-CB 3.26Å; D240-L244 WeakPolarHBondContact O-CG 3.47Å; D240-L244 PolarHBondContact O-N 3.37Å; L244-K247 PolarHBondContact O-N 3.28Å; L244-A248 WeakPolarHBondContact O-CB 3.2Å; L244-A248 PolarHBondContact O-N 2.62Å
245	M	82.5	Confident	81.3	Confident	110 Å²	110	72.3 Å²	72.3	54%	0.542	42%	0.417	S	S	.	.	H	α-helix	trans	-65	-41.3	174.2	-176.7	170.3	56.4	0	0	111.4	Q241 D242 A248 T249	Q241-M245 VanDerWaalsContact O-CB 3.3Å; Q241-M245 WeakPolarHBondContact O-CB 3.31Å; Q241-M245 PolarHBondContact O-N 3.23Å; D242-M245 PolarHBondContact O-N 3.31Å; M245-A248 PolarHBondContact O-N 3.4Å; M245-T249 HydrophobicContact CG-CG2 4.47Å; M245-T249 WeakPolarHBondContact O-CB 3.44Å; M245-T249 WeakPolarHBondContact O-CG2 3.35Å; M245-T249 PolarHBondContact O-N 2.53Å; M245-T249 PolarHBondContact O-OG1 3.41Å
246	L	84.7	Confident	82.1	Confident	81 Å²	81	73 Å²	73	42%	0.424	41%	0.413	S	S	.	.	H	α-helix	trans	-62.2	-42.1	174.1	-175.9	64	0	0	0	111.6	L221 D242 L243 T249 S250	L221-L246 HydrophobicContact CD1-CD2 4.37Å; D242-L246 VanDerWaalsContact O-CB 3.31Å; D242-L246 WeakPolarHBondContact O-CB 3.44Å; D242-L246 PolarHBondContact O-N 3.1Å; L243-L246 PolarHBondContact O-N 3.41Å; L246-T249 WeakPolarHBondContact CA-OG1 3.46Å; L246-T249 PolarHBondContact O-OG1 2.97Å; L246-T249 VanDerWaalsContact O-OG1 3.07Å; L246-S250 WeakPolarHBondContact O-CB 3.05Å; L246-S250 PolarHBondContact O-N 3.2Å
247	K	84.7	Confident	82.7	Confident	52 Å²	52	71.4 Å²	71.4	23%	0.226	40%	0.404	C	S	.	.	H	α-helix	trans	-62.5	-47.4	174.9	-179.6	172.4	178.3	-179.8	0	111.8	I222 I225 E226 L243 L244 S250 M251	I222-K247 HydrophobicContact CG1-CD 4.48Å; I222-K247 HydrophobicContact CG1-CG 4.2Å; I225-K247 HydrophobicContact CD1-CB 4.3Å; E226-K247 IonicContact OE1-NZ 3.3Å; E226-K247 PolarHBondContact OE1-NZ 3.27Å; L243-K247 WeakPolarHBondContact O-CB 3.4Å; L243-K247 PolarHBondContact O-N 3.31Å; L244-K247 PolarHBondContact O-N 3.28Å; K247-S250 PolarHBondContact O-N 3.2Å; K247-M251 WeakPolarHBondContact O-CB 3.38Å; K247-M251 PolarHBondContact O-N 2.82Å
248	A	79.1	Confident	82.8	Confident	52 Å²	52	72.5 Å²	72.5	43%	0.43	41%	0.412	S	S	.	.	H	α-helix	trans	-64.3	-45.1	-179.9	0	0	0	0	0	112.3	L244 M245 M251 A252	L244-A248 WeakPolarHBondContact O-CB 3.2Å; L244-A248 PolarHBondContact O-N 2.62Å; M245-A248 PolarHBondContact O-N 3.4Å; A248-M251 PolarHBondContact O-N 3.28Å; A248-A252 WeakPolarHBondContact O-CB 3.36Å; A248-A252 PolarHBondContact O-N 3.26Å
249	T	81	Confident	82.8	Confident	72 Å²	72	77 Å²	77	44%	0.442	43%	0.431	S	S	.	.	H	α-helix	trans	-67.1	-40.9	178	48.7	0	0	0	0	112.1	M245 L246 A252 T253	M245-T249 HydrophobicContact CG-CG2 4.47Å; M245-T249 WeakPolarHBondContact O-CB 3.44Å; M245-T249 WeakPolarHBondContact O-CG2 3.35Å; M245-T249 PolarHBondContact O-N 2.53Å; M245-T249 PolarHBondContact O-OG1 3.41Å; L246-T249 WeakPolarHBondContact CA-OG1 3.46Å; L246-T249 PolarHBondContact O-OG1 2.97Å; L246-T249 VanDerWaalsContact O-OG1 3.07Å; T249-A252 PolarHBondContact O-N 2.85Å; T249-T253 WeakPolarHBondContact O-CB 3.36Å; T249-T253 PolarHBondContact O-N 3.27Å; T249-T253 PolarHBondContact O-OG1 3.27Å
250	S	87.4	Confident	82.6	Confident	26 Å²	26	73.4 Å²	73.4	18%	0.182	42%	0.416	C	S	.	.	H	α-helix	trans	-62.1	-44.1	174.8	-169.9	0	0	0	0	111.5	H218 L246 K247 T253 M254	H218-S250 PolarHBondContact ND1-OG 3.28Å; L246-S250 WeakPolarHBondContact O-CB 3.05Å; L246-S250 PolarHBondContact O-N 3.2Å; K247-S250 PolarHBondContact O-N 3.2Å; S250-T253 PolarHBondContact O-N 3.3Å; S250-M254 WeakPolarHBondContact O-CG 3.48Å; S250-M254 PolarHBondContact O-N 3.42Å
251	M	85.8	Confident	82.6	Confident	109 Å²	109	72 Å²	72	54%	0.537	41%	0.409	S	S	.	.	H	α-helix	trans	-64.6	-44.9	177.7	-175.9	172.7	57.9	0	0	112.4	H218 K247 A248 T253 M254 S255	H218-M251 VanDerWaalsContact CE1-CA 3.5Å; H218-M251 WeakPolarHBondContact CE1-CA 3.41Å; H218-M251 PolarHBondContact CE1-N 3.17Å; K247-M251 WeakPolarHBondContact O-CB 3.38Å; K247-M251 PolarHBondContact O-N 2.82Å; A248-M251 PolarHBondContact O-N 3.28Å; M251-T253 VanDerWaalsContact C-N 3.32Å; M251-T253 PolarHBondContact O-N 3.44Å; M251-M254 PolarHBondContact O-N 3.25Å; M251-S255 PolarHBondContact O-N 2.98Å
252	A	81.5	Confident	82.3	Confident	61 Å²	61	69.3 Å²	69.3	50%	0.504	40%	0.396	S	S	.	.	H	α-helix	trans	-62.3	-39.7	175.7	0	0	0	0	0	112.1	A248 T249 S255 C256	A248-A252 WeakPolarHBondContact O-CB 3.36Å; A248-A252 PolarHBondContact O-N 3.26Å; T249-A252 PolarHBondContact O-N 2.85Å; A252-S255 PolarHBondContact O-N 2.97Å; A252-C256 WeakPolarHBondContact O-CB 3.29Å; A252-C256 PolarHBondContact O-N 2.91Å
253	T	84.2	Confident	82.1	Confident	77 Å²	77	68.4 Å²	68.4	47%	0.472	39%	0.39	S	S	.	.	H	α-helix	trans	-63.3	-44.7	176.8	-56.3	0	0	0	0	111.1	T249 S250 M251 S255 C256 L257	T249-T253 WeakPolarHBondContact O-CB 3.36Å; T249-T253 PolarHBondContact O-N 3.27Å; T249-T253 PolarHBondContact O-OG1 3.27Å; S250-T253 PolarHBondContact O-N 3.3Å; M251-T253 VanDerWaalsContact C-N 3.32Å; M251-T253 PolarHBondContact O-N 3.44Å; T253-S255 PolarHBondContact O-N 3.3Å; T253-C256 PolarHBondContact O-N 2.69Å; T253-L257 HydrophobicContact CG2-CD1 4.05Å; T253-L257 HydrophobicContact CG2-CG 4.47Å; T253-L257 WeakPolarHBondContact O-CG 3.47Å; T253-L257 PolarHBondContact O-N 3.3Å
254	M	90.3	Very high	81.6	Confident	23 Å²	23	70.7 Å²	70.7	11%	0.113	40%	0.402	C	S	.	.	H	α-helix	trans	-64.5	-38.2	177.3	-69.9	-50.7	-57	0	0	112.7	M211 A214 Q215 H218 S250 M251 S258	M211-M254 HydrophobicContact CE-CE 3.93Å; A214-M254 HydrophobicContact CB-CE 4.02Å; A214-M254 HydrophobicContact CB-SD 4.05Å; Q215-M254 HydrophobicContact CB-CE 4.15Å; Q215-M254 HydrophobicContact CG-CE 3.32Å; H218-M254 HydrophobicContact CB-CG 3.92Å; H218-M254 HydrophobicContact CB-SD 4.45Å; S250-M254 WeakPolarHBondContact O-CG 3.48Å; S250-M254 PolarHBondContact O-N 3.42Å; M251-M254 PolarHBondContact O-N 3.25Å; M254-S258 VanDerWaalsContact O-CB 3.31Å; M254-S258 WeakPolarHBondContact O-CB 3.43Å; M254-S258 PolarHBondContact O-N 3.05Å
255	S	79.7	Confident	81.4	Confident	64 Å²	64	70.6 Å²	70.6	45%	0.448	40%	0.4	S	S	.	.	H	α-helix	trans	-62.1	-48.4	174.6	-161.6	0	0	0	0	111.3	M251 A252 T253 L257 S258 E259	M251-S255 PolarHBondContact O-N 2.98Å; A252-S255 PolarHBondContact O-N 2.97Å; T253-S255 PolarHBondContact O-N 3.3Å; S255-L257 PolarHBondContact O-N 3.27Å; S255-S258 PolarHBondContact O-N 2.87Å; S255-E259 PolarHBondContact O-N 2.92Å
256	C	80.8	Confident	81	Confident	72 Å²	72	70.1 Å²	70.1	49%	0.486	40%	0.399	S	S	.	.	H	α-helix	trans	-62	-43.9	-179.9	-175.3	0	0	0	0	112.2	A252 T253 E259 C260	A252-C256 WeakPolarHBondContact O-CB 3.29Å; A252-C256 PolarHBondContact O-N 2.91Å; T253-C256 PolarHBondContact O-N 2.69Å; C256-E259 PolarHBondContact O-N 3.18Å; C256-C260 WeakPolarHBondContact O-CB 3.37Å; C256-C260 PolarHBondContact O-N 3.21Å; C256-C260 PolarHBondContact O-SG 2.69Å
257	L	83.4	Confident	80.3	Confident	77 Å²	77	70.9 Å²	70.9	40%	0.403	40%	0.4	S	S	.	.	H	α-helix	trans	-66.8	-36.6	177.5	-69.8	173.2	0	0	0	112.3	M211 T253 S255 C260 L261	M211-L257 HydrophobicContact CE-CB 3.61Å; M211-L257 HydrophobicContact SD-CB 3.53Å; M211-L257 VanDerWaalsContact SD-CB 3.53Å; M211-L257 HydrophobicContact SD-CD1 4.18Å; M211-L257 HydrophobicContact SD-CG 4.41Å; T253-L257 HydrophobicContact CG2-CD1 4.05Å; T253-L257 HydrophobicContact CG2-CG 4.47Å; T253-L257 WeakPolarHBondContact O-CG 3.47Å; T253-L257 PolarHBondContact O-N 3.3Å; S255-L257 PolarHBondContact O-N 3.27Å; L257-C260 PolarHBondContact O-N 2.99Å; L257-L261 PolarHBondContact O-N 3.1Å
258	S	81.8	Confident	79.6	Confident	56 Å²	56	69.7 Å²	69.7	39%	0.392	40%	0.395	S	S	.	.	H	α-helix	trans	-64.2	-43.7	174.9	-174.3	0	0	0	0	111.9	M254 S255 C260 L261 H262	M254-S258 VanDerWaalsContact O-CB 3.31Å; M254-S258 WeakPolarHBondContact O-CB 3.43Å; M254-S258 PolarHBondContact O-N 3.05Å; S255-S258 PolarHBondContact O-N 2.87Å; S258-C260 VanDerWaalsContact C-N 3.35Å; S258-L261 PolarHBondContact O-N 2.77Å; S258-H262 WeakPolarHBondContact O-CB 3.36Å; S258-H262 PolarHBondContact O-N 3.41Å
259	E	76.3	Confident	79.1	Confident	119 Å²	119	70.7 Å²	70.7	56%	0.556	40%	0.396	S	S	*	.	H	α-helix	trans	-62.7	-41.8	174.3	-76.2	174.3	-163.7	0	0	111.7	S255 C256 L261 H262 I263	S255-E259 PolarHBondContact O-N 2.92Å; C256-E259 PolarHBondContact O-N 3.18Å; E259-L261 PolarHBondContact O-N 2.9Å; E259-H262 WeakPolarHBondContact O-CB 3.18Å; E259-H262 PolarHBondContact O-N 2.91Å; E259-I263 VanDerWaalsContact O-CG1 3.3Å; E259-I263 WeakPolarHBondContact O-CG1 3.45Å; E259-I263 PolarHBondContact O-N 3.17Å
260	C	78.4	Confident	78.2	Confident	59 Å²	59	70 Å²	70	40%	0.399	40%	0.398	S	S	.	.	H	α-helix	trans	-61.3	-44.5	176.2	-72.1	0	0	0	0	111.9	C256 L257 S258 H262 I263 L264	C256-C260 WeakPolarHBondContact O-CB 3.37Å; C256-C260 PolarHBondContact O-N 3.21Å; C256-C260 PolarHBondContact O-SG 2.69Å; L257-C260 PolarHBondContact O-N 2.99Å; S258-C260 VanDerWaalsContact C-N 3.35Å; C260-H262 VanDerWaalsContact C-N 3.31Å; C260-H262 PolarHBondContact O-N 3.25Å; C260-I263 PolarHBondContact O-N 3.31Å; C260-L264 WeakPolarHBondContact O-CG 3.41Å; C260-L264 PolarHBondContact O-N 3.31Å
261	L	82.8	Confident	77	Confident	24 Å²	24	77.6 Å²	77.6	13%	0.126	42%	0.423	C	S	.	.	H	α-helix	trans	-62.8	-38.7	175.4	-174.6	66.3	0	0	0	111.5	A207 R208 M211 L257 S258 E259 L264 Q265	A207-L261 HydrophobicContact CB-CD1 4.2Å; R208-L261 HydrophobicContact CB-CD2 4.41Å; M211-L261 HydrophobicContact CB-CD2 4.26Å; M211-L261 HydrophobicContact CG-CD2 4.08Å; L257-L261 PolarHBondContact O-N 3.1Å; S258-L261 PolarHBondContact O-N 2.77Å; E259-L261 PolarHBondContact O-N 2.9Å; L261-L264 PolarHBondContact O-N 3.46Å; L261-Q265 WeakPolarHBondContact O-CG 3.35Å; L261-Q265 PolarHBondContact O-N 2.86Å
262	H	75.5	Confident	75.6	Confident	106 Å²	106	75.8 Å²	75.8	49%	0.491	41%	0.413	S	S	.	.	H	α-helix	trans	-64	-43.9	176.6	-173.6	62.2	0	0	0	112.3	S258 E259 C260 L264 Q265 L266	S258-H262 WeakPolarHBondContact O-CB 3.36Å; S258-H262 PolarHBondContact O-N 3.41Å; E259-H262 WeakPolarHBondContact O-CB 3.18Å; E259-H262 PolarHBondContact O-N 2.91Å; C260-H262 VanDerWaalsContact C-N 3.31Å; C260-H262 PolarHBondContact O-N 3.25Å; H262-L264 VanDerWaalsContact C-N 3.32Å; H262-L264 PolarHBondContact O-N 3.19Å; H262-Q265 WeakPolarHBondContact O-CB 3.47Å; H262-Q265 PolarHBondContact O-N 2.85Å; H262-L266 WeakPolarHBondContact O-CG 3.24Å; H262-L266 PolarHBondContact O-N 2.95Å
263	I	76.6	Confident	74.4	Confident	88 Å²	88	82.4 Å²	82.4	45%	0.451	43%	0.425	S	S	.	.	H	α-helix	trans	-61.1	-41.9	175.7	-67.7	164	0	0	0	110.8	E259 C260 Q265 L266 Q267	E259-I263 VanDerWaalsContact O-CG1 3.3Å; E259-I263 WeakPolarHBondContact O-CG1 3.45Å; E259-I263 PolarHBondContact O-N 3.17Å; C260-I263 PolarHBondContact O-N 3.31Å; I263-Q265 VanDerWaalsContact C-N 3.34Å; I263-Q265 PolarHBondContact O-N 3.01Å; I263-L266 PolarHBondContact O-N 3.39Å; I263-Q267 WeakPolarHBondContact O-CG 3.32Å; I263-Q267 PolarHBondContact O-N 2.9Å
264	L	75.6	Confident	72.9	Confident	79 Å²	79	82.7 Å²	82.7	41%	0.414	44%	0.435	S	S	.	.	H	α-helix	trans	-63.3	-39.5	177	-70.8	170.6	0	0	0	112.1	L204 C260 L261 H262 Q267 Q268	L204-L264 HydrophobicContact CD2-CB 4.01Å; L204-L264 HydrophobicContact CD2-CD1 4.28Å; C260-L264 WeakPolarHBondContact O-CG 3.41Å; C260-L264 PolarHBondContact O-N 3.31Å; L261-L264 PolarHBondContact O-N 3.46Å; H262-L264 VanDerWaalsContact C-N 3.32Å; H262-L264 PolarHBondContact O-N 3.19Å; L264-Q267 PolarHBondContact O-N 2.75Å; L264-Q268 PolarHBondContact O-N 2.83Å; L264-Q268 VanDerWaalsContact O-N 3.07Å
265	Q	77.1	Confident	70.8	Confident	76 Å²	76	85.7 Å²	85.7	36%	0.355	46%	0.463	S	S	.	.	H	α-helix	trans	-63.6	-44.3	174.4	-72.6	172.4	-9.4	0	0	111.8	L261 H262 I263 Q267 Q268 V269	L261-Q265 WeakPolarHBondContact O-CG 3.35Å; L261-Q265 PolarHBondContact O-N 2.86Å; H262-Q265 WeakPolarHBondContact O-CB 3.47Å; H262-Q265 PolarHBondContact O-N 2.85Å; I263-Q265 VanDerWaalsContact C-N 3.34Å; I263-Q265 PolarHBondContact O-N 3.01Å; Q265-Q267 PolarHBondContact O-N 3.27Å; Q265-Q268 PolarHBondContact O-N 2.83Å; Q265-V269 WeakPolarHBondContact O-CG2 3.06Å; Q265-V269 PolarHBondContact O-N 3.06Å
266	L	74.2	Confident	69.2	Low	100 Å²	100	89.1 Å²	89.1	52%	0.524	48%	0.476	S	S	.	.	H	α-helix	trans	-61.4	-42.6	176.7	-71.7	172.3	0	0	0	112.1	H262 I263 Q268 V269 A270	H262-L266 WeakPolarHBondContact O-CG 3.24Å; H262-L266 PolarHBondContact O-N 2.95Å; I263-L266 PolarHBondContact O-N 3.39Å; L266-Q268 VanDerWaalsContact C-N 3.32Å; L266-Q268 PolarHBondContact O-N 3.28Å; L266-V269 PolarHBondContact O-N 3.4Å; L266-A270 WeakPolarHBondContact O-CB 3.07Å; L266-A270 PolarHBondContact O-N 3.26Å
267	Q	71	Confident	67.7	Low	97 Å²	97	89.6 Å²	89.6	45%	0.453	49%	0.493	S	S	.	.	H	α-helix	trans	-63	-37.7	176.1	-73.8	-179.1	0.8	0	0	112.3	I263 L264 Q265 A270 R271	I263-Q267 WeakPolarHBondContact O-CG 3.32Å; I263-Q267 PolarHBondContact O-N 2.9Å; L264-Q267 PolarHBondContact O-N 2.75Å; Q265-Q267 PolarHBondContact O-N 3.27Å; Q267-A270 PolarHBondContact O-N 2.7Å; Q267-R271 WeakPolarHBondContact O-CG 3.46Å; Q267-R271 PolarHBondContact O-N 3.31Å
268	Q	68.7	Low	65.3	Low	26 Å²	26	90.6 Å²	90.6	12%	0.121	51%	0.512	C	S	.	.	H	α-helix	trans	-68.5	-42	176.6	-170.3	-171	-20.2	0	0	111.8	M200 L204 L264 Q265 L266 A270 R271 Q272	M200-Q268 PolarHBondContact SD-NE2 3.19Å; M200-Q268 VanDerWaalsContact SD-NE2 3.42Å; L204-Q268 HydrophobicContact CD1-CB 4.45Å; L264-Q268 PolarHBondContact O-N 2.83Å; L264-Q268 VanDerWaalsContact O-N 3.07Å; Q265-Q268 PolarHBondContact O-N 2.83Å; L266-Q268 VanDerWaalsContact C-N 3.32Å; L266-Q268 PolarHBondContact O-N 3.28Å; Q268-A270 VanDerWaalsContact C-N 3.31Å; Q268-A270 PolarHBondContact O-N 3.43Å; Q268-R271 PolarHBondContact O-N 2.59Å; Q268-Q272 WeakPolarHBondContact O-CG 3.35Å; Q268-Q272 PolarHBondContact O-N 3.14Å
269	V	68.5	Low	63.3	Low	73 Å²	73	95 Å²	95	44%	0.442	54%	0.537	S	S	.	.	H	α-helix	trans	-61.7	-41.1	175.5	172.4	0	0	0	0	110.9	Q265 L266 Q272 R273	Q265-V269 WeakPolarHBondContact O-CG2 3.06Å; Q265-V269 PolarHBondContact O-N 3.06Å; L266-V269 PolarHBondContact O-N 3.4Å; V269-Q272 PolarHBondContact O-N 2.84Å; V269-R273 PolarHBondContact O-N 3.46Å
270	A	63.4	Low	60.9	Low	59 Å²	59	92.9 Å²	92.9	49%	0.488	55%	0.547	S	S	.	.	H	α-helix	trans	-63	-41.1	174.6	0	0	0	0	0	112.3	L266 Q267 Q268 R273 A274	L266-A270 WeakPolarHBondContact O-CB 3.07Å; L266-A270 PolarHBondContact O-N 3.26Å; Q267-A270 PolarHBondContact O-N 2.7Å; Q268-A270 VanDerWaalsContact C-N 3.31Å; Q268-A270 PolarHBondContact O-N 3.43Å; A270-R273 PolarHBondContact O-N 2.99Å; A270-A274 PolarHBondContact O-N 3.48Å; A270-A274 VanDerWaalsContact O-N 3.11Å
271	R	61.5	Low	59	Low	185 Å²	185	96.1 Å²	96.1	70%	0.698	57%	0.567	S	S	*	*	H	α-helix	trans	-67.1	-38	175.5	-75.8	177.7	179.9	174	2.6	113	Q267 Q268 A274 A275	Q267-R271 WeakPolarHBondContact O-CG 3.46Å; Q267-R271 PolarHBondContact O-N 3.31Å; Q268-R271 PolarHBondContact O-N 2.59Å; R271-A274 PolarHBondContact O-N 2.83Å; R271-A275 PolarHBondContact O-N 2.77Å; R271-A275 VanDerWaalsContact O-N 3.1Å
272	Q	57	Low	56.3	Low	71 Å²	71	100.8 Å²	100.8	33%	0.332	60%	0.597	S	S	.	*	H	α-helix	trans	-68.5	-35.8	175.9	-75.3	-179.3	-12.1	0	0	111.9	L199 Q268 V269 A274 A275 L276	L199-Q272 PolarHBondContact O-NE2 3.14Å; L199-Q272 VanDerWaalsContact O-NE2 3.16Å; Q268-Q272 WeakPolarHBondContact O-CG 3.35Å; Q268-Q272 PolarHBondContact O-N 3.14Å; V269-Q272 PolarHBondContact O-N 2.84Å; Q272-A274 VanDerWaalsContact C-N 3.32Å; Q272-A274 PolarHBondContact O-N 2.87Å; Q272-A275 PolarHBondContact O-N 3.18Å; Q272-L276 PolarHBondContact O-N 3.31Å; Q272-L276 VanDerWaalsContact O-N 3.14Å
273	R	55.3	Low	54.1	Low	200 Å²	200	103.2 Å²	103.2	76%	0.755	61%	0.612	S	S	*	*	H	α-helix	trans	-64.1	-33.9	171	-83	-178.1	169.2	167	-2.6	113.1	V269 A270	V269-R273 PolarHBondContact O-N 3.46Å; A270-R273 PolarHBondContact O-N 2.99Å
274	A	53	Low	51.8	Low	83 Å²	83	107 Å²	107	69%	0.686	63%	0.628	S	S	*	*	H	α-helix	trans	-74.5	-26.2	174.8	0	0	0	0	0	113.3	A270 R271 Q272	A270-A274 PolarHBondContact O-N 3.48Å; A270-A274 VanDerWaalsContact O-N 3.11Å; R271-A274 PolarHBondContact O-N 2.83Å; Q272-A274 VanDerWaalsContact C-N 3.32Å; Q272-A274 PolarHBondContact O-N 2.87Å
275	A	46.1	Very low	49.5	Very low	86 Å²	86	114.2 Å²	114.2	71%	0.711	65%	0.649	S	S	*	*	H	α-helix	trans	-84.4	-25	180	0	0	0	0	0	113.8	R271 Q272 G277	R271-A275 PolarHBondContact O-N 2.77Å; R271-A275 VanDerWaalsContact O-N 3.1Å; Q272-A275 PolarHBondContact O-N 3.18Å; A275-G277 PolarHBondContact O-N 3Å
276	L	45.7	Very low	47.1	Very low	136 Å²	136	117.1 Å²	117.1	71%	0.712	67%	0.667	S	S	*	*	S	Bend	trans	-94.7	81.8	173.8	-72.7	159.4	0	0	0	108.5	Q272 A278	Q272-L276 PolarHBondContact O-N 3.31Å; Q272-L276 VanDerWaalsContact O-N 3.14Å; L276-A278 PolarHBondContact O-N 2.97Å
277	G	49.5	Very low	44.8	Very low	82 Å²	82	121.7 Å²	121.7	85%	0.845	69%	0.686	S	S	*	*			trans	-46.6	110	-178.9	0	0	0	0	0	112.7	A275	A275-G277 PolarHBondContact O-N 3Å
278	A	32.5	Very low	42.6	Very low	97 Å²	97	128.4 Å²	128.4	80%	0.802	71%	0.707	S	S	*	*			trans	-117.2	122.3	164.6	0	0	0	0	0	107.7	L276	L276-A278 PolarHBondContact O-N 2.97Å
279	T	39.9	Very low	40.5	Very low	150 Å²	150	137.2 Å²	137.2	92%	0.92	74%	0.744	S	S	*	*			trans	-68.8	134.7	-171.8	45.1	0	0	0	0	114.1
280	G	27.3	Very low	38.5	Very low	74 Å²	74	137.3 Å²	137.3	76%	0.763	76%	0.76	S	S	*	*			trans	128.4	146.4	145.9	0	0	0	0	0	117.1
281	P	36.8	Very low	36.7	Very low	127 Å²	127	142.1 Å²	142.1	83%	0.825	78%	0.778	S	S	*	*			cis	-108	143.4	-37	34.5	-21.1	0	0	0	111.9
282	T	27.5	Very low	35.1	Very low	122 Å²	122	141 Å²	141	75%	0.748	79%	0.785	S	S	*	*			trans	-67.7	127.4	173.5	-47.1	0	0	0	0	110.6	E284	T282-E284 HydrophobicContact CG2-CG 3.89Å
283	I	28.5	Very low	33.6	Very low	157 Å²	157	145 Å²	145	81%	0.805	81%	0.809	S	S	*	*			trans	-97.4	100.1	156.2	-65.9	-171.3	0	0	0	106.8	W285	I283-W285 PolarHBondContact O-N 3.19Å
284	E	28.4	Very low	32.3	Very low	168 Å²	168	141.2 Å²	141.2	79%	0.785	81%	0.808	S	S	*	*			trans	-73.5	108.6	166.2	-73.7	-179.7	146.5	0	0	109	T282	T282-E284 HydrophobicContact CG2-CG 3.89Å
285	W	28	Very low	31.1	Very low	229 Å²	229	144.8 Å²	144.8	87%	0.867	82%	0.815	S	S	*	*			trans	-143.9	112.1	152.7	-95.2	86.2	0	0	0	110.4	I283	I283-W285 PolarHBondContact O-N 3.19Å
286	L	26.1	Very low	30.2	Very low	137 Å²	137	150.6 Å²	150.6	72%	0.717	82%	0.824	S	S	*	*			trans	79.2	76	154.6	-129.8	80.5	0	0	0	120.1
287	E	25.8	Very low	29.1	Very low	197 Å²	197	152.3 Å²	152.3	92%	0.921	83%	0.834	S	S	*	*			trans	-73.4	126.4	141	-71	-169.7	152.3	0	0	109.4
288	R	24	Very low	27.9	Very low	237 Å²	237	152.3 Å²	152.3	89%	0.894	83%	0.834	S	S	*	*			trans	-77.1	121.5	169.9	-73.4	-175.3	-162.5	129.9	4	110.1
289	K	25.9	Very low	27.5	Very low	211 Å²	211	152.9 Å²	152.9	92%	0.917	83%	0.832	S	S	*	*			trans	-109	119.9	148.9	-105.9	172.8	168.9	176.2	0	104.8
290	G	25.7	Very low	26.6	Very low	75 Å²	75	151.1 Å²	151.1	77%	0.773	83%	0.826	S	S	*	*				97.5	85.8	58.7	0	0	0	0	0	106.3
291	D	26.9	Very low	27	Very low	161 Å²	161	152.7 Å²	152.7	86%	0.861	82%	0.823	S	S	*	*			trans	-64.8	134.3	174.4	-82.5	-48.2	0	0	0	110.4
292	D	27.2	Very low	26.4	Very low	160 Å²	160	154.6 Å²	154.6	86%	0.856	83%	0.825	S	S	*	*			trans	-162.4	102.6	149.1	-94.7	-26.1	0	0	0	109.3
293	D	26.1	Very low	26.2	Very low	155 Å²	155	152.4 Å²	152.4	83%	0.829	83%	0.827	S	S	*	*			trans	54.1	153.4	133.4	-125.6	-10.5	0	0	0	124.4
294	V	27.1	Very low	26	Very low	121 Å²	121	151.6 Å²	151.6	73%	0.733	82%	0.824	S	S	*	*			trans	103.2	93.9	160.8	-165.3	0	0	0	0	119.6
295	L	27.9	Very low	25.8	Very low	158 Å²	158	152.8 Å²	152.8	83%	0.827	83%	0.829	S	S	*	*			trans	7.5	126.8	134.9	-66.9	157.2	0	0	0	119.9
296	K	26.4	Very low	25.7	Very low	209 Å²	209	148.4 Å²	148.4	91%	0.909	83%	0.828	S	S	*	*				-172.1	136.2	123.1	-111	171.7	-179.2	175.7	0	115.2
297	N	24.5	Very low	25.9	Very low	172 Å²	172	147.5 Å²	147.5	92%	0.92	83%	0.831	S	S	*	*			trans	-56.9	152.7	169.6	-74.5	-23	0	0	0	114.4
298	G	23.8	Very low	26	Very low	82 Å²	82	146.7 Å²	146.7	85%	0.845	83%	0.831	S	S	*	*			trans	179.2	116.4	162.1	0	0	0	0	0	113.4
299	S	23.1	Very low	26	Very low	109 Å²	109	143.1 Å²	143.1	76%	0.762	83%	0.83	S	S	*	*			trans	-85.4	138.5	-169.3	47.1	0	0	0	0	116.4
300	S	21.4	Very low	25.9	Very low	112 Å²	112	136.7 Å²	136.7	78%	0.783	82%	0.824	S	S	*	*			trans	66.2	164.9	134.5	-60.6	0	0	0	0	121.1
301	P	35.3	Very low	25.9	Very low	107 Å²	107	136.6 Å²	136.6	70%	0.695	82%	0.823	S	S	*	*			cis	-141	172.4	-23.9	29.8	-7.2	0	0	0	116.7
302	L	24.5	Very low	25.8	Very low	167 Å²	167	140.1 Å²	140.1	87%	0.874	82%	0.824	S	S	*	*			trans	52.5	121	141	-74.9	151.6	0	0	0	121.4
303	G	24.4	Very low	25.7	Very low	77 Å²	77	139.9 Å²	139.9	79%	0.794	82%	0.822	S	S	*	*			trans	-157.5	100.2	154.1	0	0	0	0	0	110.3
304	D	22.6	Very low	25.7	Very low	140 Å²	140	138.2 Å²	138.2	75%	0.749	82%	0.819	S	S	*	*			trans	-55.8	141.3	168.5	-92.2	-37.1	0	0	0	111.6
305	H	26.2	Very low	25.6	Very low	192 Å²	192	139.9 Å²	139.9	89%	0.889	82%	0.823	S	S	*	*			trans	-166.6	129.9	131.9	-82.2	-51.6	0	0	0	110.5
306	T	25.3	Very low	25.6	Very low	138 Å²	138	137.6 Å²	137.6	85%	0.847	82%	0.821	S	S	*	*			trans	-78.4	173.1	-176.9	12.8	0	0	0	0	113.3
307	P	30.7	Very low	25.5	Very low	118 Å²	118	131.5 Å²	131.5	77%	0.766	81%	0.809	S	S	*	*			trans	-103.1	162.2	-133.2	40.7	-36.7	0	0	0	114.7
308	L	26.1	Very low	25.9	Very low	179 Å²	179	128.8 Å²	128.8	94%	0.937	80%	0.801	S	S	*	*			trans	-127	130.2	162.4	-89.9	158.3	0	0	0	110.7
309	D	24.2	Very low	26.1	Very low	163 Å²	163	132.4 Å²	132.4	87%	0.872	80%	0.801	S	S	*	*			trans	-65	150.5	-175.2	-173.8	19.6	0	0	0	113.5
310	G	24.8	Very low	26.3	Very low	75 Å²	75	133.7 Å²	133.7	77%	0.773	80%	0.804	S	S	*	*			trans	174.5	67.8	-177	0	0	0	0	0	115.3
311	G	26	Very low	26.9	Very low	73 Å²	73	132.2 Å²	132.2	75%	0.753	79%	0.793	S	S	*	*			trans	70.3	74.4	143.7	0	0	0	0	0	118.6
312	R	24	Very low	26.6	Very low	235 Å²	235	131.7 Å²	131.7	89%	0.887	79%	0.792	S	S	*	*			trans	-85.7	120.9	156.1	-108.7	-178.3	177	-154.4	-0.7	109.5
313	L	26.4	Very low	27.2	Very low	156 Å²	156	127.8 Å²	127.8	82%	0.817	78%	0.777	S	S	*	*			trans	-52.7	134.7	159	-71.5	160.2	0	0	0	108.5	L315	L313-L315 PolarHBondContact O-N 3.44Å
314	P	24.1	Very low	27.8	Very low	119 Å²	119	127.5 Å²	127.5	77%	0.773	76%	0.764	S	S	*	*			trans	-69.8	103.2	178.8	28.1	-31.1	0	0	0	108.5	S316	P314-S316 VanDerWaalsContact C-N 3.3Å; P314-S316 PolarHBondContact O-N 3.45Å
315	L	26.9	Very low	28.9	Very low	156 Å²	156	123.9 Å²	123.9	82%	0.817	76%	0.759	S	S	*	*			trans	-62.7	99.9	154.9	-82.5	152.4	0	0	0	106	L313 A317	L313-L315 PolarHBondContact O-N 3.44Å; L315-A317 PolarHBondContact O-N 2.85Å
316	S	26.2	Very low	30.3	Very low	111 Å²	111	122.1 Å²	122.1	78%	0.776	75%	0.752	S	S	*	*			trans	-48.2	127.4	162.2	1.5	0	0	0	0	107.6	P314	P314-S316 VanDerWaalsContact C-N 3.3Å; P314-S316 PolarHBondContact O-N 3.45Å
317	A	26	Very low	32.1	Very low	80 Å²	80	118 Å²	118	66%	0.661	72%	0.722	S	S	*	*			trans	-50.7	146.4	173.9	0	0	0	0	0	109.8	L315 D319	L315-A317 PolarHBondContact O-N 2.85Å; A317-D319 PolarHBondContact O-N 3.45Å
318	P	32.4	Very low	33.8	Very low	115 Å²	115	116 Å²	116	75%	0.747	70%	0.703	S	S	*	*			trans	-62.4	115.9	174.5	27	-30.5	0	0	0	107.1	T320	P318-T320 PolarHBondContact O-N 3.26Å
319	D	27.3	Very low	35.8	Very low	158 Å²	158	116.3 Å²	116.3	85%	0.845	70%	0.7	S	S	*	*			trans	-49.7	111.2	163.1	-78.6	-34.2	0	0	0	106.1	A317 C321	A317-D319 PolarHBondContact O-N 3.45Å; D319-C321 VanDerWaalsContact C-N 3.32Å; D319-C321 PolarHBondContact O-N 2.92Å
320	T	27.3	Very low	38.4	Very low	137 Å²	137	109.9 Å²	109.9	84%	0.84	67%	0.666	S	S	*	*			trans	-63.4	103.5	176.4	-38.3	0	0	0	0	104.1	P318 S322	P318-T320 PolarHBondContact O-N 3.26Å; T320-S322 PolarHBondContact O-N 3.42Å
321	C	34.4	Very low	40.8	Very low	81 Å²	81	109.9 Å²	109.9	55%	0.547	65%	0.648	S	S	.	*			trans	-65.6	90.1	-179.8	-170.7	0	0	0	0	107	D319 C323	D319-C321 VanDerWaalsContact C-N 3.32Å; D319-C321 PolarHBondContact O-N 2.92Å; C321-C323 PolarHBondContact O-N 3.41Å
322	S	29.3	Very low	43.1	Very low	95 Å²	95	108.5 Å²	108.5	66%	0.664	63%	0.626	S	S	*	*			trans	-63	92.9	167.5	170.1	0	0	0	0	106.2	T320 S324	T320-S322 PolarHBondContact O-N 3.42Å; S322-S324 PolarHBondContact O-N 3.12Å
323	C	36.9	Very low	45.8	Very low	85 Å²	85	105 Å²	105	57%	0.574	62%	0.62	S	S	*	*			trans	-69.1	68.2	164.2	-70.7	0	0	0	0	108.2	C321 G325	C321-C323 PolarHBondContact O-N 3.41Å; C323-G325 PolarHBondContact O-N 3.4Å
324	S	35.9	Very low	48.7	Very low	72 Å²	72	99.8 Å²	99.8	50%	0.503	59%	0.593	S	S	.	*			trans	-64.3	112.4	157.3	44	0	0	0	0	105.5	S322 E326	S322-S324 PolarHBondContact O-N 3.12Å; S324-E326 PolarHBondContact O-N 2.96Å
325	G	46.9	Very low	51.8	Low	64 Å²	64	94.5 Å²	94.5	66%	0.66	56%	0.558	S	S	*	*			trans	-67.1	37.6	179.1	0	0	0	0	0	113.8	C323	C323-G325 PolarHBondContact O-N 3.4Å
326	E	54.9	Low	54.9	Low	155 Å²	155	90.8 Å²	90.8	72%	0.724	54%	0.542	S	S	*	.			trans	-82.1	125.4	171.1	-68	-171	157.2	0	0	108.3	S324 E328	S324-E326 PolarHBondContact O-N 2.96Å; E326-E328 PolarHBondContact O-N 3.33Å; E326-E328 VanDerWaalsContact O-N 3.16Å
327	Q	64	Low	57.9	Low	50 Å²	50	91.2 Å²	91.2	23%	0.234	53%	0.531	C	S	.	.			trans	-65.2	110.9	173.5	-168.1	-178.5	-4.3	0	0	108.1	E329 Y693 Y703	Q327-E329 PolarHBondContact O-N 3.32Å; Q327-Y693 HydrophobicContact CB-CE1 4.46Å; Q327-Y693 HydrophobicContact CG-CD1 3.57Å; Q327-Y693 HydrophobicContact CG-CE1 3.31Å; Q327-Y703 PolarHBondContact NE2-OH 3.25Å
328	E	66.6	Low	60.7	Low	76 Å²	76	88.1 Å²	88.1	36%	0.355	50%	0.504	S	S	.	.			trans	-67.7	122.2	175.3	-165	-172.9	135.5	0	0	108.6	E326 V330 R635	E326-E328 PolarHBondContact O-N 3.33Å; E326-E328 VanDerWaalsContact O-N 3.16Å; E328-V330 PolarHBondContact O-N 3.22Å; E328-R635 IonicContact OE1-CZ 2.69Å; E328-R635 IonicContact OE1-NH1 3.1Å; E328-R635 PolarHBondContact OE1-NH1 3.24Å; E328-R635 VanDerWaalsContact OE1-NH1 3.1Å; E328-R635 IonicContact OE1-NH2 3.27Å; E328-R635 PolarHBondContact OE1-NH2 3.18Å
329	E	68.1	Low	62.5	Low	187 Å²	187	87.7 Å²	87.7	87%	0.874	50%	0.503	S	S	*	.			trans	-81.1	107.5	175.9	-160.2	168.4	-155.2	0	0	108	Q327 D331	Q327-E329 PolarHBondContact O-N 3.32Å; E329-D331 PolarHBondContact O-N 3.34Å
330	V	77.3	Confident	64.2	Low	28 Å²	28	82.5 Å²	82.5	17%	0.17	47%	0.473	C	S	.	.			trans	-76.6	114.6	-179.2	177.4	0	0	0	0	108.6	E328 P332 H445 R635	E328-V330 PolarHBondContact O-N 3.22Å; V330-P332 VanDerWaalsContact O-CD 3.32Å; V330-P332 WeakPolarHBondContact O-CD 3.26Å; V330-H445 HydrophobicContact CG2-CB 4.39Å; V330-R635 HydrophobicContact CG1-CG 4.23Å
331	D	76.9	Confident	65.7	Low	74 Å²	74	81.4 Å²	81.4	40%	0.396	46%	0.46	S	S	.	.			trans	-66.6	118.8	173.5	-169.3	-22.3	0	0	0	110.2	E329 E333 D334	E329-D331 PolarHBondContact O-N 3.34Å; D331-E333 PolarHBondContact O-N 3.28Å; D331-E333 WeakPolarHBondContact OD1-CB 3.32Å; D331-E333 PolarHBondContact OD1-N 3.11Å; D331-D334 WeakPolarHBondContact O-CB 3.28Å; D331-D334 PolarHBondContact O-N 2.97Å
332	P	73.8	Confident	67	Low	44 Å²	44	80 Å²	80	29%	0.286	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-14.2	179.5	-12.4	26.5	0	0	0	115.3	V330 D334 R633	V330-P332 VanDerWaalsContact O-CD 3.32Å; V330-P332 WeakPolarHBondContact O-CD 3.26Å; P332-D334 VanDerWaalsContact C-N 3.29Å; P332-R633 PolarHBondContact O-NH1 2.88Å; P332-R633 PolarHBondContact O-NH2 3.44Å
333	E	79.6	Confident	68.2	Low	161 Å²	161	81.4 Å²	81.4	75%	0.752	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-26.5	172.8	-62	-161.9	162.1	0	0	111.8	D331 E335	D331-E333 PolarHBondContact O-N 3.28Å; D331-E333 WeakPolarHBondContact OD1-CB 3.32Å; D331-E333 PolarHBondContact OD1-N 3.11Å; E333-E335 VanDerWaalsContact C-N 3.27Å; E333-E335 PolarHBondContact O-N 3.11Å
334	D	87.1	Confident	69.1	Low	48 Å²	48	80.7 Å²	80.7	26%	0.257	44%	0.44	S	S	.	.	S	Bend	trans	-74.2	-17.9	177.9	-80.1	-24.6	0	0	0	113.6	D331 P332 R635 P636 K639	D331-D334 WeakPolarHBondContact O-CB 3.28Å; D331-D334 PolarHBondContact O-N 2.97Å; P332-D334 VanDerWaalsContact C-N 3.29Å; D334-R635 HydrophobicContact CB-CG 4.17Å; D334-P636 WeakPolarHBondContact O-CD 3.47Å; D334-K639 HydrophobicContact CB-CD 4.1Å; D334-K639 IonicContact OD1-NZ 3.1Å; D334-K639 PolarHBondContact OD1-NZ 2.9Å
335	E	90.3	Very high	69.9	Low	8 Å²	8	86 Å²	86	4%	0.037	46%	0.457	C	S	.	.			trans	-76.7	136.9	180	-63.8	-179.9	143.4	0	0	111.1	E333 C446 S447 R633 R635	E333-E335 VanDerWaalsContact C-N 3.27Å; E333-E335 PolarHBondContact O-N 3.11Å; E335-C446 WeakPolarHBondContact OE1-CA 3.37Å; E335-S447 WeakPolarHBondContact OE2-CB 3.21Å; E335-S447 PolarHBondContact OE2-OG 2.89Å; E335-R633 HydrophobicContact CB-CB 3.85Å; E335-R633 PolarHBondContact O-NH2 3.35Å; E335-R633 IonicContact OE2-NH1 2.84Å; E335-R635 HydrophobicContact CG-CG 3.74Å
336	V	91.6	Very high	70.4	Confident	78 Å²	78	84.6 Å²	84.6	47%	0.473	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	149.6	175.5	-64.9	0	0	0	0	109.3	D338 R633 V634 P636	V336-D338 PolarHBondContact O-N 3.34Å; V336-R633 CarbonylContact O-C 3.59Å; V336-R633 WeakPolarHBondContact O-CA 3.35Å; V336-V634 WeakPolarHBondContact CG2-O 3.42Å; V336-V634 PolarHBondContact N-O 3.5Å; V336-V634 PolarHBondContact O-N 3.04Å; V336-P636 HydrophobicContact CG1-CG 4.41Å; V336-P636 HydrophobicContact CG2-CG 4.1Å
337	E	89.6	Confident	70.3	Confident	120 Å²	120	82.9 Å²	82.9	56%	0.561	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.3	131.3	174.1	-167.7	-177.4	160.3	0	0	109.7	S339 R631	E337-S339 PolarHBondContact O-N 3.46Å; E337-R631 HydrophobicContact CG-CB 3.9Å; E337-R631 WeakPolarHBondContact OE1-CD 3.28Å
338	D	84.1	Confident	69.8	Low	15 Å²	15	82.5 Å²	82.5	8%	0.08	44%	0.439	C	S	.	.			trans	-67.7	108.1	-172.2	-169.3	22.5	0	0	0	110.8	V336 F340 K632 R646	V336-D338 PolarHBondContact O-N 3.34Å; D338-F340 WeakPolarHBondContact OD1-CB 3.28Å; D338-F340 PolarHBondContact OD1-N 3Å; D338-K632 HydrophobicContact CB-CG 4.03Å; D338-K632 WeakPolarHBondContact CB-O 3.26Å; D338-K632 PolarHBondContact N-O 2.89Å; D338-K632 VanDerWaalsContact OD2-CE 3.32Å; D338-K632 WeakPolarHBondContact OD2-CE 3.46Å; D338-R646 IonicContact OD1-CZ 3.14Å; D338-R646 IonicContact OD1-NH1 3.65Å; D338-R646 PolarHBondContact OD1-NH1 3.44Å; D338-R646 IonicContact OD1-NH2 2.65Å; D338-R646 PolarHBondContact OD1-NH2 3.47Å; D338-R646 VanDerWaalsContact OD1-NH2 3.1Å; D338-R646 IonicContact OD2-CZ 3.7Å; D338-R646 IonicContact OD2-NH1 2.68Å; D338-R646 IonicContact OD2-NH2 3.29Å; D338-R646 PolarHBondContact OD2-NH2 3.48Å
339	S	70.3	Confident	69.4	Low	105 Å²	105	79.9 Å²	79.9	73%	0.734	43%	0.431	S	S	*	.			trans	-83.9	-1.2	174	60.6	0	0	0	0	112.5	E337 M341	E337-S339 PolarHBondContact O-N 3.46Å; S339-M341 PolarHBondContact O-N 2.97Å
340	F	64.5	Low	69.1	Low	49 Å²	49	72 Å²	72	22%	0.215	40%	0.395	C	S	.	.			trans	-67.6	95	178.3	-166.2	-80.3	0	0	0	110.4	D338 D342 K382 T653	D338-F340 WeakPolarHBondContact OD1-CB 3.28Å; D338-F340 PolarHBondContact OD1-N 3Å; F340-D342 HydrophobicContact CD1-CB 4.46Å; F340-D342 HydrophobicContact CE1-CB 3.84Å; F340-K382 HydrophobicContact CZ-CB 4.3Å; F340-T653 HydrophobicContact CE2-CG2 4.4Å; F340-T653 HydrophobicContact CZ-CG2 4.44Å
341	M	57.8	Low	68.5	Low	115 Å²	115	77.9 Å²	77.9	57%	0.567	42%	0.421	S	S	*	.			trans	-108.8	100.7	168.6	-65.9	-84.2	109.8	0	0	107.3	S339 T343	S339-M341 PolarHBondContact O-N 2.97Å; M341-T343 PolarHBondContact O-N 3.24Å
342	D	60.9	Low	68.2	Low	51 Å²	51	81.9 Å²	81.9	27%	0.273	44%	0.437	S	S	.	.			trans	-83.7	89.9	169.5	-160	23	0	0	0	107.9	F340 E344 K382	F340-D342 HydrophobicContact CD1-CB 4.46Å; F340-D342 HydrophobicContact CE1-CB 3.84Å; D342-E344 PolarHBondContact O-N 2.94Å; D342-K382 IonicContact OD1-NZ 3.19Å; D342-K382 PolarHBondContact OD1-NZ 3.32Å; D342-K382 VanDerWaalsContact OD2-CD 3.27Å; D342-K382 WeakPolarHBondContact OD2-CD 3.44Å; D342-K382 WeakPolarHBondContact OD2-CG 3.25Å; D342-K382 IonicContact OD2-NZ 2.74Å; D342-K382 PolarHBondContact OD2-NZ 3.04Å
343	T	54.5	Low	68.1	Low	125 Å²	125	82.8 Å²	82.8	77%	0.767	44%	0.437	S	S	*	.			trans	-69.5	97.2	171.1	42.1	0	0	0	0	108.3	M341 E345	M341-T343 PolarHBondContact O-N 3.24Å; T343-E345 PolarHBondContact O-N 2.99Å
344	E	57.3	Low	67.9	Low	70 Å²	70	81.3 Å²	81.3	33%	0.327	43%	0.425	S	S	.	.			trans	-79	98.4	-176.7	-63.9	-143.9	133.3	0	0	112.4	D342 K433	D342-E344 PolarHBondContact O-N 2.94Å; E344-K433 VanDerWaalsContact CD-NZ 3.35Å; E344-K433 WeakPolarHBondContact OE1-CD 3.42Å; E344-K433 WeakPolarHBondContact OE1-CE 3.01Å; E344-K433 IonicContact OE1-NZ 3.32Å; E344-K433 PolarHBondContact OE1-NZ 3.12Å; E344-K433 VanDerWaalsContact OE2-CE 3.31Å; E344-K433 WeakPolarHBondContact OE2-CE 3.29Å; E344-K433 IonicContact OE2-NZ 3.12Å; E344-K433 PolarHBondContact OE2-NZ 3.23Å
345	E	52.9	Low	67.4	Low	182 Å²	182	83 Å²	83	85%	0.85	44%	0.441	S	S	*	.			trans	-100.5	82.8	161.7	-69.8	-175.6	174.6	0	0	109.2	T343	T343-E345 PolarHBondContact O-N 2.99Å
346	D	56.5	Low	66.9	Low	35 Å²	35	85.3 Å²	85.3	19%	0.187	46%	0.455	C	S	.	.			trans	-133.8	34.7	-167.6	-148.5	15.2	0	0	0	115.1	G348 A349 I431 K433	D346-G348 VanDerWaalsContact C-N 3.34Å; D346-A349 WeakPolarHBondContact OD1-CB 3.47Å; D346-I431 WeakPolarHBondContact O-CD1 3.36Å; D346-K433 WeakPolarHBondContact OD2-CE 3.34Å; D346-K433 IonicContact OD2-NZ 3.79Å; D346-K433 PolarHBondContact OD2-NZ 2.97Å
347	L	52.3	Low	66.4	Low	119 Å²	119	82.8 Å²	82.8	62%	0.623	44%	0.439	S	S	*	.	S	Bend	trans	-73.1	-26.6	169.5	-74.3	166.9	0	0	0	112.4	I431 V549	L347-I431 HydrophobicContact CD2-CD1 3.72Å; L347-I431 HydrophobicContact CD2-CG1 4.18Å; L347-I431 HydrophobicContact CG-CD1 4.04Å; L347-V549 HydrophobicContact CD2-CG1 3.98Å; L347-V549 HydrophobicContact CD2-CG2 4.1Å
348	G	53.8	Low	65.9	Low	42 Å²	42	80.4 Å²	80.4	43%	0.433	43%	0.43	S	S	.	.	H	α-helix	trans	-70.1	-39.5	-174.9	0	0	0	0	0	114.7	D346 V350 E351 E352	D346-G348 VanDerWaalsContact C-N 3.34Å; G348-V350 VanDerWaalsContact C-N 3.33Å; G348-V350 PolarHBondContact O-N 3.19Å; G348-E351 PolarHBondContact O-N 3.07Å; G348-E352 PolarHBondContact O-N 2.81Å
349	A	59.4	Low	65.8	Low	22 Å²	22	85.2 Å²	85.2	18%	0.182	45%	0.451	C	S	.	.	H	α-helix	trans	-66.9	-31.2	-174	0	0	0	0	0	113.5	D346 E353	D346-A349 WeakPolarHBondContact OD1-CB 3.47Å; A349-E353 WeakPolarHBondContact O-CB 3.37Å; A349-E353 WeakPolarHBondContact O-CG 3.44Å; A349-E353 PolarHBondContact O-N 3.08Å
350	V	61.6	Low	66.3	Low	22 Å²	22	81.4 Å²	81.4	13%	0.133	42%	0.423	C	S	.	.	H	α-helix	trans	-71.4	-33.4	-178.1	-178.2	0	0	0	0	111.8	G348 R354 I357 T548	G348-V350 VanDerWaalsContact C-N 3.33Å; G348-V350 PolarHBondContact O-N 3.19Å; V350-R354 PolarHBondContact O-N 2.59Å; V350-I357 HydrophobicContact CG1-CD1 4.03Å; V350-T548 WeakPolarHBondContact CG1-O 3.44Å
351	E	64.1	Low	67.1	Low	150 Å²	150	79.4 Å²	79.4	70%	0.701	41%	0.414	S	S	*	.	H	α-helix	trans	-77.9	-38.6	-178.5	-163.6	162.1	-151.4	0	0	111.7	G348 E353 R354	G348-E351 PolarHBondContact O-N 3.07Å; E351-E353 VanDerWaalsContact C-N 3.34Å; E351-R354 WeakPolarHBondContact O-CB 3.37Å; E351-R354 PolarHBondContact O-N 3.18Å
352	E	69.8	Low	68	Low	159 Å²	159	75.7 Å²	75.7	74%	0.743	40%	0.399	S	S	*	.	H	α-helix	trans	-62.9	-39.5	174.2	-68.4	175.5	-179.4	0	0	111.6	G348 R354	G348-E352 PolarHBondContact O-N 2.81Å; E352-R354 PolarHBondContact O-N 2.66Å
353	E	73.1	Confident	69	Low	62 Å²	62	78.7 Å²	78.7	29%	0.29	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	14.3	-176.1	-64.7	-63.3	165.5	0	0	114.6	A349 E351 S355 V356 I357 F378	A349-E353 WeakPolarHBondContact O-CB 3.37Å; A349-E353 WeakPolarHBondContact O-CG 3.44Å; A349-E353 PolarHBondContact O-N 3.08Å; E351-E353 VanDerWaalsContact C-N 3.34Å; E353-S355 PolarHBondContact O-N 3.22Å; E353-S355 VanDerWaalsContact O-N 3.09Å; E353-V356 WeakPolarHBondContact O-CB 3.27Å; E353-V356 PolarHBondContact O-N 2.83Å; E353-V356 VanDerWaalsContact OE2-CG2 3.23Å; E353-V356 WeakPolarHBondContact OE2-CG2 3.44Å; E353-I357 PolarHBondContact O-N 3.32Å; E353-F378 HydrophobicContact CB-CD1 3.94Å; E353-F378 HydrophobicContact CB-CD2 4.34Å; E353-F378 HydrophobicContact CB-CE1 3.48Å; E353-F378 VanDerWaalsContact CB-CE1 3.48Å; E353-F378 HydrophobicContact CB-CE2 3.93Å; E353-F378 HydrophobicContact CB-CG 4.36Å; E353-F378 HydrophobicContact CB-CZ 3.49Å; E353-F378 VanDerWaalsContact CB-CZ 3.49Å; E353-F378 HydrophobicContact CG-CD1 3.83Å; E353-F378 HydrophobicContact CG-CE1 3.9Å; E353-F378 HydrophobicContact CG-CG 4.16Å; E353-F378 HydrophobicContact CG-CZ 4.3Å
354	R	73.7	Confident	70.3	Confident	130 Å²	130	72.9 Å²	72.9	49%	0.491	38%	0.376	S	S	.	.	H	α-helix	trans	-55.7	-33.1	-178.2	-173.5	176	-175.6	148.7	3	113.1	V350 E351 E352 I357 L358	V350-R354 PolarHBondContact O-N 2.59Å; E351-R354 WeakPolarHBondContact O-CB 3.37Å; E351-R354 PolarHBondContact O-N 3.18Å; E352-R354 PolarHBondContact O-N 2.66Å; R354-I357 PolarHBondContact O-N 3.42Å; R354-L358 HydrophobicContact CG-CD1 4.14Å; R354-L358 HydrophobicContact CG-CG 4.44Å; R354-L358 WeakPolarHBondContact O-CB 3.42Å; R354-L358 VanDerWaalsContact O-CG 3.32Å; R354-L358 WeakPolarHBondContact O-CG 3.33Å; R354-L358 PolarHBondContact O-N 3.41Å
355	S	77.5	Confident	71.5	Confident	85 Å²	85	76.4 Å²	76.4	59%	0.594	39%	0.39	S	S	*	.	H	α-helix	trans	-64.9	-40.1	178.5	70.9	0	0	0	0	112.4	E353 L358 H359	E353-S355 PolarHBondContact O-N 3.22Å; E353-S355 VanDerWaalsContact O-N 3.09Å; S355-L358 PolarHBondContact O-N 3.5Å; S355-H359 WeakPolarHBondContact O-CB 3.31Å; S355-H359 PolarHBondContact O-N 3.13Å
356	V	80.6	Confident	72.7	Confident	56 Å²	56	69.2 Å²	69.2	34%	0.339	36%	0.358	S	S	.	.	H	α-helix	trans	-67.3	-43.2	177	178.5	0	0	0	0	110.4	E353 H359 L360 P376 F378	E353-V356 WeakPolarHBondContact O-CB 3.27Å; E353-V356 PolarHBondContact O-N 2.83Å; E353-V356 VanDerWaalsContact OE2-CG2 3.23Å; E353-V356 WeakPolarHBondContact OE2-CG2 3.44Å; V356-H359 PolarHBondContact O-N 2.86Å; V356-L360 WeakPolarHBondContact O-CB 3.14Å; V356-L360 PolarHBondContact O-N 3Å; V356-P376 HydrophobicContact CG1-CB 4.31Å; V356-P376 HydrophobicContact CG1-CG 3.79Å; V356-F378 HydrophobicContact CG1-CE1 4.39Å
357	I	79.4	Confident	73.7	Confident	25 Å²	25	68.3 Å²	68.3	13%	0.128	36%	0.356	C	S	.	.	H	α-helix	trans	-60.2	-49.1	175.2	-59.3	178.3	0	0	0	110.2	V350 E353 R354 H359 L360 L361 F378 I546	V350-I357 HydrophobicContact CG1-CD1 4.03Å; E353-I357 PolarHBondContact O-N 3.32Å; R354-I357 PolarHBondContact O-N 3.42Å; I357-H359 VanDerWaalsContact C-N 3.32Å; I357-H359 PolarHBondContact O-N 3Å; I357-L360 PolarHBondContact O-N 3.19Å; I357-L361 HydrophobicContact CG2-CD1 3.66Å; I357-L361 HydrophobicContact CG2-CG 4.13Å; I357-L361 WeakPolarHBondContact O-CB 3.47Å; I357-L361 WeakPolarHBondContact O-CG 3.36Å; I357-L361 PolarHBondContact O-N 3.01Å; I357-F378 HydrophobicContact CD1-CE2 4.07Å; I357-F378 HydrophobicContact CD1-CZ 3.88Å; I357-F378 HydrophobicContact CG1-CE2 4.36Å; I357-F378 HydrophobicContact CG1-CZ 3.66Å; I357-I546 WeakPolarHBondContact CG2-O 3.38Å
358	L	79.7	Confident	75.2	Confident	70 Å²	70	65.4 Å²	65.4	37%	0.366	34%	0.34	S	S	.	.	H	α-helix	trans	-62.1	-39.4	178.9	-74.6	171.8	0	0	0	112.2	R354 S355 L361 S362 L547	R354-L358 HydrophobicContact CG-CD1 4.14Å; R354-L358 HydrophobicContact CG-CG 4.44Å; R354-L358 WeakPolarHBondContact O-CB 3.42Å; R354-L358 VanDerWaalsContact O-CG 3.32Å; R354-L358 WeakPolarHBondContact O-CG 3.33Å; R354-L358 PolarHBondContact O-N 3.41Å; S355-L358 PolarHBondContact O-N 3.5Å; L358-L361 PolarHBondContact O-N 3Å; L358-S362 WeakPolarHBondContact O-CB 3.34Å; L358-S362 PolarHBondContact O-N 3.45Å; L358-L547 HydrophobicContact CD2-CD2 3.75Å
359	H	82.1	Confident	76.6	Confident	116 Å²	116	66.6 Å²	66.6	54%	0.537	34%	0.337	S	S	.	.	H	α-helix	trans	-61.4	-49.5	175	-177.3	76.7	0	0	0	111.3	S355 V356 I357 L361 S362 Q363	S355-H359 WeakPolarHBondContact O-CB 3.31Å; S355-H359 PolarHBondContact O-N 3.13Å; V356-H359 PolarHBondContact O-N 2.86Å; I357-H359 VanDerWaalsContact C-N 3.32Å; I357-H359 PolarHBondContact O-N 3Å; H359-L361 PolarHBondContact O-N 3.2Å; H359-S362 WeakPolarHBondContact O-CB 3.23Å; H359-S362 PolarHBondContact O-N 3.49Å; H359-S362 PolarHBondContact O-OG 3.45Å; H359-Q363 PolarHBondContact NE2-NE2 2.91Å
360	L	81.5	Confident	77.7	Confident	25 Å²	25	66.1 Å²	66.1	13%	0.131	33%	0.331	C	S	.	.	H	α-helix	trans	-56.7	-51.4	176.1	-177	73.9	0	0	0	111	V356 I357 S362 Q363 L364 V373 L375	V356-L360 WeakPolarHBondContact O-CB 3.14Å; V356-L360 PolarHBondContact O-N 3Å; I357-L360 PolarHBondContact O-N 3.19Å; L360-S362 PolarHBondContact O-N 3.04Å; L360-Q363 WeakPolarHBondContact O-CB 3.37Å; L360-Q363 PolarHBondContact O-N 3.39Å; L360-L364 WeakPolarHBondContact O-CG 3.39Å; L360-L364 PolarHBondContact O-N 2.75Å; L360-V373 HydrophobicContact CD1-CG1 3.69Å; L360-L375 HydrophobicContact CD2-CD2 3.82Å
361	L	79.9	Confident	78.4	Confident	6 Å²	6	69 Å²	69	3%	0.031	35%	0.348	C	S	.	.	H	α-helix	trans	-63.2	-27.3	-178.8	-68.2	178.2	0	0	0	113.3	L55 I357 L358 H359 Q363 L364 F510 I546 L547	L55-L361 HydrophobicContact CD1-CB 4.14Å; L55-L361 HydrophobicContact CD1-CD1 3.86Å; L55-L361 HydrophobicContact CD1-CD2 4.06Å; L55-L361 HydrophobicContact CD1-CG 4.25Å; I357-L361 HydrophobicContact CG2-CD1 3.66Å; I357-L361 HydrophobicContact CG2-CG 4.13Å; I357-L361 WeakPolarHBondContact O-CB 3.47Å; I357-L361 WeakPolarHBondContact O-CG 3.36Å; I357-L361 PolarHBondContact O-N 3.01Å; L358-L361 PolarHBondContact O-N 3Å; H359-L361 PolarHBondContact O-N 3.2Å; L361-Q363 PolarHBondContact O-N 3.39Å; L361-L364 HydrophobicContact CD2-CD1 3.76Å; L361-L364 PolarHBondContact O-N 3.25Å; L361-F510 HydrophobicContact CD2-CE2 3.65Å; L361-F510 HydrophobicContact CD2-CZ 4.13Å; L361-I546 HydrophobicContact CD1-CG1 4.39Å; L361-I546 HydrophobicContact CD2-CD1 3.72Å; L361-I546 HydrophobicContact CD2-CG1 4.37Å; L361-L547 HydrophobicContact CD1-CD2 3.23Å; L361-L547 HydrophobicContact CD1-CG 3.91Å
362	S	77.9	Confident	78.8	Confident	37 Å²	37	73 Å²	73	26%	0.259	36%	0.357	S	S	.	.	H	α-helix	trans	-64.4	-28.8	173.9	83.9	0	0	0	0	112.7	N54 L358 H359 L360	N54-S362 PolarHBondContact ND2-O 2.99Å; L358-S362 WeakPolarHBondContact O-CB 3.34Å; L358-S362 PolarHBondContact O-N 3.45Å; H359-S362 WeakPolarHBondContact O-CB 3.23Å; H359-S362 PolarHBondContact O-N 3.49Å; H359-S362 PolarHBondContact O-OG 3.45Å; L360-S362 PolarHBondContact O-N 3.04Å
363	Q	81.2	Confident	79.3	Confident	115 Å²	115	67 Å²	67	54%	0.537	33%	0.331	S	S	.	.	H	α-helix	trans	-84.6	-21.3	179.8	-57.4	-179.5	-1	0	0	112.1	H359 L360 L361	H359-Q363 PolarHBondContact NE2-NE2 2.91Å; L360-Q363 WeakPolarHBondContact O-CB 3.37Å; L360-Q363 PolarHBondContact O-N 3.39Å; L361-Q363 PolarHBondContact O-N 3.39Å
364	L	82.5	Confident	79.6	Confident	3 Å²	3	69.2 Å²	69.2	2%	0.016	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-81.6	135.5	-176.9	-44.3	-176.1	0	0	0	111.7	N54 L360 L361 M368 L370 V373 F510	N54-L364 WeakPolarHBondContact CB-O 3.44Å; L360-L364 WeakPolarHBondContact O-CG 3.39Å; L360-L364 PolarHBondContact O-N 2.75Å; L361-L364 HydrophobicContact CD2-CD1 3.76Å; L361-L364 PolarHBondContact O-N 3.25Å; L364-M368 HydrophobicContact CB-CE 3.84Å; L364-M368 HydrophobicContact CD2-CE 3.17Å; L364-M368 HydrophobicContact CG-CE 4.03Å; L364-L370 HydrophobicContact CD1-CD2 4Å; L364-L370 HydrophobicContact CD2-CD2 4.07Å; L364-V373 HydrophobicContact CD2-CG1 3.97Å; L364-V373 HydrophobicContact CD2-CG2 4.04Å; L364-F510 HydrophobicContact CB-CD1 3.85Å; L364-F510 HydrophobicContact CB-CD2 4.25Å; L364-F510 HydrophobicContact CB-CE1 3.88Å; L364-F510 HydrophobicContact CB-CE2 4.28Å; L364-F510 HydrophobicContact CB-CG 4.02Å; L364-F510 HydrophobicContact CB-CZ 4.09Å; L364-F510 HydrophobicContact CD1-CD2 3.58Å; L364-F510 HydrophobicContact CD1-CE2 3.71Å; L364-F510 HydrophobicContact CD1-CG 4.08Å; L364-F510 HydrophobicContact CD1-CZ 4.3Å
365	K	81.5	Confident	80	Confident	144 Å²	144	64.8 Å²	64.8	63%	0.626	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-103.3	147.2	170.8	-65	177.6	-174.3	170.6	0	110.1	G367 M368 F510	K365-G367 PolarHBondContact O-N 3.18Å; K365-M368 WeakPolarHBondContact O-CB 3.27Å; K365-M368 PolarHBondContact O-N 3.38Å; K365-F510 VanDerWaalsContact O-CD1 3.29Å; K365-F510 WeakPolarHBondContact O-CD1 3.5Å
366	L	77.9	Confident	80.3	Confident	31 Å²	31	61.8 Å²	61.8	16%	0.162	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	129	175.3	-172.1	69.6	0	0	0	110.4	Q116 K118 M368 G512	Q116-L366 HydrophobicContact CG-CD2 4.45Å; K118-L366 HydrophobicContact CB-CD2 3.83Å; K118-L366 HydrophobicContact CD-CD2 4.16Å; L366-M368 VanDerWaalsContact C-N 3.33Å; L366-G512 VanDerWaalsContact CD1-N 3.33Å
367	G	78	Confident	80.6	Confident	15 Å²	15	59.6 Å²	59.6	16%	0.155	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	-1	-179.2	0	0	0	0	0	116	K365 F510	K365-G367 PolarHBondContact O-N 3.18Å; G367-F510 WeakPolarHBondContact CA-O 3.1Å; G367-F510 PolarHBondContact N-O 3.06Å
368	M	83.8	Confident	80.8	Confident	59 Å²	59	59 Å²	59	29%	0.291	30%	0.296	S	S	.	.			trans	-64.1	139.9	178.8	-167.6	172.3	79	0	0	112.1	L364 K365 L366 L370 V373 F510	L364-M368 HydrophobicContact CB-CE 3.84Å; L364-M368 HydrophobicContact CD2-CE 3.17Å; L364-M368 HydrophobicContact CG-CE 4.03Å; K365-M368 WeakPolarHBondContact O-CB 3.27Å; K365-M368 PolarHBondContact O-N 3.38Å; L366-M368 VanDerWaalsContact C-N 3.33Å; M368-L370 HydrophobicContact CE-CD2 4.21Å; M368-V373 HydrophobicContact CE-CG2 3.78Å; M368-F510 PolarHBondContact O-N 2.85Å
369	D	84.3	Confident	81	Confident	67 Å²	67	57.7 Å²	57.7	36%	0.358	29%	0.289	S	S	.	.	B	Isolated β-bridge	trans	-72.3	129.5	172.8	-167.3	-38.6	0	0	0	109.9	T371 S508	D369-T371 VanDerWaalsContact OD1-CB 3.29Å; D369-T371 WeakPolarHBondContact OD1-CB 3.46Å; D369-T371 WeakPolarHBondContact OD1-CG2 3.45Å; D369-T371 PolarHBondContact OD1-N 3.13Å; D369-T371 PolarHBondContact OD1-OG1 3.39Å; D369-S508 WeakPolarHBondContact CA-O 3.17Å
370	L	82.7	Confident	81.3	Confident	12 Å²	12	52.4 Å²	52.4	6%	0.063	27%	0.265	C	S	.	.			trans	-95.8	-1	-176.4	-62	-179.8	0	0	0	114.3	L364 M368 R372 V373 S508 F510 I515	L364-L370 HydrophobicContact CD1-CD2 4Å; L364-L370 HydrophobicContact CD2-CD2 4.07Å; M368-L370 HydrophobicContact CE-CD2 4.21Å; L370-R372 PolarHBondContact O-N 3.35Å; L370-V373 HydrophobicContact CD2-CB 4.19Å; L370-V373 HydrophobicContact CD2-CG2 3.8Å; L370-V373 PolarHBondContact O-N 2.8Å; L370-S508 PolarHBondContact N-O 3.42Å; L370-F510 HydrophobicContact CD1-CB 4.26Å; L370-F510 HydrophobicContact CD2-CB 4.09Å; L370-F510 HydrophobicContact CG-CB 4.26Å; L370-I515 HydrophobicContact CD1-CB 4.18Å; L370-I515 HydrophobicContact CD1-CD1 3.73Å; L370-I515 HydrophobicContact CD1-CG1 3.7Å; L370-I515 HydrophobicContact CD1-CG2 3.48Å; L370-I515 VanDerWaalsContact CD1-CG2 3.48Å
371	T	75.9	Confident	81.6	Confident	81 Å²	81	52.7 Å²	52.7	50%	0.497	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-28.4	179	51.8	0	0	0	0	113.2	D369	D369-T371 VanDerWaalsContact OD1-CB 3.29Å; D369-T371 WeakPolarHBondContact OD1-CB 3.46Å; D369-T371 WeakPolarHBondContact OD1-CG2 3.45Å; D369-T371 PolarHBondContact OD1-N 3.13Å; D369-T371 PolarHBondContact OD1-OG1 3.39Å
372	R	71.8	Confident	82.1	Confident	236 Å²	236	53.7 Å²	53.7	89%	0.891	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	1.4	178.8	-69.3	-177.4	150.1	-169.4	-6.8	114.3	L370	L370-R372 PolarHBondContact O-N 3.35Å
373	V	80.4	Confident	82.8	Confident	32 Å²	32	53.6 Å²	53.6	19%	0.194	26%	0.264	C	S	.	.	S	Bend	trans	-94	122.4	-179.7	178.3	0	0	0	0	108.6	L360 L364 M368 L370 L375	L360-V373 HydrophobicContact CD1-CG1 3.69Å; L364-V373 HydrophobicContact CD2-CG1 3.97Å; L364-V373 HydrophobicContact CD2-CG2 4.04Å; M368-V373 HydrophobicContact CE-CG2 3.78Å; L370-V373 HydrophobicContact CD2-CB 4.19Å; L370-V373 HydrophobicContact CD2-CG2 3.8Å; L370-V373 PolarHBondContact O-N 2.8Å; V373-L375 HydrophobicContact CG1-CD2 4.2Å; V373-L375 PolarHBondContact O-N 3.43Å
374	V	79.5	Confident	83.4	Confident	109 Å²	109	48.2 Å²	48.2	66%	0.661	24%	0.239	S	C	*	.			trans	-76.1	113.4	173.6	-177	0	0	0	0	108
375	L	81.9	Confident	84	Confident	37 Å²	37	49.2 Å²	49.2	19%	0.194	24%	0.244	C	C	.	.			trans	-83.5	148.4	174.5	-58.1	177	0	0	0	110.2	L360 V373 I379 K434	L360-L375 HydrophobicContact CD2-CD2 3.82Å; V373-L375 HydrophobicContact CG1-CD2 4.2Å; V373-L375 PolarHBondContact O-N 3.43Å; L375-I379 HydrophobicContact CB-CD1 3.66Å; L375-I379 HydrophobicContact CB-CG1 4.27Å; L375-I379 HydrophobicContact CD1-CD1 3.81Å; L375-I379 HydrophobicContact CG-CD1 4.23Å; L375-K434 HydrophobicContact CD1-CD 3.58Å
376	P	84.3	Confident	84.7	Confident	22 Å²	22	42.3 Å²	42.3	14%	0.143	21%	0.214	C	C	.	.			trans	-58.6	148.7	178.6	-25.6	34.6	0	0	0	113.3	V356 F378 I379	V356-P376 HydrophobicContact CG1-CB 4.31Å; V356-P376 HydrophobicContact CG1-CG 3.79Å; P376-F378 VanDerWaalsContact C-N 3.32Å; P376-F378 HydrophobicContact CB-CD1 3.48Å; P376-F378 VanDerWaalsContact CB-CD1 3.48Å; P376-F378 HydrophobicContact CB-CE1 3.18Å; P376-F378 HydrophobicContact CB-CG 4.46Å; P376-F378 HydrophobicContact CB-CZ 3.98Å; P376-F378 HydrophobicContact CG-CE1 3.8Å; P376-F378 HydrophobicContact CG-CZ 4.29Å; P376-F378 PolarHBondContact O-N 2.65Å; P376-I379 WeakPolarHBondContact O-CG1 3.23Å; P376-I379 PolarHBondContact O-N 2.86Å
377	T	86.5	Confident	85.5	Confident	10 Å²	10	41.2 Å²	41.2	6%	0.061	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-69.5	-28.8	-175.2	-47.9	0	0	0	0	112.8	I379 L380 L656 A664 T665	T377-I379 VanDerWaalsContact C-N 3.25Å; T377-I379 PolarHBondContact O-N 2.73Å; T377-L380 HydrophobicContact CG2-CD1 3.85Å; T377-L380 VanDerWaalsContact O-CB 3.25Å; T377-L380 WeakPolarHBondContact O-CB 3.44Å; T377-L380 VanDerWaalsContact O-CG 3.31Å; T377-L380 WeakPolarHBondContact O-CG 3.29Å; T377-L380 PolarHBondContact O-N 3.18Å; T377-L380 VanDerWaalsContact O-N 3.09Å; T377-L656 HydrophobicContact CG2-CD2 4.14Å; T377-A664 HydrophobicContact CG2-CB 3.72Å; T377-T665 VanDerWaalsContact CB-OG1 3.31Å; T377-T665 WeakPolarHBondContact CB-OG1 3.49Å; T377-T665 PolarHBondContact OG1-OG1 2.94Å
378	F	83.2	Confident	86.3	Confident	12 Å²	12	40.8 Å²	40.8	5%	0.053	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-68	-19.7	-179.6	71.4	-96.3	0	0	0	114.1	E353 V356 I357 P376 L380 I661	E353-F378 HydrophobicContact CB-CD1 3.94Å; E353-F378 HydrophobicContact CB-CD2 4.34Å; E353-F378 HydrophobicContact CB-CE1 3.48Å; E353-F378 VanDerWaalsContact CB-CE1 3.48Å; E353-F378 HydrophobicContact CB-CE2 3.93Å; E353-F378 HydrophobicContact CB-CG 4.36Å; E353-F378 HydrophobicContact CB-CZ 3.49Å; E353-F378 VanDerWaalsContact CB-CZ 3.49Å; E353-F378 HydrophobicContact CG-CD1 3.83Å; E353-F378 HydrophobicContact CG-CE1 3.9Å; E353-F378 HydrophobicContact CG-CG 4.16Å; E353-F378 HydrophobicContact CG-CZ 4.3Å; V356-F378 HydrophobicContact CG1-CE1 4.39Å; I357-F378 HydrophobicContact CD1-CE2 4.07Å; I357-F378 HydrophobicContact CD1-CZ 3.88Å; I357-F378 HydrophobicContact CG1-CE2 4.36Å; I357-F378 HydrophobicContact CG1-CZ 3.66Å; P376-F378 VanDerWaalsContact C-N 3.32Å; P376-F378 HydrophobicContact CB-CD1 3.48Å; P376-F378 VanDerWaalsContact CB-CD1 3.48Å; P376-F378 HydrophobicContact CB-CE1 3.18Å; P376-F378 HydrophobicContact CB-CG 4.46Å; P376-F378 HydrophobicContact CB-CZ 3.98Å; P376-F378 HydrophobicContact CG-CE1 3.8Å; P376-F378 HydrophobicContact CG-CZ 4.29Å; P376-F378 PolarHBondContact O-N 2.65Å; F378-L380 PolarHBondContact O-N 3.45Å; F378-I661 HydrophobicContact CB-CD1 3.91Å; F378-I661 HydrophobicContact CB-CG1 4.36Å; F378-I661 HydrophobicContact CB-CG2 4.38Å
379	I	84.9	Confident	86.7	Confident	42 Å²	42	38.7 Å²	38.7	22%	0.215	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-84.9	2.6	175.1	68.8	149.3	0	0	0	112.8	L375 P376 T377 K433 K434	L375-I379 HydrophobicContact CB-CD1 3.66Å; L375-I379 HydrophobicContact CB-CG1 4.27Å; L375-I379 HydrophobicContact CD1-CD1 3.81Å; L375-I379 HydrophobicContact CG-CD1 4.23Å; P376-I379 WeakPolarHBondContact O-CG1 3.23Å; P376-I379 PolarHBondContact O-N 2.86Å; T377-I379 VanDerWaalsContact C-N 3.25Å; T377-I379 PolarHBondContact O-N 2.73Å; I379-K433 WeakPolarHBondContact O-CA 3.44Å; I379-K434 PolarHBondContact O-N 3.46Å
380	L	88.6	Confident	87.2	Confident	6 Å²	6	35.5 Å²	35.5	3%	0.031	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	138.6	-178.3	-61.1	176.7	0	0	0	111.1	T377 F378 K434 Y436 L656 K668	T377-L380 HydrophobicContact CG2-CD1 3.85Å; T377-L380 VanDerWaalsContact O-CB 3.25Å; T377-L380 WeakPolarHBondContact O-CB 3.44Å; T377-L380 VanDerWaalsContact O-CG 3.31Å; T377-L380 WeakPolarHBondContact O-CG 3.29Å; T377-L380 PolarHBondContact O-N 3.18Å; T377-L380 VanDerWaalsContact O-N 3.09Å; F378-L380 PolarHBondContact O-N 3.45Å; L380-K434 CarbonylContact C-O 3.48Å; L380-K434 VanDerWaalsContact CA-O 3.25Å; L380-K434 WeakPolarHBondContact CA-O 3.37Å; L380-K434 HydrophobicContact CD2-CB 4.45Å; L380-K434 WeakPolarHBondContact CD2-O 3.46Å; L380-Y436 HydrophobicContact CB-CD1 4.23Å; L380-Y436 HydrophobicContact CB-CE1 3.93Å; L380-Y436 HydrophobicContact CD1-CD1 4.08Å; L380-Y436 HydrophobicContact CD1-CE1 4.11Å; L380-L656 HydrophobicContact CB-CD1 4.32Å; L380-K668 HydrophobicContact CD1-CD 3.8Å
381	E	87.9	Confident	87.6	Confident	30 Å²	30	36.1 Å²	36.1	14%	0.14	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	148.3	167.9	-161.5	177.5	173.2	0	0	109.2	R383 K433 K434 Y436	E381-R383 VanDerWaalsContact CD-NE 3.34Å; E381-R383 HydrophobicContact CG-CG 4.06Å; E381-R383 PolarHBondContact O-N 2.9Å; E381-R383 IonicContact OE1-CZ 3.73Å; E381-R383 IonicContact OE1-NE 2.84Å; E381-R383 PolarHBondContact OE1-NE 2.77Å; E381-R383 IonicContact OE1-NH2 2.73Å; E381-R383 PolarHBondContact OE1-NH2 2.95Å; E381-R383 IonicContact OE2-NE 3.93Å; E381-K433 HydrophobicContact CB-CB 3.88Å; E381-K433 HydrophobicContact CG-CB 4.41Å; E381-K434 PolarHBondContact N-O 3.37Å; E381-Y436 WeakPolarHBondContact O-CE1 3.43Å; E381-Y436 VanDerWaalsContact O-CZ 3.27Å
382	K	90.4	Very high	88.4	Confident	28 Å²	28	33.9 Å²	33.9	12%	0.122	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	37.4	-173.8	-58.7	-158	-163.1	87.4	0	114.2	F340 D342 Y436 T653 L656 R657	F340-K382 HydrophobicContact CZ-CB 4.3Å; D342-K382 IonicContact OD1-NZ 3.19Å; D342-K382 PolarHBondContact OD1-NZ 3.32Å; D342-K382 VanDerWaalsContact OD2-CD 3.27Å; D342-K382 WeakPolarHBondContact OD2-CD 3.44Å; D342-K382 WeakPolarHBondContact OD2-CG 3.25Å; D342-K382 IonicContact OD2-NZ 2.74Å; D342-K382 PolarHBondContact OD2-NZ 3.04Å; K382-Y436 WeakPolarHBondContact CA-OH 3.45Å; K382-T653 HydrophobicContact CB-CG2 4.19Å; K382-L656 HydrophobicContact CD-CB 4.23Å; K382-L656 HydrophobicContact CG-CB 4.35Å; K382-L656 HydrophobicContact CG-CD1 4.46Å; K382-R657 HydrophobicContact CD-CG 3.67Å
383	R	91.4	Very high	89.5	Confident	35 Å²	35	23 Å²	23	13%	0.132	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162	160.3	-178.1	63.9	-174.6	179.2	176.6	0.7	112.8	E381 E387 D391 P435 Y436	E381-R383 VanDerWaalsContact CD-NE 3.34Å; E381-R383 HydrophobicContact CG-CG 4.06Å; E381-R383 PolarHBondContact O-N 2.9Å; E381-R383 IonicContact OE1-CZ 3.73Å; E381-R383 IonicContact OE1-NE 2.84Å; E381-R383 PolarHBondContact OE1-NE 2.77Å; E381-R383 IonicContact OE1-NH2 2.73Å; E381-R383 PolarHBondContact OE1-NH2 2.95Å; E381-R383 IonicContact OE2-NE 3.93Å; R383-E387 HydrophobicContact CB-CB 4.48Å; R383-E387 HydrophobicContact CB-CG 4.4Å; R383-D391 IonicContact CZ-OD2 2.7Å; R383-D391 IonicContact NH1-OD1 2.75Å; R383-D391 PolarHBondContact NH1-OD1 3.22Å; R383-D391 IonicContact NH1-OD2 3.48Å; R383-D391 PolarHBondContact NH1-OD2 2.9Å; R383-D391 IonicContact NH2-OD2 2.71Å; R383-D391 PolarHBondContact NH2-OD2 3.47Å; R383-P435 WeakPolarHBondContact O-CA 3.38Å; R383-Y436 WeakPolarHBondContact O-CD2 3.39Å; R383-Y436 PolarHBondContact O-N 3.44Å
384	S	94.9	Very high	89.9	Confident	2 Å²	2	21.8 Å²	21.8	1%	0.014	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	156.1	174.6	179.1	0	0	0	0	112.6	L386 E387 M388 E442	S384-L386 PolarHBondContact O-N 2.87Å; S384-L386 PolarHBondContact OG-N 3.32Å; S384-E387 PolarHBondContact O-N 2.85Å; S384-M388 PolarHBondContact O-N 2.96Å; S384-E442 WeakPolarHBondContact CB-OE1 3.17Å; S384-E442 PolarHBondContact OG-OE1 2.77Å
385	L	94.1	Very high	90.6	Very high	23 Å²	23	16.6 Å²	16.6	12%	0.12	8%	0.082	C	C	.	.	H	α-helix	trans	-57.8	-34.7	170.6	-177.9	147.8	0	0	0	111.1	E387 M388 Y389 P435 Y436 P438 F489	L385-E387 VanDerWaalsContact C-N 3.31Å; L385-E387 PolarHBondContact O-N 2.82Å; L385-M388 HydrophobicContact CG-CE 4.24Å; L385-M388 PolarHBondContact O-N 3.36Å; L385-Y389 HydrophobicContact CD1-CE2 4.43Å; L385-Y389 HydrophobicContact CD2-CD2 3.77Å; L385-Y389 HydrophobicContact CD2-CE2 3.71Å; L385-Y389 HydrophobicContact CG-CD2 4.05Å; L385-Y389 HydrophobicContact CG-CE2 3.92Å; L385-Y389 WeakPolarHBondContact O-CD2 3.25Å; L385-Y389 PolarHBondContact O-N 3.46Å; L385-P435 HydrophobicContact CB-CB 4.22Å; L385-P435 HydrophobicContact CB-CG 4.01Å; L385-P435 HydrophobicContact CD1-CG 4.42Å; L385-P435 HydrophobicContact CG-CG 4.45Å; L385-Y436 PolarHBondContact N-O 2.92Å; L385-Y436 VanDerWaalsContact N-O 3.11Å; L385-P438 HydrophobicContact CB-CG 3.74Å; L385-P438 HydrophobicContact CD2-CG 4.38Å; L385-F489 HydrophobicContact CD2-CZ 3.93Å
386	L	96.4	Very high	91.2	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-60.1	-43.4	178.3	-58.5	-172.1	0	0	0	111.7	S384 P438 E442 F444 A477 F489	S384-L386 PolarHBondContact O-N 2.87Å; S384-L386 PolarHBondContact OG-N 3.32Å; L386-P438 HydrophobicContact CD1-CB 4.28Å; L386-P438 HydrophobicContact CD2-CB 4.24Å; L386-P438 HydrophobicContact CD2-CG 3.94Å; L386-P438 HydrophobicContact CG-CB 3.94Å; L386-P438 HydrophobicContact CG-CG 3.81Å; L386-E442 HydrophobicContact CD1-CB 4.08Å; L386-E442 HydrophobicContact CD1-CG 3.88Å; L386-E442 VanDerWaalsContact CD1-O 3.26Å; L386-E442 WeakPolarHBondContact CD1-O 3.4Å; L386-F444 HydrophobicContact CB-CB 3.8Å; L386-A477 HydrophobicContact CB-CB 4.01Å; L386-A477 HydrophobicContact CD2-CB 4.21Å; L386-A477 HydrophobicContact CG-CB 4.47Å; L386-F489 HydrophobicContact CD2-CE1 4.15Å; L386-F489 HydrophobicContact CD2-CZ 4.4Å
387	E	95.3	Very high	91.6	Very high	7 Å²	7	15.8 Å²	15.8	3%	0.033	8%	0.075	C	C	.	.	H	α-helix	trans	-72.9	-37	177.1	176.2	168.7	177	0	0	112.6	R383 S384 L385 Y389 A390 F444 K632 R646	R383-E387 HydrophobicContact CB-CB 4.48Å; R383-E387 HydrophobicContact CB-CG 4.4Å; S384-E387 PolarHBondContact O-N 2.85Å; L385-E387 VanDerWaalsContact C-N 3.31Å; L385-E387 PolarHBondContact O-N 2.82Å; E387-Y389 VanDerWaalsContact C-N 3.26Å; E387-Y389 PolarHBondContact O-N 2.68Å; E387-A390 VanDerWaalsContact O-CB 3.29Å; E387-A390 WeakPolarHBondContact O-CB 3.25Å; E387-A390 PolarHBondContact O-N 3.09Å; E387-A390 VanDerWaalsContact O-N 3.1Å; E387-F444 HydrophobicContact CB-CD1 4.29Å; E387-F444 HydrophobicContact CB-CD2 3.85Å; E387-F444 HydrophobicContact CB-CE1 4.16Å; E387-F444 HydrophobicContact CB-CE2 3.71Å; E387-F444 HydrophobicContact CB-CG 4.14Å; E387-F444 HydrophobicContact CB-CZ 3.88Å; E387-F444 HydrophobicContact CG-CD2 4.32Å; E387-F444 HydrophobicContact CG-CE1 4.09Å; E387-F444 HydrophobicContact CG-CE2 3.66Å; E387-F444 HydrophobicContact CG-CZ 3.53Å; E387-K632 IonicContact OE1-NZ 2.77Å; E387-K632 PolarHBondContact OE1-NZ 2.87Å; E387-R646 IonicContact OE1-CZ 3.92Å; E387-R646 IonicContact OE1-NE 3.19Å; E387-R646 PolarHBondContact OE1-NE 3.28Å; E387-R646 IonicContact OE1-NH2 2.66Å; E387-R646 PolarHBondContact OE1-NH2 3.07Å; E387-R646 WeakPolarHBondContact OE2-CG 3.36Å; E387-R646 IonicContact OE2-NE 3.52Å; E387-R646 PolarHBondContact OE2-NE 2.89Å
388	M	93.2	Very high	92	Very high	6 Å²	6	16.7 Å²	16.7	3%	0.03	8%	0.079	C	C	.	.	H	α-helix	trans	-58.2	-38.4	177	-177.6	-156.2	67.6	0	0	111.6	S384 L385 A390 D391 P435	S384-M388 PolarHBondContact O-N 2.96Å; L385-M388 HydrophobicContact CG-CE 4.24Å; L385-M388 PolarHBondContact O-N 3.36Å; M388-A390 VanDerWaalsContact C-N 3.27Å; M388-A390 PolarHBondContact O-N 2.69Å; M388-D391 WeakPolarHBondContact O-CB 3.2Å; M388-D391 PolarHBondContact O-N 3.43Å; M388-P435 HydrophobicContact CB-CB 4.48Å; M388-P435 HydrophobicContact SD-CB 4.38Å; M388-P435 HydrophobicContact SD-CG 3.78Å
389	Y	93.9	Very high	92.7	Very high	15 Å²	15	16.2 Å²	16.2	6%	0.059	8%	0.077	C	C	.	.	H	α-helix	trans	-69.5	-22.8	178.1	-91	-102.6	0	0	0	113.5	L385 E387 D391 F392 F489 V504 L538	L385-Y389 HydrophobicContact CD1-CE2 4.43Å; L385-Y389 HydrophobicContact CD2-CD2 3.77Å; L385-Y389 HydrophobicContact CD2-CE2 3.71Å; L385-Y389 HydrophobicContact CG-CD2 4.05Å; L385-Y389 HydrophobicContact CG-CE2 3.92Å; L385-Y389 WeakPolarHBondContact O-CD2 3.25Å; L385-Y389 PolarHBondContact O-N 3.46Å; E387-Y389 VanDerWaalsContact C-N 3.26Å; E387-Y389 PolarHBondContact O-N 2.68Å; Y389-D391 PolarHBondContact O-N 2.86Å; Y389-F392 AromaticContact CD1-CD2 3.85Å; Y389-F392 HydrophobicContact CD1-CD2 3.85Å; Y389-F392 AromaticContact CD1-CE2 3.65Å; Y389-F392 HydrophobicContact CD1-CE2 3.65Å; Y389-F392 HydrophobicContact CE1-CD2 4.3Å; Y389-F392 AromaticContact CE1-CE2 3.7Å; Y389-F392 HydrophobicContact CE1-CE2 3.7Å; Y389-F392 HydrophobicContact CG-CD2 4.48Å; Y389-F392 HydrophobicContact CG-CE2 4.28Å; Y389-F392 WeakPolarHBondContact O-CB 3.42Å; Y389-F392 PolarHBondContact O-N 3.46Å; Y389-F489 VanDerWaalsContact CB-CE1 3.44Å; Y389-F489 HydrophobicContact CD1-CD2 4.4Å; Y389-F489 HydrophobicContact CD1-CE1 4.23Å; Y389-F489 HydrophobicContact CD1-CE2 4.02Å; Y389-F489 AromaticContact CD1-CZ 3.92Å; Y389-F489 HydrophobicContact CD1-CZ 3.92Å; Y389-F489 HydrophobicContact CD2-CE1 4.1Å; Y389-F489 HydrophobicContact CD2-CE2 4.46Å; Y389-F489 AromaticContact CD2-CZ 3.71Å; Y389-F489 HydrophobicContact CD2-CZ 3.71Å; Y389-F489 HydrophobicContact CE1-CE2 4.22Å; Y389-F489 HydrophobicContact CE1-CZ 4.37Å; Y389-F489 HydrophobicContact CE2-CZ 4.19Å; Y389-F489 HydrophobicContact CG-CD1 4.33Å; Y389-F489 AromaticContact CG-CE1 3.68Å; Y389-F489 HydrophobicContact CG-CE1 3.68Å; Y389-F489 HydrophobicContact CG-CE2 4.15Å; Y389-F489 AromaticContact CG-CZ 3.56Å; Y389-F489 HydrophobicContact CG-CZ 3.56Å; Y389-V504 HydrophobicContact CE1-CG2 4.07Å; Y389-V504 WeakPolarHBondContact OH-CG1 3.33Å; Y389-L538 HydrophobicContact CE1-CD2 3.69Å
390	A	94.5	Very high	93.2	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-64.9	-25	173.6	0	0	0	0	0	112	E387 M388 F392 M393 F444 W448 F475 K632	E387-A390 VanDerWaalsContact O-CB 3.29Å; E387-A390 WeakPolarHBondContact O-CB 3.25Å; E387-A390 PolarHBondContact O-N 3.09Å; E387-A390 VanDerWaalsContact O-N 3.1Å; M388-A390 VanDerWaalsContact C-N 3.27Å; M388-A390 PolarHBondContact O-N 2.69Å; A390-F392 PolarHBondContact O-N 3.27Å; A390-M393 WeakPolarHBondContact O-CB 3.45Å; A390-M393 PolarHBondContact O-N 2.71Å; A390-F444 HydrophobicContact CB-CD1 4.34Å; A390-F444 HydrophobicContact CB-CE1 3.75Å; A390-W448 HydrophobicContact CB-CH2 4.1Å; A390-W448 HydrophobicContact CB-CZ2 4.39Å; A390-W448 WeakPolarHBondContact O-CZ2 3.17Å; A390-F475 HydrophobicContact CB-CD1 4.09Å; A390-F475 HydrophobicContact CB-CE1 3.82Å; A390-F475 HydrophobicContact CB-CE2 4.45Å; A390-F475 HydrophobicContact CB-CZ 4.01Å; A390-K632 HydrophobicContact CB-CD 4.4Å
391	D	91.6	Very high	93.5	Very high	25 Å²	25	16.2 Å²	16.2	13%	0.134	8%	0.079	C	C	.	.	G	3₁₀ helix	trans	-67.4	-18.4	177.5	-69.2	5.9	0	0	0	113.6	R383 M388 Y389 M393 S394 K632	R383-D391 IonicContact CZ-OD2 2.7Å; R383-D391 IonicContact NH1-OD1 2.75Å; R383-D391 PolarHBondContact NH1-OD1 3.22Å; R383-D391 IonicContact NH1-OD2 3.48Å; R383-D391 PolarHBondContact NH1-OD2 2.9Å; R383-D391 IonicContact NH2-OD2 2.71Å; R383-D391 PolarHBondContact NH2-OD2 3.47Å; M388-D391 WeakPolarHBondContact O-CB 3.2Å; M388-D391 PolarHBondContact O-N 3.43Å; Y389-D391 PolarHBondContact O-N 2.86Å; D391-M393 PolarHBondContact O-N 2.68Å; D391-S394 VanDerWaalsContact O-CB 3.23Å; D391-S394 WeakPolarHBondContact O-CB 3.25Å; D391-S394 PolarHBondContact O-N 3.1Å; D391-S394 VanDerWaalsContact O-N 3.08Å; D391-S394 PolarHBondContact O-OG 3.23Å; D391-K632 IonicContact OD1-NZ 3.8Å; D391-K632 PolarHBondContact OD1-NZ 3.11Å
392	F	92.1	Very high	93.9	Very high	35 Å²	35	14.8 Å²	14.8	15%	0.154	7%	0.073	C	C	.	.	G	3₁₀ helix	trans	-65.5	-15.4	170.8	-64.2	-19.1	0	0	0	112	Y389 A390 S394 Y418 S422 F423 L538	Y389-F392 AromaticContact CD1-CD2 3.85Å; Y389-F392 HydrophobicContact CD1-CD2 3.85Å; Y389-F392 AromaticContact CD1-CE2 3.65Å; Y389-F392 HydrophobicContact CD1-CE2 3.65Å; Y389-F392 HydrophobicContact CE1-CD2 4.3Å; Y389-F392 AromaticContact CE1-CE2 3.7Å; Y389-F392 HydrophobicContact CE1-CE2 3.7Å; Y389-F392 HydrophobicContact CG-CD2 4.48Å; Y389-F392 HydrophobicContact CG-CE2 4.28Å; Y389-F392 WeakPolarHBondContact O-CB 3.42Å; Y389-F392 PolarHBondContact O-N 3.46Å; A390-F392 PolarHBondContact O-N 3.27Å; F392-S394 VanDerWaalsContact C-N 3.33Å; F392-Y418 PolarHBondContact O-OH 2.77Å; F392-S422 WeakPolarHBondContact CD1-O 3.36Å; F392-S422 WeakPolarHBondContact O-CB 3.16Å; F392-F423 AromaticContact CE1-CD1 3.92Å; F392-F423 HydrophobicContact CE1-CD1 3.92Å; F392-F423 HydrophobicContact CE1-CE1 4.34Å; F392-F423 HydrophobicContact CZ-CD1 4.11Å; F392-F423 HydrophobicContact CZ-CE1 4.13Å; F392-L538 HydrophobicContact CE2-CD2 4.16Å
393	M	93.4	Very high	94.1	Very high	8 Å²	8	13.7 Å²	13.7	4%	0.039	7%	0.068	C	C	.	.	G	3₁₀ helix	trans	-97.4	31.8	171.7	-161.4	65.5	69	0	0	111.8	A390 D391 H395 P396 F399 Y418 W448 V473 A491	A390-M393 WeakPolarHBondContact O-CB 3.45Å; A390-M393 PolarHBondContact O-N 2.71Å; D391-M393 PolarHBondContact O-N 2.68Å; M393-H395 PolarHBondContact O-N 2.69Å; M393-P396 HydrophobicContact CG-CB 4.2Å; M393-P396 WeakPolarHBondContact O-CD 3.38Å; M393-P396 HydrophobicContact SD-CB 4.36Å; M393-F399 HydrophobicContact CE-CD1 4.21Å; M393-F399 HydrophobicContact CE-CD2 4.16Å; M393-F399 HydrophobicContact CE-CE1 4.33Å; M393-F399 HydrophobicContact CE-CE2 4.28Å; M393-F399 HydrophobicContact CE-CG 4.12Å; M393-F399 HydrophobicContact CE-CZ 4.37Å; M393-F399 HydrophobicContact SD-CB 3.79Å; M393-F399 HydrophobicContact SD-CD1 3.91Å; M393-F399 HydrophobicContact SD-CD2 4.26Å; M393-F399 HydrophobicContact SD-CG 3.72Å; M393-Y418 VanDerWaalsContact CE-OH 3.26Å; M393-Y418 WeakPolarHBondContact CE-OH 3.37Å; M393-Y418 HydrophobicContact SD-CE2 4.31Å; M393-Y418 PolarHBondContact SD-OH 2.93Å; M393-W448 HydrophobicContact CB-CE3 4.5Å; M393-W448 HydrophobicContact CB-CH2 3.61Å; M393-W448 HydrophobicContact CB-CZ2 3.66Å; M393-W448 HydrophobicContact CB-CZ3 4.05Å; M393-W448 HydrophobicContact CG-CD2 4.07Å; M393-W448 HydrophobicContact CG-CE3 3.88Å; M393-W448 HydrophobicContact CG-CH2 3.89Å; M393-W448 HydrophobicContact CG-CZ2 4.06Å; M393-W448 HydrophobicContact CG-CZ3 3.8Å; M393-W448 PolarHBondContact O-NE1 2.9Å; M393-V473 HydrophobicContact CE-CG1 4.45Å; M393-V473 HydrophobicContact CG-CG1 4.24Å; M393-V473 HydrophobicContact SD-CG1 4.21Å; M393-A491 HydrophobicContact CE-CB 3.87Å
394	S	89.9	Confident	94.2	Very high	6 Å²	6	14.7 Å²	14.7	4%	0.042	8%	0.076	C	C	.	.	S	Bend	trans	-67.4	-24.8	175.8	35.8	0	0	0	0	114.1	D391 F392 P396 E425 T630	D391-S394 VanDerWaalsContact O-CB 3.23Å; D391-S394 WeakPolarHBondContact O-CB 3.25Å; D391-S394 PolarHBondContact O-N 3.1Å; D391-S394 VanDerWaalsContact O-N 3.08Å; D391-S394 PolarHBondContact O-OG 3.23Å; F392-S394 VanDerWaalsContact C-N 3.33Å; S394-P396 VanDerWaalsContact O-CD 3.24Å; S394-P396 WeakPolarHBondContact O-CD 3.44Å; S394-E425 WeakPolarHBondContact OG-CB 3.42Å; S394-E425 WeakPolarHBondContact OG-CG 3.44Å; S394-T630 PolarHBondContact O-N 2.78Å
395	H	93.6	Very high	94.2	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.076	C	C	.	.			trans	-115.7	63.8	175.9	-62.9	-51.9	0	0	0	111.1	M393 E397 L398 F399 H424 L627 P628	M393-H395 PolarHBondContact O-N 2.69Å; H395-E397 WeakPolarHBondContact CA-OE1 3.33Å; H395-E397 VanDerWaalsContact CA-OE2 3.25Å; H395-E397 WeakPolarHBondContact CA-OE2 3.29Å; H395-E397 VanDerWaalsContact CB-OE1 3.25Å; H395-E397 WeakPolarHBondContact CB-OE1 3.21Å; H395-E397 IonicContact CG-OE1 2.64Å; H395-E397 IonicContact ND1-OE1 3.89Å; H395-E397 PolarHBondContact ND1-OE1 2.99Å; H395-E397 PolarHBondContact O-N 3.43Å; H395-L398 HydrophobicContact CB-CB 4.18Å; H395-L398 HydrophobicContact CB-CD1 3.96Å; H395-L398 HydrophobicContact CB-CG 4.11Å; H395-L398 PolarHBondContact O-N 2.92Å; H395-L398 VanDerWaalsContact O-N 3.07Å; H395-F399 PolarHBondContact O-N 3.33Å; H395-H424 AromaticContact CD2-CE1 3.86Å; H395-H424 AromaticContact CE1-CE1 3.98Å; H395-H424 AromaticContact NE2-CE1 3.03Å; H395-H424 PolarHBondContact NE2-CE1 2.81Å; H395-H424 AromaticContact NE2-ND1 3.99Å; H395-H424 AromaticContact NE2-NE2 3.8Å; H395-L627 WeakPolarHBondContact CE1-CB 3.2Å; H395-P628 PolarHBondContact CE1-O 3.36Å; H395-P628 PolarHBondContact ND1-O 3.28Å
396	P	94.6	Very high	94.1	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.9	-21.2	-178.5	32.1	-38.2	0	0	0	112.1	M393 S394 F399 V400 W448 V450 V473 T630	M393-P396 HydrophobicContact CG-CB 4.2Å; M393-P396 WeakPolarHBondContact O-CD 3.38Å; M393-P396 HydrophobicContact SD-CB 4.36Å; S394-P396 VanDerWaalsContact O-CD 3.24Å; S394-P396 WeakPolarHBondContact O-CD 3.44Å; P396-F399 WeakPolarHBondContact O-CB 3.34Å; P396-F399 PolarHBondContact O-N 3.03Å; P396-V400 WeakPolarHBondContact O-CG1 3.29Å; P396-V400 WeakPolarHBondContact O-CG2 3.44Å; P396-V400 PolarHBondContact O-N 3.34Å; P396-W448 HydrophobicContact CB-CB 4.14Å; P396-W448 HydrophobicContact CB-CG 4.28Å; P396-W448 HydrophobicContact CG-CB 3.96Å; P396-W448 HydrophobicContact CG-CG 4.03Å; P396-V450 HydrophobicContact CB-CG2 3.6Å; P396-V450 HydrophobicContact CG-CG2 3.78Å; P396-V473 HydrophobicContact CB-CG2 4.27Å; P396-T630 HydrophobicContact CG-CG2 4.01Å
397	E	93.8	Very high	94.1	Very high	41 Å²	41	23.4 Å²	23.4	19%	0.192	13%	0.127	C	C	.	.	H	α-helix	trans	-63.2	-40.2	171	73.2	-68.4	166.2	0	0	112.9	H395 F399 V400 T401 V450	H395-E397 WeakPolarHBondContact CA-OE1 3.33Å; H395-E397 VanDerWaalsContact CA-OE2 3.25Å; H395-E397 WeakPolarHBondContact CA-OE2 3.29Å; H395-E397 VanDerWaalsContact CB-OE1 3.25Å; H395-E397 WeakPolarHBondContact CB-OE1 3.21Å; H395-E397 IonicContact CG-OE1 2.64Å; H395-E397 IonicContact ND1-OE1 3.89Å; H395-E397 PolarHBondContact ND1-OE1 2.99Å; H395-E397 PolarHBondContact O-N 3.43Å; E397-F399 VanDerWaalsContact C-N 3.32Å; E397-V400 WeakPolarHBondContact O-CG2 3.44Å; E397-T401 WeakPolarHBondContact O-CB 3.21Å; E397-T401 WeakPolarHBondContact O-CG2 3.1Å; E397-T401 PolarHBondContact O-N 2.68Å; E397-T401 PolarHBondContact O-OG1 2.62Å; E397-V450 HydrophobicContact CB-CG1 3.96Å
398	L	95.3	Very high	94.1	Very high	29 Å²	29	25.3 Å²	25.3	15%	0.152	14%	0.14	C	C	.	.	H	α-helix	trans	-71.6	-32.3	175	-65.9	-178	0	0	0	111	H395 T401 I402 Y418 T421 L627	H395-L398 HydrophobicContact CB-CB 4.18Å; H395-L398 HydrophobicContact CB-CD1 3.96Å; H395-L398 HydrophobicContact CB-CG 4.11Å; H395-L398 PolarHBondContact O-N 2.92Å; H395-L398 VanDerWaalsContact O-N 3.07Å; L398-T401 WeakPolarHBondContact CA-OG1 3.37Å; L398-T401 PolarHBondContact O-OG1 2.71Å; L398-I402 WeakPolarHBondContact O-CG1 3.37Å; L398-Y418 HydrophobicContact CB-CD2 3.97Å; L398-T421 HydrophobicContact CD1-CG2 4.05Å; L398-T421 WeakPolarHBondContact CD1-OG1 2.82Å; L398-L627 HydrophobicContact CD1-CD1 4.23Å
399	F	96.3	Very high	94.3	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.009	15%	0.151	C	C	.	.	H	α-helix	trans	-64.1	-52.7	174.1	178.8	-109.6	0	0	0	112	M393 H395 P396 E397 T401 I402 Y418 V473 M498 V500 L525	M393-F399 HydrophobicContact CE-CD1 4.21Å; M393-F399 HydrophobicContact CE-CD2 4.16Å; M393-F399 HydrophobicContact CE-CE1 4.33Å; M393-F399 HydrophobicContact CE-CE2 4.28Å; M393-F399 HydrophobicContact CE-CG 4.12Å; M393-F399 HydrophobicContact CE-CZ 4.37Å; M393-F399 HydrophobicContact SD-CB 3.79Å; M393-F399 HydrophobicContact SD-CD1 3.91Å; M393-F399 HydrophobicContact SD-CD2 4.26Å; M393-F399 HydrophobicContact SD-CG 3.72Å; H395-F399 PolarHBondContact O-N 3.33Å; P396-F399 WeakPolarHBondContact O-CB 3.34Å; P396-F399 PolarHBondContact O-N 3.03Å; E397-F399 VanDerWaalsContact C-N 3.32Å; F399-T401 PolarHBondContact O-N 3.4Å; F399-I402 HydrophobicContact CD2-CD1 4.22Å; F399-I402 WeakPolarHBondContact O-CD1 3.38Å; F399-I402 VanDerWaalsContact O-CG1 3.3Å; F399-I402 WeakPolarHBondContact O-CG1 3.5Å; F399-I402 PolarHBondContact O-N 2.68Å; F399-Y418 HydrophobicContact CB-CD2 3.91Å; F399-Y418 HydrophobicContact CB-CE1 4.44Å; F399-Y418 HydrophobicContact CB-CE2 3.61Å; F399-Y418 HydrophobicContact CB-CG 4.44Å; F399-Y418 HydrophobicContact CD2-CD1 4.21Å; F399-Y418 AromaticContact CD2-CE1 3.7Å; F399-Y418 HydrophobicContact CD2-CE1 3.7Å; F399-Y418 HydrophobicContact CD2-CE2 4.36Å; F399-Y418 AromaticContact CD2-CZ 3.78Å; F399-Y418 HydrophobicContact CG-CE2 4.41Å; F399-V473 HydrophobicContact CD1-CG1 4.39Å; F399-V473 HydrophobicContact CD1-CG2 4.47Å; F399-V473 HydrophobicContact CE1-CG1 4.41Å; F399-M498 HydrophobicContact CD1-SD 4.44Å; F399-M498 HydrophobicContact CE1-CG 4.19Å; F399-M498 HydrophobicContact CE1-SD 4.19Å; F399-M498 HydrophobicContact CZ-CG 4.4Å; F399-M498 WeakPolarHBondContact O-CE 3.42Å; F399-V500 HydrophobicContact CE2-CB 4.46Å; F399-V500 HydrophobicContact CE2-CG1 4.13Å; F399-V500 HydrophobicContact CZ-CG1 4.11Å; F399-L525 HydrophobicContact CE2-CD1 3.91Å; F399-L525 HydrophobicContact CZ-CD1 4.28Å
400	V	95.6	Very high	94.4	Very high	4 Å²	4	29 Å²	29	2%	0.024	16%	0.159	C	C	.	.	H	α-helix	trans	-68.3	-23.5	-176.3	-61.4	0	0	0	0	113.3	P396 E397 I402 V450 Y471 V473 C493 R496	P396-V400 WeakPolarHBondContact O-CG1 3.29Å; P396-V400 WeakPolarHBondContact O-CG2 3.44Å; P396-V400 PolarHBondContact O-N 3.34Å; E397-V400 WeakPolarHBondContact O-CG2 3.44Å; V400-I402 VanDerWaalsContact C-N 3.33Å; V400-V450 HydrophobicContact CG2-CG1 3.98Å; V400-Y471 HydrophobicContact CG2-CD2 4.32Å; V400-V473 HydrophobicContact CG1-CG2 3.76Å; V400-C493 HydrophobicContact CG1-CB 4.38Å; V400-R496 HydrophobicContact CB-CG 4.28Å
401	T	94.9	Very high	94.6	Very high	44 Å²	44	29.7 Å²	29.7	27%	0.27	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-2.9	-179.5	53.1	0	0	0	0	113.7	E397 L398 F399 T403 D404 R414	E397-T401 WeakPolarHBondContact O-CB 3.21Å; E397-T401 WeakPolarHBondContact O-CG2 3.1Å; E397-T401 PolarHBondContact O-N 2.68Å; E397-T401 PolarHBondContact O-OG1 2.62Å; L398-T401 WeakPolarHBondContact CA-OG1 3.37Å; L398-T401 PolarHBondContact O-OG1 2.71Å; F399-T401 PolarHBondContact O-N 3.4Å; T401-T403 VanDerWaalsContact C-N 3.28Å; T401-T403 PolarHBondContact O-N 3.29Å; T401-D404 WeakPolarHBondContact CA-OD2 3.24Å; T401-D404 WeakPolarHBondContact O-CB 3.31Å; T401-D404 PolarHBondContact O-N 2.91Å; T401-R414 WeakPolarHBondContact O-CD 3.48Å; T401-R414 PolarHBondContact O-NH1 2.74Å
402	I	97	Very high	94.9	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.155	C	C	.	.	S	Bend	trans	-59.2	-42.5	173.6	-62.3	168.8	0	0	0	110.3	L398 F399 V400 D404 G405 R411 R414 F415 Y418 M498 L525 L527	L398-I402 WeakPolarHBondContact O-CG1 3.37Å; F399-I402 HydrophobicContact CD2-CD1 4.22Å; F399-I402 WeakPolarHBondContact O-CD1 3.38Å; F399-I402 VanDerWaalsContact O-CG1 3.3Å; F399-I402 WeakPolarHBondContact O-CG1 3.5Å; F399-I402 PolarHBondContact O-N 2.68Å; V400-I402 VanDerWaalsContact C-N 3.33Å; I402-D404 PolarHBondContact O-N 3.13Å; I402-G405 PolarHBondContact O-N 3.16Å; I402-R411 WeakPolarHBondContact O-CG 3.25Å; I402-R414 HydrophobicContact CG1-CB 4.43Å; I402-F415 HydrophobicContact CD1-CB 4.27Å; I402-F415 HydrophobicContact CD1-CD2 3.8Å; I402-F415 HydrophobicContact CD1-CG 4.38Å; I402-F415 HydrophobicContact CG2-CB 4.12Å; I402-Y418 HydrophobicContact CD1-CD1 3.99Å; I402-Y418 HydrophobicContact CD1-CG 4.18Å; I402-M498 HydrophobicContact CB-CE 4.14Å; I402-L525 HydrophobicContact CD1-CD2 4.04Å; I402-L525 HydrophobicContact CG2-CD2 4.32Å; I402-L527 HydrophobicContact CG2-CD1 3.94Å; I402-L527 HydrophobicContact CG2-CD2 4.18Å
403	T	94.9	Very high	95.2	Very high	5 Å²	5	27.3 Å²	27.3	3%	0.031	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-19.8	-179.1	-158	0	0	0	0	113.2	T401 G405 R496 E529 H530	T401-T403 VanDerWaalsContact C-N 3.28Å; T401-T403 PolarHBondContact O-N 3.29Å; T403-G405 PolarHBondContact O-N 3.24Å; T403-G405 VanDerWaalsContact O-N 3.16Å; T403-R496 HydrophobicContact CG2-CB 4.36Å; T403-E529 PolarHBondContact OG1-OE2 3.47Å; T403-H530 PolarHBondContact O-NE2 2.81Å; T403-H530 PolarHBondContact OG1-CD2 2.87Å; T403-H530 VanDerWaalsContact OG1-CD2 3.3Å; T403-H530 PolarHBondContact OG1-NE2 2.74Å
404	D	93.7	Very high	95.4	Very high	56 Å²	56	30.1 Å²	30.1	30%	0.299	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-0.3	179.5	-62.3	-29.9	0	0	0	112.8	T401 I402 N406 R496	T401-D404 WeakPolarHBondContact CA-OD2 3.24Å; T401-D404 WeakPolarHBondContact O-CB 3.31Å; T401-D404 PolarHBondContact O-N 2.91Å; I402-D404 PolarHBondContact O-N 3.13Å; D404-N406 PolarHBondContact O-N 3Å; D404-R496 IonicContact OD1-CZ 3.85Å; D404-R496 VanDerWaalsContact OD1-CZ 3.23Å; D404-R496 IonicContact OD1-NH1 3.24Å; D404-R496 PolarHBondContact OD1-NH1 3.23Å; D404-R496 IonicContact OD1-NH2 3.54Å; D404-R496 PolarHBondContact OD1-NH2 3.23Å; D404-R496 VanDerWaalsContact OD1-NH2 3.13Å; D404-R496 IonicContact OD2-CZ 2.63Å; D404-R496 IonicContact OD2-NH1 2.71Å; D404-R496 IonicContact OD2-NH2 2.73Å; D404-R496 PolarHBondContact OD2-NH2 2.82Å
405	G	93.3	Very high	95.8	Very high	1 Å²	1	30 Å²	30	1%	0.01	16%	0.159	C	C	.	.			trans	-72.4	121.2	177.2	0	0	0	0	0	112.5	I402 T403 S407 D410 R411	I402-G405 PolarHBondContact O-N 3.16Å; T403-G405 PolarHBondContact O-N 3.24Å; T403-G405 VanDerWaalsContact O-N 3.16Å; G405-S407 VanDerWaalsContact C-N 3.28Å; G405-S407 PolarHBondContact O-N 3.46Å; G405-D410 WeakPolarHBondContact CA-OD2 3.48Å; G405-R411 WeakPolarHBondContact O-CD 3.46Å; G405-R411 VanDerWaalsContact O-CG 3.23Å; G405-R411 WeakPolarHBondContact O-CG 3.33Å; G405-R411 PolarHBondContact O-NH1 3.2Å
406	N	91.9	Very high	96	Very high	159 Å²	159	30 Å²	30	85%	0.85	16%	0.159	S	C	*	.	S	Bend	trans	-69.1	-24.4	-174.6	-71.7	-18.6	0	0	0	113.5	D404	D404-N406 PolarHBondContact O-N 3Å
407	S	96.5	Very high	96.1	Very high	49 Å²	49	31 Å²	31	34%	0.343	16%	0.164	S	C	.	.	S	Bend	trans	-124.1	155.7	178.3	70	0	0	0	0	110.7	G405 E409 D410 R411	G405-S407 VanDerWaalsContact C-N 3.28Å; G405-S407 PolarHBondContact O-N 3.46Å; S407-E409 PolarHBondContact O-N 3.36Å; S407-D410 PolarHBondContact O-N 3.18Å; S407-D410 VanDerWaalsContact O-N 3.09Å; S407-D410 PolarHBondContact OG-N 3.44Å; S407-D410 VanDerWaalsContact OG-N 3.14Å; S407-R411 PolarHBondContact O-N 3.13Å
408	P	97.1	Very high	96.3	Very high	46 Å²	46	30 Å²	30	30%	0.299	16%	0.159	S	C	.	.	H	α-helix	trans	-58.8	-29	174.8	-19.5	28.5	0	0	0	113.3	M412 Y567	P408-M412 WeakPolarHBondContact O-CB 3.13Å; P408-M412 PolarHBondContact O-N 3.29Å; P408-Y567 HydrophobicContact CB-CD2 4.1Å; P408-Y567 HydrophobicContact CB-CE2 4.04Å
409	E	96.8	Very high	96.4	Very high	55 Å²	55	29.1 Å²	29.1	26%	0.257	15%	0.153	S	C	.	.	H	α-helix	trans	-61.9	-53.1	171.7	-175	169.7	139.8	0	0	112	S407 R411 M412 I413 Y567 V599	S407-E409 PolarHBondContact O-N 3.36Å; E409-R411 VanDerWaalsContact C-N 3.34Å; E409-R411 PolarHBondContact O-N 3.36Å; E409-M412 PolarHBondContact O-N 2.85Å; E409-I413 HydrophobicContact CG-CD1 3.92Å; E409-I413 WeakPolarHBondContact O-CG1 3.34Å; E409-I413 PolarHBondContact O-N 3.09Å; E409-Y567 HydrophobicContact CB-CE1 3.8Å; E409-Y567 HydrophobicContact CB-CE2 4.41Å; E409-Y567 HydrophobicContact CG-CE1 3.9Å; E409-Y567 PolarHBondContact OE2-OH 2.84Å; E409-V599 HydrophobicContact CG-CB 4.11Å; E409-V599 HydrophobicContact CG-CG1 4.45Å; E409-V599 HydrophobicContact CG-CG2 3.97Å
410	D	96.4	Very high	96.4	Very high	44 Å²	44	29 Å²	29	24%	0.235	15%	0.153	C	C	.	.	H	α-helix	trans	-60.8	-44.7	-180	-174.4	20.1	0	0	0	110.4	G405 S407 M412 I413 R414	G405-D410 WeakPolarHBondContact CA-OD2 3.48Å; S407-D410 PolarHBondContact O-N 3.18Å; S407-D410 VanDerWaalsContact O-N 3.09Å; S407-D410 PolarHBondContact OG-N 3.44Å; S407-D410 VanDerWaalsContact OG-N 3.14Å; D410-M412 PolarHBondContact O-N 2.78Å; D410-I413 PolarHBondContact O-N 2.71Å; D410-R414 VanDerWaalsContact O-CG 3.31Å; D410-R414 WeakPolarHBondContact O-CG 3.49Å; D410-R414 PolarHBondContact O-N 2.78Å; D410-R414 IonicContact OD1-CZ 2.71Å; D410-R414 IonicContact OD1-NE 2.68Å; D410-R414 PolarHBondContact OD1-NE 2.96Å; D410-R414 IonicContact OD1-NH2 2.75Å; D410-R414 IonicContact OD2-CZ 2.68Å; D410-R414 IonicContact OD2-NE 2.62Å; D410-R414 PolarHBondContact OD2-NE 2.97Å; D410-R414 IonicContact OD2-NH2 3.13Å; D410-R414 PolarHBondContact OD2-NH2 3.46Å
411	R	98	Very high	96.3	Very high	15 Å²	15	28.8 Å²	28.8	6%	0.057	15%	0.152	C	C	.	.	H	α-helix	trans	-60.8	-41.9	176.7	-65.1	-168.9	-65.6	-91	8.5	112.9	I402 G405 S407 E409 R414 F415 L527 H530 E532 Y534	I402-R411 WeakPolarHBondContact O-CG 3.25Å; G405-R411 WeakPolarHBondContact O-CD 3.46Å; G405-R411 VanDerWaalsContact O-CG 3.23Å; G405-R411 WeakPolarHBondContact O-CG 3.33Å; G405-R411 PolarHBondContact O-NH1 3.2Å; S407-R411 PolarHBondContact O-N 3.13Å; E409-R411 VanDerWaalsContact C-N 3.34Å; E409-R411 PolarHBondContact O-N 3.36Å; R411-R414 PolarHBondContact O-N 2.9Å; R411-F415 PolarHBondContact O-N 3.21Å; R411-L527 HydrophobicContact CB-CD1 4.47Å; R411-H530 PolarHBondContact NH1-ND1 2.89Å; R411-E532 IonicContact CZ-OE1 3.09Å; R411-E532 IonicContact CZ-OE2 3.18Å; R411-E532 IonicContact NE-OE1 2.59Å; R411-E532 IonicContact NE-OE2 3.04Å; R411-E532 PolarHBondContact NE-OE2 3.19Å; R411-E532 IonicContact NH2-OE1 2.83Å; R411-E532 PolarHBondContact NH2-OE1 2.77Å; R411-E532 IonicContact NH2-OE2 3.21Å; R411-E532 PolarHBondContact NH2-OE2 2.95Å; R411-E532 VanDerWaalsContact NH2-OE2 3.12Å; R411-Y534 WeakPolarHBondContact CB-OH 3.32Å
412	M	98.1	Very high	96.2	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.8	-43.8	174.7	178.5	61.1	78.3	0	0	111.7	P408 E409 D410 F415 V416 Y534 I560 C562 Y567 A569 V590	P408-M412 WeakPolarHBondContact O-CB 3.13Å; P408-M412 PolarHBondContact O-N 3.29Å; E409-M412 PolarHBondContact O-N 2.85Å; D410-M412 PolarHBondContact O-N 2.78Å; M412-F415 PolarHBondContact O-N 3.03Å; M412-V416 WeakPolarHBondContact O-CG2 3.35Å; M412-V416 PolarHBondContact O-N 2.92Å; M412-Y534 HydrophobicContact CB-CE1 4.33Å; M412-Y534 HydrophobicContact CE-CD1 3.64Å; M412-Y534 HydrophobicContact CE-CE1 3.6Å; M412-Y534 HydrophobicContact SD-CD1 4.09Å; M412-Y534 HydrophobicContact SD-CE1 4.04Å; M412-I560 HydrophobicContact CE-CG2 4.31Å; M412-I560 HydrophobicContact SD-CG2 3.81Å; M412-C562 HydrophobicContact CE-CB 4.09Å; M412-Y567 VanDerWaalsContact CE-O 3.28Å; M412-Y567 WeakPolarHBondContact CE-O 3.27Å; M412-A569 HydrophobicContact SD-CB 4.37Å; M412-V590 HydrophobicContact CB-CG1 4.38Å; M412-V590 HydrophobicContact CG-CG1 3.52Å
413	I	97.5	Very high	95.9	Very high	9 Å²	9	27.3 Å²	27.3	5%	0.046	14%	0.142	C	C	.	.	H	α-helix	trans	-63.7	-44.7	179	-69.6	167.6	0	0	0	110.8	E409 D410 F415 V416 E417 V590 C600 Y614	E409-I413 HydrophobicContact CG-CD1 3.92Å; E409-I413 WeakPolarHBondContact O-CG1 3.34Å; E409-I413 PolarHBondContact O-N 3.09Å; D410-I413 PolarHBondContact O-N 2.71Å; I413-F415 VanDerWaalsContact C-N 3.31Å; I413-F415 PolarHBondContact O-N 3.35Å; I413-V416 WeakPolarHBondContact O-CB 3.31Å; I413-V416 PolarHBondContact O-N 2.85Å; I413-E417 PolarHBondContact O-N 2.99Å; I413-V590 HydrophobicContact CG1-CG1 4.47Å; I413-V590 HydrophobicContact CG1-CG2 4.43Å; I413-C600 HydrophobicContact CD1-CB 3.86Å; I413-C600 HydrophobicContact CG1-CB 3.92Å; I413-Y614 HydrophobicContact CD1-CD1 4.27Å; I413-Y614 HydrophobicContact CD1-CE1 4.1Å; I413-Y614 HydrophobicContact CG2-CE1 4.03Å
414	R	97.8	Very high	95.5	Very high	68 Å²	68	27.8 Å²	27.8	26%	0.257	14%	0.144	S	C	.	.	H	α-helix	trans	-61.8	-39.2	175.7	-69.8	176.1	-173.9	-135.6	7.4	112.2	T401 I402 D410 R411 E417 Y418	T401-R414 WeakPolarHBondContact O-CD 3.48Å; T401-R414 PolarHBondContact O-NH1 2.74Å; I402-R414 HydrophobicContact CG1-CB 4.43Å; D410-R414 VanDerWaalsContact O-CG 3.31Å; D410-R414 WeakPolarHBondContact O-CG 3.49Å; D410-R414 PolarHBondContact O-N 2.78Å; D410-R414 IonicContact OD1-CZ 2.71Å; D410-R414 IonicContact OD1-NE 2.68Å; D410-R414 PolarHBondContact OD1-NE 2.96Å; D410-R414 IonicContact OD1-NH2 2.75Å; D410-R414 IonicContact OD2-CZ 2.68Å; D410-R414 IonicContact OD2-NE 2.62Å; D410-R414 PolarHBondContact OD2-NE 2.97Å; D410-R414 IonicContact OD2-NH2 3.13Å; D410-R414 PolarHBondContact OD2-NH2 3.46Å; R411-R414 PolarHBondContact O-N 2.9Å; R414-E417 PolarHBondContact O-N 2.86Å; R414-Y418 PolarHBondContact O-N 2.9Å
415	F	98.3	Very high	95	Very high	4 Å²	4	26.3 Å²	26.3	2%	0.018	14%	0.135	C	C	.	.	H	α-helix	trans	-64.6	-41.6	175	-175.6	-153.1	0	0	0	111.6	I402 R411 M412 I413 E417 Y418 Y419 L525 Y534 F536 I560	I402-F415 HydrophobicContact CD1-CB 4.27Å; I402-F415 HydrophobicContact CD1-CD2 3.8Å; I402-F415 HydrophobicContact CD1-CG 4.38Å; I402-F415 HydrophobicContact CG2-CB 4.12Å; R411-F415 PolarHBondContact O-N 3.21Å; M412-F415 PolarHBondContact O-N 3.03Å; I413-F415 VanDerWaalsContact C-N 3.31Å; I413-F415 PolarHBondContact O-N 3.35Å; F415-E417 VanDerWaalsContact C-N 3.31Å; F415-E417 PolarHBondContact O-N 2.91Å; F415-Y418 HydrophobicContact CD2-CD1 4.15Å; F415-Y418 HydrophobicContact CE2-CD1 4.21Å; F415-Y418 PolarHBondContact O-N 2.92Å; F415-Y419 VanDerWaalsContact O-CB 3.23Å; F415-Y419 WeakPolarHBondContact O-CB 3.25Å; F415-Y419 PolarHBondContact O-N 2.87Å; F415-L525 HydrophobicContact CD1-CD2 3.95Å; F415-L525 HydrophobicContact CD2-CD2 3.77Å; F415-L525 HydrophobicContact CE1-CB 4.34Å; F415-L525 HydrophobicContact CE1-CD2 4.02Å; F415-L525 HydrophobicContact CE2-CD2 3.87Å; F415-L525 HydrophobicContact CG-CD2 3.85Å; F415-L525 HydrophobicContact CZ-CB 4.17Å; F415-L525 HydrophobicContact CZ-CD2 3.99Å; F415-Y534 AromaticContact CD1-CD1 3.84Å; F415-Y534 HydrophobicContact CD1-CD1 3.84Å; F415-Y534 AromaticContact CD1-CG 4Å; F415-Y534 HydrophobicContact CD1-CG 4Å; F415-Y534 HydrophobicContact CE1-CD1 4.44Å; F415-Y534 HydrophobicContact CE1-CG 4.27Å; F415-F536 HydrophobicContact CE1-CB 4.49Å; F415-F536 HydrophobicContact CE1-CD1 4.04Å; F415-F536 HydrophobicContact CE1-CG 4.47Å; F415-F536 HydrophobicContact CZ-CB 4.41Å; F415-F536 AromaticContact CZ-CD1 3.55Å; F415-F536 HydrophobicContact CZ-CD1 3.55Å; F415-F536 AromaticContact CZ-CE1 3.88Å; F415-F536 HydrophobicContact CZ-CE1 3.88Å; F415-F536 AromaticContact CZ-CG 3.98Å; F415-F536 HydrophobicContact CZ-CG 3.98Å; F415-I560 HydrophobicContact CD1-CD1 4.37Å; F415-I560 HydrophobicContact CD1-CG2 3.54Å; F415-I560 HydrophobicContact CE1-CD1 4.25Å; F415-I560 HydrophobicContact CE1-CG2 3.47Å; F415-I560 VanDerWaalsContact CE1-CG2 3.47Å
416	V	98.3	Very high	94.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.5	-39.6	173.6	171.4	0	0	0	0	111.6	M412 I413 Y419 L420 I560 A569 I571 A588 V590 V602	M412-V416 WeakPolarHBondContact O-CG2 3.35Å; M412-V416 PolarHBondContact O-N 2.92Å; I413-V416 WeakPolarHBondContact O-CB 3.31Å; I413-V416 PolarHBondContact O-N 2.85Å; V416-Y419 PolarHBondContact O-N 3.14Å; V416-L420 HydrophobicContact CG1-CD1 3.91Å; V416-L420 HydrophobicContact CG1-CG 4.4Å; V416-L420 WeakPolarHBondContact O-CB 3.31Å; V416-L420 WeakPolarHBondContact O-CG 3.44Å; V416-L420 PolarHBondContact O-N 2.82Å; V416-I560 HydrophobicContact CG2-CD1 4.19Å; V416-A569 HydrophobicContact CG2-CB 3.51Å; V416-I571 HydrophobicContact CG1-CD1 4.4Å; V416-A588 HydrophobicContact CG1-CB 4.36Å; V416-V590 HydrophobicContact CG2-CG2 4.06Å; V416-V602 HydrophobicContact CG1-CG2 4.32Å
417	E	97.4	Very high	93.2	Very high	19 Å²	19	21.5 Å²	21.5	9%	0.089	11%	0.106	C	C	.	.	H	α-helix	trans	-63.4	-50.8	176.3	-178.4	174.4	172.4	0	0	112.3	I413 R414 F415 Y419 L420 T421 F612 K620	I413-E417 PolarHBondContact O-N 2.99Å; R414-E417 PolarHBondContact O-N 2.86Å; F415-E417 VanDerWaalsContact C-N 3.31Å; F415-E417 PolarHBondContact O-N 2.91Å; E417-Y419 VanDerWaalsContact C-N 3.31Å; E417-Y419 PolarHBondContact O-N 3.41Å; E417-L420 PolarHBondContact O-N 2.78Å; E417-T421 VanDerWaalsContact O-CG2 3.31Å; E417-T421 WeakPolarHBondContact O-CG2 3.44Å; E417-T421 PolarHBondContact O-N 2.74Å; E417-T421 VanDerWaalsContact O-N 3.1Å; E417-T421 PolarHBondContact O-OG1 2.86Å; E417-F612 HydrophobicContact CB-CE1 4.13Å; E417-F612 HydrophobicContact CB-CZ 3.9Å; E417-F612 HydrophobicContact CG-CZ 4.06Å; E417-K620 WeakPolarHBondContact OE1-CE 3.31Å; E417-K620 IonicContact OE1-NZ 2.8Å; E417-K620 PolarHBondContact OE1-NZ 2.8Å; E417-K620 IonicContact OE2-NZ 3.86Å; E417-K620 PolarHBondContact OE2-NZ 2.83Å
418	Y	97.1	Very high	91.7	Very high	22 Å²	22	26 Å²	26	9%	0.086	12%	0.119	C	C	.	.	H	α-helix	trans	-57.2	-45.7	173.2	167.9	-107.5	0	0	0	111.4	F392 M393 L398 F399 I402 R414 F415 L420 T421 S422	F392-Y418 PolarHBondContact O-OH 2.77Å; M393-Y418 VanDerWaalsContact CE-OH 3.26Å; M393-Y418 WeakPolarHBondContact CE-OH 3.37Å; M393-Y418 HydrophobicContact SD-CE2 4.31Å; M393-Y418 PolarHBondContact SD-OH 2.93Å; L398-Y418 HydrophobicContact CB-CD2 3.97Å; F399-Y418 HydrophobicContact CB-CD2 3.91Å; F399-Y418 HydrophobicContact CB-CE1 4.44Å; F399-Y418 HydrophobicContact CB-CE2 3.61Å; F399-Y418 HydrophobicContact CB-CG 4.44Å; F399-Y418 HydrophobicContact CD2-CD1 4.21Å; F399-Y418 AromaticContact CD2-CE1 3.7Å; F399-Y418 HydrophobicContact CD2-CE1 3.7Å; F399-Y418 HydrophobicContact CD2-CE2 4.36Å; F399-Y418 AromaticContact CD2-CZ 3.78Å; F399-Y418 HydrophobicContact CG-CE2 4.41Å; I402-Y418 HydrophobicContact CD1-CD1 3.99Å; I402-Y418 HydrophobicContact CD1-CG 4.18Å; R414-Y418 PolarHBondContact O-N 2.9Å; F415-Y418 HydrophobicContact CD2-CD1 4.15Å; F415-Y418 HydrophobicContact CE2-CD1 4.21Å; F415-Y418 PolarHBondContact O-N 2.92Å; Y418-L420 PolarHBondContact O-N 3.31Å; Y418-T421 WeakPolarHBondContact CA-OG1 3.38Å; Y418-T421 PolarHBondContact O-N 3.07Å; Y418-T421 PolarHBondContact O-OG1 3.24Å; Y418-S422 PolarHBondContact O-N 3.03Å; Y418-S422 VanDerWaalsContact O-N 3.12Å
419	Y	97.2	Very high	90.2	Very high	9 Å²	9	25.9 Å²	25.9	4%	0.035	13%	0.127	C	C	.	.	H	α-helix	trans	-60.1	-46.5	-179.2	-173.7	-89.5	0	0	0	111.7	F415 V416 E417 T421 S422 F423 F536 T537 P539 V558 I560 I571 F573	F415-Y419 VanDerWaalsContact O-CB 3.23Å; F415-Y419 WeakPolarHBondContact O-CB 3.25Å; F415-Y419 PolarHBondContact O-N 2.87Å; V416-Y419 PolarHBondContact O-N 3.14Å; E417-Y419 VanDerWaalsContact C-N 3.31Å; E417-Y419 PolarHBondContact O-N 3.41Å; Y419-T421 PolarHBondContact O-N 3.39Å; Y419-S422 PolarHBondContact O-N 3.29Å; Y419-S422 PolarHBondContact O-OG 2.89Å; Y419-F423 AromaticContact CD1-CE2 3.84Å; Y419-F423 HydrophobicContact CD1-CE2 3.84Å; Y419-F423 HydrophobicContact CD1-CZ 4.38Å; Y419-F423 AromaticContact CE1-CE2 3.48Å; Y419-F423 HydrophobicContact CE1-CE2 3.48Å; Y419-F423 VanDerWaalsContact CE1-CE2 3.48Å; Y419-F423 AromaticContact CE1-CZ 3.67Å; Y419-F423 HydrophobicContact CE1-CZ 3.67Å; Y419-F423 HydrophobicContact CE2-CZ 4.21Å; Y419-F423 AromaticContact CZ-CE2 3.86Å; Y419-F423 AromaticContact CZ-CZ 3.55Å; Y419-F423 WeakPolarHBondContact O-CD2 3.22Å; Y419-F423 WeakPolarHBondContact O-CE2 3.32Å; Y419-F536 HydrophobicContact CD2-CD2 4.29Å; Y419-F536 AromaticContact CE2-CD2 3.78Å; Y419-F536 HydrophobicContact CE2-CD2 3.78Å; Y419-F536 HydrophobicContact CE2-CE2 4.23Å; Y419-T537 PolarHBondContact OH-O 3.4Å; Y419-P539 VanDerWaalsContact OH-CD 3.31Å; Y419-P539 WeakPolarHBondContact OH-CD 3.14Å; Y419-V558 HydrophobicContact CE1-CG1 3.91Å; Y419-I560 HydrophobicContact CD1-CD1 4.42Å; Y419-I560 HydrophobicContact CD2-CD1 4.32Å; Y419-I560 HydrophobicContact CG-CD1 4.05Å; Y419-I571 HydrophobicContact CD1-CD1 3.51Å; Y419-I571 HydrophobicContact CE1-CD1 3.89Å; Y419-I571 HydrophobicContact CG-CD1 4.36Å; Y419-F573 HydrophobicContact CE1-CE2 4.32Å; Y419-F573 HydrophobicContact CE1-CZ 4.39Å
420	L	96.5	Very high	88.7	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-70.3	-29.5	-178.5	-72.5	174.3	0	0	0	113.6	V416 E417 Y418 I571 F573 V586 V602 L610 F612	V416-L420 HydrophobicContact CG1-CD1 3.91Å; V416-L420 HydrophobicContact CG1-CG 4.4Å; V416-L420 WeakPolarHBondContact O-CB 3.31Å; V416-L420 WeakPolarHBondContact O-CG 3.44Å; V416-L420 PolarHBondContact O-N 2.82Å; E417-L420 PolarHBondContact O-N 2.78Å; Y418-L420 PolarHBondContact O-N 3.31Å; L420-I571 HydrophobicContact CD2-CD1 4.42Å; L420-I571 HydrophobicContact CD2-CG2 3.74Å; L420-F573 HydrophobicContact CD2-CZ 4.22Å; L420-V586 HydrophobicContact CD2-CG1 4.41Å; L420-V586 HydrophobicContact CD2-CG2 3.69Å; L420-V602 HydrophobicContact CD1-CB 4.26Å; L420-V602 HydrophobicContact CD1-CG1 3.81Å; L420-V602 HydrophobicContact CD1-CG2 4.46Å; L420-L610 HydrophobicContact CB-CD1 3.77Å; L420-L610 HydrophobicContact CD1-CD1 4.49Å; L420-F612 HydrophobicContact CD1-CZ 4.47Å
421	T	94.3	Very high	87.9	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-80.1	-21	179	52.5	0	0	0	0	112.6	L398 E417 Y418 Y419 F423 H424 L610 V622 V624 L627	L398-T421 HydrophobicContact CD1-CG2 4.05Å; L398-T421 WeakPolarHBondContact CD1-OG1 2.82Å; E417-T421 VanDerWaalsContact O-CG2 3.31Å; E417-T421 WeakPolarHBondContact O-CG2 3.44Å; E417-T421 PolarHBondContact O-N 2.74Å; E417-T421 VanDerWaalsContact O-N 3.1Å; E417-T421 PolarHBondContact O-OG1 2.86Å; Y418-T421 WeakPolarHBondContact CA-OG1 3.38Å; Y418-T421 PolarHBondContact O-N 3.07Å; Y418-T421 PolarHBondContact O-OG1 3.24Å; Y419-T421 PolarHBondContact O-N 3.39Å; T421-F423 VanDerWaalsContact C-N 3.32Å; T421-F423 PolarHBondContact O-N 3.12Å; T421-H424 PolarHBondContact O-CE1 2.82Å; T421-H424 PolarHBondContact O-ND1 3.28Å; T421-L610 HydrophobicContact CG2-CD1 4.48Å; T421-V622 HydrophobicContact CG2-CG1 4.19Å; T421-V624 HydrophobicContact CG2-CG1 4.07Å; T421-L627 HydrophobicContact CG2-CD1 3.7Å
422	S	92.4	Very high	87.1	Confident	6 Å²	6	26.3 Å²	26.3	4%	0.042	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-20.4	-175.7	66.5	0	0	0	0	116.2	F392 Y418 Y419	F392-S422 WeakPolarHBondContact CD1-O 3.36Å; F392-S422 WeakPolarHBondContact O-CB 3.16Å; Y418-S422 PolarHBondContact O-N 3.03Å; Y418-S422 VanDerWaalsContact O-N 3.12Å; Y419-S422 PolarHBondContact O-N 3.29Å; Y419-S422 PolarHBondContact O-OG 2.89Å
423	F	90.8	Very high	86.5	Confident	6 Å²	6	27.4 Å²	27.4	3%	0.026	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-27.9	-169	-67.5	-74.5	0	0	0	115.8	F392 Y419 T421 P539 L554 F573 W606	F392-F423 AromaticContact CE1-CD1 3.92Å; F392-F423 HydrophobicContact CE1-CD1 3.92Å; F392-F423 HydrophobicContact CE1-CE1 4.34Å; F392-F423 HydrophobicContact CZ-CD1 4.11Å; F392-F423 HydrophobicContact CZ-CE1 4.13Å; Y419-F423 AromaticContact CD1-CE2 3.84Å; Y419-F423 HydrophobicContact CD1-CE2 3.84Å; Y419-F423 HydrophobicContact CD1-CZ 4.38Å; Y419-F423 AromaticContact CE1-CE2 3.48Å; Y419-F423 HydrophobicContact CE1-CE2 3.48Å; Y419-F423 VanDerWaalsContact CE1-CE2 3.48Å; Y419-F423 AromaticContact CE1-CZ 3.67Å; Y419-F423 HydrophobicContact CE1-CZ 3.67Å; Y419-F423 HydrophobicContact CE2-CZ 4.21Å; Y419-F423 AromaticContact CZ-CE2 3.86Å; Y419-F423 AromaticContact CZ-CZ 3.55Å; Y419-F423 WeakPolarHBondContact O-CD2 3.22Å; Y419-F423 WeakPolarHBondContact O-CE2 3.32Å; T421-F423 VanDerWaalsContact C-N 3.32Å; T421-F423 PolarHBondContact O-N 3.12Å; F423-P539 HydrophobicContact CE1-CG 3.84Å; F423-P539 HydrophobicContact CZ-CG 3.96Å; F423-L554 HydrophobicContact CB-CD1 4.04Å; F423-L554 HydrophobicContact CD1-CD1 3.87Å; F423-L554 HydrophobicContact CG-CD1 3.9Å; F423-F573 HydrophobicContact CD2-CE1 4.28Å; F423-F573 AromaticContact CD2-CZ 3.99Å; F423-F573 HydrophobicContact CD2-CZ 3.99Å; F423-F573 HydrophobicContact CE2-CE1 4.43Å; F423-F573 AromaticContact CE2-CZ 3.71Å; F423-F573 HydrophobicContact CE2-CZ 3.71Å; F423-F573 HydrophobicContact CZ-CZ 4.31Å; F423-W606 HydrophobicContact CB-CE3 3.81Å; F423-W606 HydrophobicContact CB-CZ3 4.12Å
424	H	86.9	Confident	86.1	Confident	16 Å²	16	29.6 Å²	29.6	7%	0.074	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-38.1	-168	78	-61.7	0	0	0	112.8	H395 T421 R427 K428 N607 V624	H395-H424 AromaticContact CD2-CE1 3.86Å; H395-H424 AromaticContact CE1-CE1 3.98Å; H395-H424 AromaticContact NE2-CE1 3.03Å; H395-H424 PolarHBondContact NE2-CE1 2.81Å; H395-H424 AromaticContact NE2-ND1 3.99Å; H395-H424 AromaticContact NE2-NE2 3.8Å; T421-H424 PolarHBondContact O-CE1 2.82Å; T421-H424 PolarHBondContact O-ND1 3.28Å; H424-R427 CarbonylContact O-C 3.47Å; H424-R427 PolarHBondContact O-N 2.75Å; H424-K428 PolarHBondContact O-N 3.25Å; H424-N607 HydrophobicContact CB-CB 4.26Å; H424-V624 HydrophobicContact CB-CG2 3.99Å; H424-V624 PolarHBondContact NE2-O 3.21Å
425	E	82.9	Confident	85.8	Confident	25 Å²	25	26.9 Å²	26.9	12%	0.117	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-65	-46.8	176.5	-77.7	-54.9	121.6	0	0	112.5	S394 R427 K428 V629	S394-E425 WeakPolarHBondContact OG-CB 3.42Å; S394-E425 WeakPolarHBondContact OG-CG 3.44Å; E425-R427 PolarHBondContact O-N 3.2Å; E425-K428 PolarHBondContact O-N 3.3Å; E425-K428 WeakPolarHBondContact OE1-CE 3.37Å; E425-K428 IonicContact OE1-NZ 3.67Å; E425-K428 PolarHBondContact OE1-NZ 2.7Å; E425-K428 WeakPolarHBondContact OE2-CD 3.32Å; E425-K428 WeakPolarHBondContact OE2-CE 3.35Å; E425-K428 IonicContact OE2-NZ 2.7Å; E425-K428 PolarHBondContact OE2-NZ 3.48Å; E425-V629 HydrophobicContact CG-CG1 4.13Å; E425-V629 HydrophobicContact CG-CG2 3.85Å; E425-V629 VanDerWaalsContact OE1-CG2 3.32Å; E425-V629 WeakPolarHBondContact OE1-CG2 3.27Å
426	G	74.1	Confident	85.5	Confident	4 Å²	4	26.8 Å²	26.8	4%	0.041	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-63.4	-5.9	178.7	0	0	0	0	0	114.1
427	R	73.3	Confident	85.2	Confident	55 Å²	55	31.2 Å²	31.2	21%	0.208	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-136.3	28.1	-175.4	-61.9	-64.5	-176.5	-170	-3.1	113.7	H424 E425 G429 W606	H424-R427 CarbonylContact O-C 3.47Å; H424-R427 PolarHBondContact O-N 2.75Å; E425-R427 PolarHBondContact O-N 3.2Å; R427-G429 PolarHBondContact O-N 3.17Å; R427-W606 HydrophobicContact CB-CH2 4.1Å; R427-W606 HydrophobicContact CB-CZ3 4.26Å; R427-W606 HydrophobicContact CG-CH2 4.44Å
428	K	65.6	Low	85.1	Confident	142 Å²	142	30.8 Å²	30.8	62%	0.617	17%	0.173	S	C	*	.			trans	-58.1	-27.7	178.9	-87.6	179.2	154.2	163.2	0	115.5	H424 E425	H424-K428 PolarHBondContact O-N 3.25Å; E425-K428 PolarHBondContact O-N 3.3Å; E425-K428 WeakPolarHBondContact OE1-CE 3.37Å; E425-K428 IonicContact OE1-NZ 3.67Å; E425-K428 PolarHBondContact OE1-NZ 2.7Å; E425-K428 WeakPolarHBondContact OE2-CD 3.32Å; E425-K428 WeakPolarHBondContact OE2-CE 3.35Å; E425-K428 IonicContact OE2-NZ 2.7Å; E425-K428 PolarHBondContact OE2-NZ 3.48Å
429	G	64.5	Low	84.9	Confident	44 Å²	44	30.9 Å²	30.9	45%	0.454	18%	0.175	S	C	.	.			trans	-67.6	131.2	-179	0	0	0	0	0	112.7	R427 I431	R427-G429 PolarHBondContact O-N 3.17Å; G429-I431 PolarHBondContact O-N 3.33Å
430	A	65.2	Low	84.7	Confident	87 Å²	87	31.1 Å²	31.1	72%	0.719	18%	0.177	S	C	*	.	S	Bend	trans	-64.8	-23.3	172	0	0	0	0	0	112.4
431	I	79.1	Confident	84.6	Confident	21 Å²	21	31.2 Å²	31.2	11%	0.108	18%	0.178	C	C	.	.	S	Bend	trans	-103.2	129.5	-178.7	-53.6	178.4	0	0	0	109.2	D346 L347 G429 K433 V549 P550	D346-I431 WeakPolarHBondContact O-CD1 3.36Å; L347-I431 HydrophobicContact CD2-CD1 3.72Å; L347-I431 HydrophobicContact CD2-CG1 4.18Å; L347-I431 HydrophobicContact CG-CD1 4.04Å; G429-I431 PolarHBondContact O-N 3.33Å; I431-K433 PolarHBondContact O-N 2.91Å; I431-K433 VanDerWaalsContact O-N 3.14Å; I431-V549 HydrophobicContact CG1-CG1 3.94Å; I431-P550 CarbonylContact C-O 3.57Å; I431-P550 WeakPolarHBondContact CA-O 3.46Å; I431-P550 HydrophobicContact CG2-CG 4.01Å
432	A	82.4	Confident	84.7	Confident	16 Å²	16	31.3 Å²	31.3	13%	0.132	18%	0.178	C	C	.	.			trans	-71.2	108.8	173	0	0	0	0	0	110.4	P550 V552	A432-P550 HydrophobicContact CB-CB 4.07Å; A432-P550 HydrophobicContact CB-CG 4.46Å; A432-P550 PolarHBondContact N-O 2.95Å; A432-V552 HydrophobicContact CB-CG2 3.47Å; A432-V552 VanDerWaalsContact CB-CG2 3.47Å
433	K	85.5	Confident	84.9	Confident	23 Å²	23	31 Å²	31	10%	0.1	18%	0.176	C	C	.	.			trans	-105.2	161.7	167	-62.6	-168.3	-179.7	-174.2	0	111.1	E344 D346 I379 E381 I431	E344-K433 VanDerWaalsContact CD-NZ 3.35Å; E344-K433 WeakPolarHBondContact OE1-CD 3.42Å; E344-K433 WeakPolarHBondContact OE1-CE 3.01Å; E344-K433 IonicContact OE1-NZ 3.32Å; E344-K433 PolarHBondContact OE1-NZ 3.12Å; E344-K433 VanDerWaalsContact OE2-CE 3.31Å; E344-K433 WeakPolarHBondContact OE2-CE 3.29Å; E344-K433 IonicContact OE2-NZ 3.12Å; E344-K433 PolarHBondContact OE2-NZ 3.23Å; D346-K433 WeakPolarHBondContact OD2-CE 3.34Å; D346-K433 IonicContact OD2-NZ 3.79Å; D346-K433 PolarHBondContact OD2-NZ 2.97Å; I379-K433 WeakPolarHBondContact O-CA 3.44Å; E381-K433 HydrophobicContact CB-CB 3.88Å; E381-K433 HydrophobicContact CG-CB 4.41Å; I431-K433 PolarHBondContact O-N 2.91Å; I431-K433 VanDerWaalsContact O-N 3.14Å
434	K	87.7	Confident	85.2	Confident	54 Å²	54	30.8 Å²	30.8	24%	0.235	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	126.4	178.6	-172.6	-170.2	157.3	-67.5	0	109.5	L375 I379 L380 E381 N437	L375-K434 HydrophobicContact CD1-CD 3.58Å; I379-K434 PolarHBondContact O-N 3.46Å; L380-K434 CarbonylContact C-O 3.48Å; L380-K434 VanDerWaalsContact CA-O 3.25Å; L380-K434 WeakPolarHBondContact CA-O 3.37Å; L380-K434 HydrophobicContact CD2-CB 4.45Å; L380-K434 WeakPolarHBondContact CD2-O 3.46Å; E381-K434 PolarHBondContact N-O 3.37Å; K434-N437 VanDerWaalsContact CE-OD1 3.27Å; K434-N437 WeakPolarHBondContact CE-OD1 3.39Å; K434-N437 VanDerWaalsContact NZ-CG 3.27Å; K434-N437 PolarHBondContact NZ-OD1 2.87Å
435	P	91.6	Very high	85.6	Confident	12 Å²	12	30.5 Å²	30.5	8%	0.078	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	163.1	173.9	30.7	-38.6	0	0	0	111.5	R383 L385 M388 N437	R383-P435 WeakPolarHBondContact O-CA 3.38Å; L385-P435 HydrophobicContact CB-CB 4.22Å; L385-P435 HydrophobicContact CB-CG 4.01Å; L385-P435 HydrophobicContact CD1-CG 4.42Å; L385-P435 HydrophobicContact CG-CG 4.45Å; M388-P435 HydrophobicContact CB-CB 4.48Å; M388-P435 HydrophobicContact SD-CB 4.38Å; M388-P435 HydrophobicContact SD-CG 3.78Å; P435-N437 PolarHBondContact O-N 3.37Å
436	Y	92.8	Very high	86.2	Confident	2 Å²	2	29.3 Å²	29.3	1%	0.008	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	136.8	171.7	-48.7	-41.7	0	0	0	109.7	L380 E381 K382 R383 L385 P438 W649 V652 T653 L656	L380-Y436 HydrophobicContact CB-CD1 4.23Å; L380-Y436 HydrophobicContact CB-CE1 3.93Å; L380-Y436 HydrophobicContact CD1-CD1 4.08Å; L380-Y436 HydrophobicContact CD1-CE1 4.11Å; E381-Y436 WeakPolarHBondContact O-CE1 3.43Å; E381-Y436 VanDerWaalsContact O-CZ 3.27Å; K382-Y436 WeakPolarHBondContact CA-OH 3.45Å; R383-Y436 WeakPolarHBondContact O-CD2 3.39Å; R383-Y436 PolarHBondContact O-N 3.44Å; L385-Y436 PolarHBondContact N-O 2.92Å; L385-Y436 VanDerWaalsContact N-O 3.11Å; Y436-P438 WeakPolarHBondContact O-CD 3.42Å; Y436-W649 HydrophobicContact CD1-CE3 4.45Å; Y436-W649 HydrophobicContact CD2-CB 3.72Å; Y436-W649 AromaticContact CD2-CD1 4Å; Y436-W649 AromaticContact CD2-CD2 3.6Å; Y436-W649 HydrophobicContact CD2-CD2 3.6Å; Y436-W649 AromaticContact CD2-CE3 3.95Å; Y436-W649 HydrophobicContact CD2-CE3 3.95Å; Y436-W649 AromaticContact CD2-CG 3.49Å; Y436-W649 HydrophobicContact CD2-CG 3.49Å; Y436-W649 VanDerWaalsContact CD2-CG 3.49Å; Y436-W649 HydrophobicContact CE2-CB 3.72Å; Y436-W649 HydrophobicContact CE2-CD2 4.3Å; Y436-W649 HydrophobicContact CE2-CE3 4.42Å; Y436-W649 HydrophobicContact CE2-CG 4.02Å; Y436-W649 AromaticContact CG-CD2 3.89Å; Y436-W649 HydrophobicContact CG-CD2 3.89Å; Y436-W649 AromaticContact CG-CE3 3.97Å; Y436-W649 HydrophobicContact CG-CE3 3.97Å; Y436-W649 HydrophobicContact CG-CG 4.26Å; Y436-W649 HydrophobicContact CG-CZ3 4.41Å; Y436-V652 HydrophobicContact CE1-CG1 3.95Å; Y436-T653 PolarHBondContact OH-OG1 3.32Å; Y436-L656 HydrophobicContact CE1-CD1 4.03Å; Y436-L656 VanDerWaalsContact OH-CD1 3.29Å; Y436-L656 WeakPolarHBondContact OH-CD1 3.37Å
437	N	92	Very high	87.3	Confident	92 Å²	92	29.1 Å²	29.1	49%	0.492	17%	0.167	S	C	.	.	P	Polyproline II helix	trans	-71.9	118.5	171.7	-76.6	-14.8	0	0	0	107	K434 P435 W649	K434-N437 VanDerWaalsContact CE-OD1 3.27Å; K434-N437 WeakPolarHBondContact CE-OD1 3.39Å; K434-N437 VanDerWaalsContact NZ-CG 3.27Å; K434-N437 PolarHBondContact NZ-OD1 2.87Å; P435-N437 PolarHBondContact O-N 3.37Å; N437-W649 WeakPolarHBondContact O-CZ2 3.1Å
438	P	94.4	Very high	88.3	Confident	11 Å²	11	26.7 Å²	26.7	7%	0.071	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-64.8	143.1	-176.9	-17.2	29.5	0	0	0	110.8	L385 L386 Y436 E442 Q479	L385-P438 HydrophobicContact CB-CG 3.74Å; L385-P438 HydrophobicContact CD2-CG 4.38Å; L386-P438 HydrophobicContact CD1-CB 4.28Å; L386-P438 HydrophobicContact CD2-CB 4.24Å; L386-P438 HydrophobicContact CD2-CG 3.94Å; L386-P438 HydrophobicContact CG-CB 3.94Å; L386-P438 HydrophobicContact CG-CG 3.81Å; Y436-P438 WeakPolarHBondContact O-CD 3.42Å; P438-E442 WeakPolarHBondContact CA-OE2 3.39Å; P438-E442 HydrophobicContact CB-CB 4.34Å; P438-Q479 HydrophobicContact CB-CB 3.92Å; P438-Q479 HydrophobicContact CB-CG 4.05Å; P438-Q479 VanDerWaalsContact CB-OE1 3.3Å
439	I	93.4	Very high	89.6	Confident	24 Å²	24	26.1 Å²	26.1	12%	0.123	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-84.2	154.2	172.7	67.5	174.9	0	0	0	110	G441 E442 Q479 L648 W649 Q675	I439-G441 PolarHBondContact O-N 2.8Å; I439-E442 HydrophobicContact CG1-CB 3.99Å; I439-E442 PolarHBondContact N-OE2 2.99Å; I439-E442 VanDerWaalsContact N-OE2 3.13Å; I439-E442 WeakPolarHBondContact O-CB 3.26Å; I439-E442 PolarHBondContact O-N 3.08Å; I439-Q479 WeakPolarHBondContact O-CB 3.4Å; I439-Q479 WeakPolarHBondContact O-CG 3.34Å; I439-L648 HydrophobicContact CD1-CD1 3.8Å; I439-L648 HydrophobicContact CD1-CD2 3.45Å; I439-L648 VanDerWaalsContact CD1-CD2 3.45Å; I439-L648 HydrophobicContact CD1-CG 4.2Å; I439-L648 HydrophobicContact CG1-CD2 3.6Å; I439-W649 HydrophobicContact CG2-CZ2 4.18Å; I439-Q675 HydrophobicContact CB-CG 4.38Å
440	I	93.8	Very high	90.9	Very high	13 Å²	13	24 Å²	24	7%	0.067	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	130	177.4	-173.6	69.7	0	0	0	110.9	E442 H482 Q675 W689	I440-E442 VanDerWaalsContact C-N 3.27Å; I440-E442 PolarHBondContact O-N 3.4Å; I440-H482 HydrophobicContact CB-CB 4.4Å; I440-Q675 HydrophobicContact CG2-CG 4.24Å; I440-W689 HydrophobicContact CD1-CG 4.05Å; I440-W689 HydrophobicContact CG1-CB 4.39Å; I440-W689 HydrophobicContact CG1-CD2 3.69Å; I440-W689 HydrophobicContact CG1-CE3 4.36Å; I440-W689 HydrophobicContact CG1-CG 3.66Å
441	G	93.1	Very high	91.9	Very high	3 Å²	3	22.8 Å²	22.8	3%	0.031	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	-2.3	-176.8	0	0	0	0	0	115.9	I439 Q479	I439-G441 PolarHBondContact O-N 2.8Å; G441-Q479 PolarHBondContact N-O 2.93Å
442	E	96.9	Very high	92	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.005	13%	0.125	C	C	.	.			trans	-61.8	138.5	170.4	-172	-177	138.4	0	0	110.1	S384 L386 P438 I439 I440 E478 Q479 T643 S645 L648 W649	S384-E442 WeakPolarHBondContact CB-OE1 3.17Å; S384-E442 PolarHBondContact OG-OE1 2.77Å; L386-E442 HydrophobicContact CD1-CB 4.08Å; L386-E442 HydrophobicContact CD1-CG 3.88Å; L386-E442 VanDerWaalsContact CD1-O 3.26Å; L386-E442 WeakPolarHBondContact CD1-O 3.4Å; P438-E442 WeakPolarHBondContact CA-OE2 3.39Å; P438-E442 HydrophobicContact CB-CB 4.34Å; I439-E442 HydrophobicContact CG1-CB 3.99Å; I439-E442 PolarHBondContact N-OE2 2.99Å; I439-E442 VanDerWaalsContact N-OE2 3.13Å; I439-E442 WeakPolarHBondContact O-CB 3.26Å; I439-E442 PolarHBondContact O-N 3.08Å; I440-E442 VanDerWaalsContact C-N 3.27Å; I440-E442 PolarHBondContact O-N 3.4Å; E442-E478 CarbonylContact O-C 3.54Å; E442-E478 VanDerWaalsContact O-CA 3.29Å; E442-E478 WeakPolarHBondContact O-CA 3.43Å; E442-Q479 HydrophobicContact CB-CB 4.36Å; E442-Q479 PolarHBondContact O-N 3.28Å; E442-T643 WeakPolarHBondContact CA-O 3.43Å; E442-S645 VanDerWaalsContact OE1-CB 3.31Å; E442-S645 WeakPolarHBondContact OE1-CB 3.45Å; E442-S645 PolarHBondContact OE1-OG 3.27Å; E442-L648 HydrophobicContact CB-CD2 4.23Å; E442-L648 HydrophobicContact CG-CD2 3.74Å; E442-L648 WeakPolarHBondContact OE2-CD2 3.44Å; E442-W649 PolarHBondContact OE2-NE1 3.23Å
443	T	97.3	Very high	91.2	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	150.2	-178.5	55	0	0	0	0	111.6	A477 E478 T643 E644 S645 Y693	T443-A477 CarbonylContact C-O 3.58Å; T443-A477 VanDerWaalsContact CA-O 3.25Å; T443-A477 WeakPolarHBondContact CA-O 3.32Å; T443-E478 HydrophobicContact CG2-CB 4.36Å; T443-E478 HydrophobicContact CG2-CG 4.1Å; T443-T643 PolarHBondContact N-O 2.76Å; T443-E644 CarbonylContact O-C 3.58Å; T443-E644 WeakPolarHBondContact O-CA 3.47Å; T443-S645 PolarHBondContact O-N 3.45Å; T443-S645 PolarHBondContact O-OG 2.86Å; T443-Y693 HydrophobicContact CG2-CD2 4Å; T443-Y693 HydrophobicContact CG2-CE2 3.75Å
444	F	97.1	Very high	89.6	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.009	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	135.3	170.1	-176	-100.7	0	0	0	110.4	L386 E387 A390 C446 F475 V476 A477 K632 V634	L386-F444 HydrophobicContact CB-CB 3.8Å; E387-F444 HydrophobicContact CB-CD1 4.29Å; E387-F444 HydrophobicContact CB-CD2 3.85Å; E387-F444 HydrophobicContact CB-CE1 4.16Å; E387-F444 HydrophobicContact CB-CE2 3.71Å; E387-F444 HydrophobicContact CB-CG 4.14Å; E387-F444 HydrophobicContact CB-CZ 3.88Å; E387-F444 HydrophobicContact CG-CD2 4.32Å; E387-F444 HydrophobicContact CG-CE1 4.09Å; E387-F444 HydrophobicContact CG-CE2 3.66Å; E387-F444 HydrophobicContact CG-CZ 3.53Å; A390-F444 HydrophobicContact CB-CD1 4.34Å; A390-F444 HydrophobicContact CB-CE1 3.75Å; F444-C446 HydrophobicContact CE1-CB 3.96Å; F444-C446 HydrophobicContact CZ-CB 4.24Å; F444-F475 HydrophobicContact CD1-CD1 4.11Å; F444-F475 AromaticContact CD1-CE1 3.89Å; F444-F475 HydrophobicContact CD1-CE1 3.89Å; F444-F475 HydrophobicContact CE1-CE1 4.49Å; F444-V476 WeakPolarHBondContact O-CA 3.31Å; F444-A477 HydrophobicContact CB-CB 4.35Å; F444-A477 PolarHBondContact N-O 3.25Å; F444-A477 PolarHBondContact O-N 3.46Å; F444-K632 HydrophobicContact CZ-CD 4.47Å; F444-V634 HydrophobicContact CE2-CG1 4.38Å; F444-V634 HydrophobicContact CZ-CG2 4.16Å
445	H	95.8	Very high	87.6	Confident	9 Å²	9	37 Å²	37	4%	0.042	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	135.9	-178.8	-65.7	-90.2	0	0	0	110	V330 F475 V476 Y693	V330-H445 HydrophobicContact CG2-CB 4.39Å; H445-F475 WeakPolarHBondContact CA-O 3.5Å; H445-V476 VanDerWaalsContact CE1-CG1 3.49Å; H445-V476 WeakPolarHBondContact CE1-CG1 3.44Å; H445-Y693 AromaticContact CE1-CE1 3.83Å; H445-Y693 AromaticContact CE1-CE2 3.58Å; H445-Y693 AromaticContact CE1-CZ 3.31Å; H445-Y693 PolarHBondContact CE1-OH 3.22Å; H445-Y693 VanDerWaalsContact CE1-OH 3.3Å; H445-Y693 AromaticContact NE2-CE2 3.34Å; H445-Y693 VanDerWaalsContact NE2-CE2 3.34Å; H445-Y693 WeakPolarHBondContact NE2-CE2 3.43Å; H445-Y693 AromaticContact NE2-CZ 3.38Å; H445-Y693 PolarHBondContact NE2-OH 2.6Å
446	C	95.6	Very high	85.5	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	167.1	169.2	63.9	0	0	0	0	111.5	E335 F444 W448 F475 K632 R633 V634	E335-C446 WeakPolarHBondContact OE1-CA 3.37Å; F444-C446 HydrophobicContact CE1-CB 3.96Å; F444-C446 HydrophobicContact CZ-CB 4.24Å; C446-W448 WeakPolarHBondContact SG-CH2 3.32Å; C446-F475 PolarHBondContact N-O 2.89Å; C446-F475 PolarHBondContact O-N 3.47Å; C446-K632 HydrophobicContact CB-CB 4.23Å; C446-R633 CarbonylContact C-O 3.56Å; C446-R633 WeakPolarHBondContact CA-O 3.08Å; C446-R633 WeakPolarHBondContact CB-O 3.36Å; C446-V634 HydrophobicContact CB-CG2 3.99Å
447	S	95.9	Very high	83.3	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.007	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	166.5	170.5	75.9	0	0	0	0	113.5	E335 V473 K632 R633	E335-S447 WeakPolarHBondContact OE2-CB 3.21Å; E335-S447 PolarHBondContact OE2-OG 2.89Å; S447-V473 CarbonylContact C-O 3.59Å; S447-V473 WeakPolarHBondContact CA-O 3.33Å; S447-V473 VanDerWaalsContact CB-O 3.31Å; S447-V473 WeakPolarHBondContact CB-O 3.32Å; S447-K632 CarbonylContact O-C 3.6Å; S447-R633 PolarHBondContact N-O 2.97Å; S447-R633 WeakPolarHBondContact O-CB 3.5Å; S447-R633 PolarHBondContact O-N 3.5Å
448	W	94.6	Very high	80.8	Confident	4 Å²	4	49 Å²	49	2%	0.015	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	143	168.2	-62	-103.9	0	0	0	109.3	A390 M393 P396 C446 V450 V473 F475 T630 K632	A390-W448 HydrophobicContact CB-CH2 4.1Å; A390-W448 HydrophobicContact CB-CZ2 4.39Å; A390-W448 WeakPolarHBondContact O-CZ2 3.17Å; M393-W448 HydrophobicContact CB-CE3 4.5Å; M393-W448 HydrophobicContact CB-CH2 3.61Å; M393-W448 HydrophobicContact CB-CZ2 3.66Å; M393-W448 HydrophobicContact CB-CZ3 4.05Å; M393-W448 HydrophobicContact CG-CD2 4.07Å; M393-W448 HydrophobicContact CG-CE3 3.88Å; M393-W448 HydrophobicContact CG-CH2 3.89Å; M393-W448 HydrophobicContact CG-CZ2 4.06Å; M393-W448 HydrophobicContact CG-CZ3 3.8Å; M393-W448 PolarHBondContact O-NE1 2.9Å; P396-W448 HydrophobicContact CB-CB 4.14Å; P396-W448 HydrophobicContact CB-CG 4.28Å; P396-W448 HydrophobicContact CG-CB 3.96Å; P396-W448 HydrophobicContact CG-CG 4.03Å; C446-W448 WeakPolarHBondContact SG-CH2 3.32Å; W448-V450 HydrophobicContact CB-CG2 4.44Å; W448-V473 HydrophobicContact CB-CB 4.4Å; W448-V473 HydrophobicContact CE3-CB 4.3Å; W448-V473 HydrophobicContact CE3-CG1 4.14Å; W448-V473 PolarHBondContact N-O 2.87Å; W448-V473 PolarHBondContact O-N 2.89Å; W448-F475 HydrophobicContact CH2-CB 3.93Å; W448-F475 HydrophobicContact CH2-CG 4.31Å; W448-F475 HydrophobicContact CZ3-CB 3.52Å; W448-F475 HydrophobicContact CZ3-CG 4.36Å; W448-T630 HydrophobicContact CB-CG2 4.43Å; W448-T630 PolarHBondContact NE1-O 2.71Å; W448-K632 HydrophobicContact CD2-CB 4.42Å; W448-K632 HydrophobicContact CH2-CB 4.46Å; W448-K632 HydrophobicContact CZ2-CB 3.61Å
449	R	92.6	Very high	78.3	Confident	129 Å²	129	52 Å²	52	49%	0.487	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	112.4	168.5	-67.5	-177	178.9	-164.8	-3.4	107.8	P470	R449-P470 HydrophobicContact CB-CB 4.17Å; R449-P470 HydrophobicContact CB-CG 4.15Å; R449-P470 HydrophobicContact CG-CG 4.49Å
450	V	91.4	Very high	76	Confident	1 Å²	1	60 Å²	60	1%	0.006	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	120.6	-175.4	-169.4	0	0	0	0	109.1	P396 E397 V400 W448 P470 Y471 V473	P396-V450 HydrophobicContact CB-CG2 3.6Å; P396-V450 HydrophobicContact CG-CG2 3.78Å; E397-V450 HydrophobicContact CB-CG1 3.96Å; V400-V450 HydrophobicContact CG2-CG1 3.98Å; W448-V450 HydrophobicContact CB-CG2 4.44Å; V450-P470 CarbonylContact O-C 3.57Å; V450-P470 VanDerWaalsContact O-CA 3.23Å; V450-P470 WeakPolarHBondContact O-CA 3.38Å; V450-P470 VanDerWaalsContact O-CB 3.24Å; V450-P470 WeakPolarHBondContact O-CB 3.31Å; V450-Y471 PolarHBondContact N-O 2.64Å; V450-Y471 PolarHBondContact O-N 3.01Å; V450-V473 HydrophobicContact CG2-CG2 3.81Å
451	P	86.5	Confident	73.5	Confident	60 Å²	60	64 Å²	64	39%	0.39	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-56.9	141.7	178.1	-23.8	33.3	0	0	0	112.4	A456	P451-A456 HydrophobicContact CB-CB 3.86Å
452	R	81.6	Confident	71.3	Confident	87 Å²	87	73.1 Å²	73.1	33%	0.328	41%	0.411	S	S	.	.	S	Bend	trans	-85.1	117.4	172.8	-60	-158.3	-172.4	175.5	5.7	109.9	P468 E469 Y471	R452-P468 HydrophobicContact CB-CB 4.4Å; R452-P468 HydrophobicContact CB-CG 4.11Å; R452-E469 VanDerWaalsContact CD-O 3.26Å; R452-E469 WeakPolarHBondContact CD-O 3.39Å; R452-E469 VanDerWaalsContact CG-O 3.32Å; R452-E469 WeakPolarHBondContact CG-O 3.38Å; R452-E469 VanDerWaalsContact CZ-O 3.26Å; R452-E469 PolarHBondContact NE-O 3.39Å; R452-E469 PolarHBondContact NH2-O 3Å; R452-Y471 HydrophobicContact CB-CE2 4.23Å; R452-Y471 HydrophobicContact CG-CD1 4.22Å; R452-Y471 HydrophobicContact CG-CD2 3.9Å; R452-Y471 HydrophobicContact CG-CE1 3.99Å; R452-Y471 HydrophobicContact CG-CE2 3.65Å; R452-Y471 HydrophobicContact CG-CG 4.17Å
453	G	65.3	Low	69.1	Low	47 Å²	47	77 Å²	77	49%	0.485	44%	0.438	S	S	.	.	S	Bend	trans	86.5	161	172.6	0	0	0	0	0	115.4	E455	G453-E455 VanDerWaalsContact C-N 3.29Å; G453-E455 PolarHBondContact O-N 2.79Å
454	P	53.2	Low	66.7	Low	106 Å²	106	83.6 Å²	83.6	69%	0.688	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-73.1	-16.3	-178.1	27.6	-32.8	0	0	0	114.1
455	E	45.8	Very low	64.8	Low	174 Å²	174	89.3 Å²	89.3	81%	0.813	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-76.9	-18.4	-176.1	-65.5	-179.5	171	0	0	113.6	G453 L457	G453-E455 VanDerWaalsContact C-N 3.29Å; G453-E455 PolarHBondContact O-N 2.79Å; E455-L457 VanDerWaalsContact C-N 3.28Å; E455-L457 PolarHBondContact O-N 3.49Å
456	A	46.2	Very low	63	Low	67 Å²	67	97.7 Å²	97.7	55%	0.554	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-76.8	-12.7	178.8	0	0	0	0	0	113.9	P451	P451-A456 HydrophobicContact CB-CB 3.86Å
457	L	46.6	Very low	61.2	Low	130 Å²	130	101.8 Å²	101.8	68%	0.681	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-95.4	-5.5	-179.9	-70.6	165.6	0	0	0	113.2	E455	E455-L457 VanDerWaalsContact C-N 3.28Å; E455-L457 PolarHBondContact O-N 3.49Å
458	Q	40.5	Very low	60.2	Low	159 Å²	159	105.7 Å²	105.7	74%	0.743	61%	0.614	S	S	*	*	S	Bend	trans	-117.5	119.6	176	-66.1	179.3	30.4	0	0	108.2
459	G	40.9	Very low	59.6	Low	75 Å²	75	112.9 Å²	112.9	77%	0.773	65%	0.648	S	S	*	*			trans	-58.2	155.7	-167.5	0	0	0	0	0	116.3
460	E	45.7	Very low	59.4	Low	192 Å²	192	109.4 Å²	109.4	90%	0.897	64%	0.642	S	S	*	*			trans	57	73.3	160.9	-62.5	-177.7	175.7	0	0	116.8
461	A	41.6	Very low	59.4	Low	96 Å²	96	110.8 Å²	110.8	79%	0.793	65%	0.647	S	S	*	*			trans	-81.7	108.7	154.9	0	0	0	0	0	109.9	S463	A461-S463 PolarHBondContact O-N 2.79Å
462	E	46.2	Very low	59.7	Low	195 Å²	195	111 Å²	111	91%	0.911	64%	0.643	S	S	*	*			trans	-68.8	72.6	167.6	-69.8	-177.6	150.1	0	0	110.6
463	S	50.4	Low	60.4	Low	82 Å²	82	106.9 Å²	106.9	57%	0.573	63%	0.628	S	S	*	*	S	Bend	trans	-157.2	136.6	159.8	-29.4	0	0	0	0	111.3	A461 V465	A461-S463 PolarHBondContact O-N 2.79Å; S463-V465 PolarHBondContact O-N 3.25Å
464	P	47.5	Very low	61.8	Low	140 Å²	140	108.2 Å²	108.2	91%	0.909	62%	0.618	S	S	*	*			trans	-83.2	52.8	179.1	36.5	-34.7	0	0	0	111
465	V	57	Low	63.9	Low	121 Å²	121	103.7 Å²	103.7	73%	0.733	59%	0.588	S	S	*	*			trans	-87.2	119.1	163.9	-172.4	0	0	0	0	105.2	S463 A467	S463-V465 PolarHBondContact O-N 3.25Å; V465-A467 PolarHBondContact O-N 3.32Å
466	E	57.4	Low	66.4	Low	186 Å²	186	95.4 Å²	95.4	87%	0.869	55%	0.549	S	S	*	.			trans	-46.5	113.7	178.4	-72.7	176.8	164.1	0	0	109.3
467	A	59.4	Low	68.8	Low	86 Å²	86	92.2 Å²	92.2	71%	0.711	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-57.6	130.8	-180	0	0	0	0	0	107.9	V465 E469	V465-A467 PolarHBondContact O-N 3.32Å; A467-E469 PolarHBondContact O-N 3.45Å
468	P	73.3	Confident	71.3	Confident	83 Å²	83	86.2 Å²	86.2	54%	0.539	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-60	133	-177	23.8	-32.9	0	0	0	109.9	R452	R452-P468 HydrophobicContact CB-CB 4.4Å; R452-P468 HydrophobicContact CB-CG 4.11Å
469	E	81.6	Confident	74	Confident	154 Å²	154	78.7 Å²	78.7	72%	0.72	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-53.3	134.8	-176.9	-73.4	-170.4	154.4	0	0	111	R452 A467	R452-E469 VanDerWaalsContact CD-O 3.26Å; R452-E469 WeakPolarHBondContact CD-O 3.39Å; R452-E469 VanDerWaalsContact CG-O 3.32Å; R452-E469 WeakPolarHBondContact CG-O 3.38Å; R452-E469 VanDerWaalsContact CZ-O 3.26Å; R452-E469 PolarHBondContact NE-O 3.39Å; R452-E469 PolarHBondContact NH2-O 3Å; A467-E469 PolarHBondContact O-N 3.45Å
470	P	88.9	Confident	76.6	Confident	56 Å²	56	75.3 Å²	75.3	36%	0.364	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-58.6	149.3	-179.9	26	-34.2	0	0	0	111.1	R449 V450	R449-P470 HydrophobicContact CB-CB 4.17Å; R449-P470 HydrophobicContact CB-CG 4.15Å; R449-P470 HydrophobicContact CG-CG 4.49Å; V450-P470 CarbonylContact O-C 3.57Å; V450-P470 VanDerWaalsContact O-CA 3.23Å; V450-P470 WeakPolarHBondContact O-CA 3.38Å; V450-P470 VanDerWaalsContact O-CB 3.24Å; V450-P470 WeakPolarHBondContact O-CB 3.31Å
471	Y	92.4	Very high	78.8	Confident	31 Å²	31	67.4 Å²	67.4	12%	0.122	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	140.6	169.2	-59.4	-59.7	0	0	0	110	V400 V450 R452 E495 R496	V400-Y471 HydrophobicContact CG2-CD2 4.32Å; V450-Y471 PolarHBondContact N-O 2.64Å; V450-Y471 PolarHBondContact O-N 3.01Å; R452-Y471 HydrophobicContact CB-CE2 4.23Å; R452-Y471 HydrophobicContact CG-CD1 4.22Å; R452-Y471 HydrophobicContact CG-CD2 3.9Å; R452-Y471 HydrophobicContact CG-CE1 3.99Å; R452-Y471 HydrophobicContact CG-CE2 3.65Å; R452-Y471 HydrophobicContact CG-CG 4.17Å; Y471-E495 HydrophobicContact CD1-CB 3.85Å; Y471-E495 HydrophobicContact CE1-CB 4.28Å; Y471-R496 HydrophobicContact CD1-CG 4.16Å; Y471-R496 HydrophobicContact CE1-CG 4.16Å; Y471-R496 VanDerWaalsContact CE2-NE 3.26Å; Y471-R496 HydrophobicContact CG-CG 4.42Å; Y471-R496 VanDerWaalsContact OH-CZ 3.24Å; Y471-R496 PolarHBondContact OH-NE 3.08Å
472	Q	92.8	Very high	80.8	Confident	65 Å²	65	65.1 Å²	65.1	30%	0.304	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	115.9	175.8	-170.1	169	19.6	0	0	111	E495	Q472-E495 PolarHBondContact N-OE1 3.18Å
473	V	95.6	Very high	82.6	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	119.3	171	-178.3	0	0	0	0	108.3	M393 P396 F399 V400 S447 W448 V450 E492 C493	M393-V473 HydrophobicContact CE-CG1 4.45Å; M393-V473 HydrophobicContact CG-CG1 4.24Å; M393-V473 HydrophobicContact SD-CG1 4.21Å; P396-V473 HydrophobicContact CB-CG2 4.27Å; F399-V473 HydrophobicContact CD1-CG1 4.39Å; F399-V473 HydrophobicContact CD1-CG2 4.47Å; F399-V473 HydrophobicContact CE1-CG1 4.41Å; V400-V473 HydrophobicContact CG1-CG2 3.76Å; S447-V473 CarbonylContact C-O 3.59Å; S447-V473 WeakPolarHBondContact CA-O 3.33Å; S447-V473 VanDerWaalsContact CB-O 3.31Å; S447-V473 WeakPolarHBondContact CB-O 3.32Å; W448-V473 HydrophobicContact CB-CB 4.4Å; W448-V473 HydrophobicContact CE3-CB 4.3Å; W448-V473 HydrophobicContact CE3-CG1 4.14Å; W448-V473 PolarHBondContact N-O 2.87Å; W448-V473 PolarHBondContact O-N 2.89Å; V450-V473 HydrophobicContact CG2-CG2 3.81Å; V473-E492 WeakPolarHBondContact CA-O 3.43Å; V473-C493 HydrophobicContact CG2-CB 4.27Å
474	R	95.6	Very high	84.2	Confident	74 Å²	74	61.4 Å²	61.4	28%	0.279	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	141.6	178.2	-174.6	170.4	68.4	101.1	-2.3	110.1	A491 E492 Y703	R474-A491 CarbonylContact O-C 3.54Å; R474-A491 WeakPolarHBondContact O-CA 3.39Å; R474-A491 WeakPolarHBondContact O-CB 3.22Å; R474-E492 HydrophobicContact CB-CG 4.3Å; R474-E492 IonicContact CZ-OE1 2.59Å; R474-E492 VanDerWaalsContact CZ-OE1 3.29Å; R474-E492 PolarHBondContact N-O 3.03Å; R474-E492 IonicContact NE-OE1 3.6Å; R474-E492 PolarHBondContact NE-OE1 2.88Å; R474-E492 VanDerWaalsContact NE-OE1 3.14Å; R474-E492 VanDerWaalsContact NH2-CD 3.35Å; R474-E492 IonicContact NH2-OE1 3.1Å; R474-E492 PolarHBondContact NH2-OE1 3.5Å; R474-E492 IonicContact NH2-OE2 3.31Å; R474-E492 PolarHBondContact O-N 2.81Å; R474-Y703 PolarHBondContact NH1-OH 3.26Å; R474-Y703 VanDerWaalsContact NH1-OH 3.08Å; R474-Y703 PolarHBondContact NH2-OH 2.9Å
475	F	97.1	Very high	86.2	Confident	12 Å²	12	57.1 Å²	57.1	5%	0.053	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	136.5	175	175.4	-81.6	0	0	0	111.3	A390 F444 H445 C446 W448 A477 F489 Y490 A491	A390-F475 HydrophobicContact CB-CD1 4.09Å; A390-F475 HydrophobicContact CB-CE1 3.82Å; A390-F475 HydrophobicContact CB-CE2 4.45Å; A390-F475 HydrophobicContact CB-CZ 4.01Å; F444-F475 HydrophobicContact CD1-CD1 4.11Å; F444-F475 AromaticContact CD1-CE1 3.89Å; F444-F475 HydrophobicContact CD1-CE1 3.89Å; F444-F475 HydrophobicContact CE1-CE1 4.49Å; H445-F475 WeakPolarHBondContact CA-O 3.5Å; C446-F475 PolarHBondContact N-O 2.89Å; C446-F475 PolarHBondContact O-N 3.47Å; W448-F475 HydrophobicContact CH2-CB 3.93Å; W448-F475 HydrophobicContact CH2-CG 4.31Å; W448-F475 HydrophobicContact CZ3-CB 3.52Å; W448-F475 HydrophobicContact CZ3-CG 4.36Å; F475-A477 HydrophobicContact CE1-CB 3.69Å; F475-A477 HydrophobicContact CZ-CB 4.08Å; F475-F489 HydrophobicContact CE2-CB 4.48Å; F475-F489 HydrophobicContact CE2-CD1 4.37Å; F475-F489 AromaticContact CZ-CD1 3.73Å; F475-F489 HydrophobicContact CZ-CD1 3.73Å; F475-F489 HydrophobicContact CZ-CE1 4.49Å; F475-Y490 CarbonylContact C-O 3.58Å; F475-Y490 WeakPolarHBondContact CA-O 3.08Å; F475-A491 HydrophobicContact CB-CB 4.38Å; F475-A491 HydrophobicContact CD2-CB 4.11Å
476	V	96.9	Very high	88.1	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	131.3	178.5	-177.7	0	0	0	0	108.7	F444 H445 F489 Y490 Y693 Y703	F444-V476 WeakPolarHBondContact O-CA 3.31Å; H445-V476 VanDerWaalsContact CE1-CG1 3.49Å; H445-V476 WeakPolarHBondContact CE1-CG1 3.44Å; V476-F489 CarbonylContact O-C 3.59Å; V476-F489 WeakPolarHBondContact O-CA 3.28Å; V476-Y490 PolarHBondContact N-O 3.04Å; V476-Y490 PolarHBondContact O-N 2.92Å; V476-Y693 HydrophobicContact CG1-CD1 4.15Å; V476-Y693 HydrophobicContact CG1-CD2 4.02Å; V476-Y693 HydrophobicContact CG1-CE2 4.46Å; V476-Y693 HydrophobicContact CG1-CG 3.86Å; V476-Y703 HydrophobicContact CB-CE2 4.18Å; V476-Y703 HydrophobicContact CG1-CE2 4.07Å; V476-Y703 HydrophobicContact CG2-CE2 4.39Å
477	A	97.8	Very high	89.9	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	147.5	173	0	0	0	0	0	111	L386 T443 F444 F475 G488 F489	L386-A477 HydrophobicContact CB-CB 4.01Å; L386-A477 HydrophobicContact CD2-CB 4.21Å; L386-A477 HydrophobicContact CG-CB 4.47Å; T443-A477 CarbonylContact C-O 3.58Å; T443-A477 VanDerWaalsContact CA-O 3.25Å; T443-A477 WeakPolarHBondContact CA-O 3.32Å; F444-A477 HydrophobicContact CB-CB 4.35Å; F444-A477 PolarHBondContact N-O 3.25Å; F444-A477 PolarHBondContact O-N 3.46Å; F475-A477 HydrophobicContact CE1-CB 3.69Å; F475-A477 HydrophobicContact CZ-CB 4.08Å; A477-G488 CarbonylContact C-O 3.42Å; A477-G488 VanDerWaalsContact CA-O 3.24Å; A477-G488 WeakPolarHBondContact CA-O 3.4Å; A477-F489 HydrophobicContact CB-CD1 3.59Å; A477-F489 HydrophobicContact CB-CE1 3.95Å
478	E	97.8	Very high	91.8	Very high	3 Å²	3	39 Å²	39	1%	0.014	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	139.9	177	-175.3	179.3	179.8	0	0	110.4	E442 T443 V480 S487 G488 T691 R692 Y693 F694	E442-E478 CarbonylContact O-C 3.54Å; E442-E478 VanDerWaalsContact O-CA 3.29Å; E442-E478 WeakPolarHBondContact O-CA 3.43Å; T443-E478 HydrophobicContact CG2-CB 4.36Å; T443-E478 HydrophobicContact CG2-CG 4.1Å; E478-V480 HydrophobicContact CB-CG1 4.15Å; E478-V480 HydrophobicContact CG-CG1 4.16Å; E478-V480 PolarHBondContact O-N 2.98Å; E478-S487 CarbonylContact O-C 3.57Å; E478-S487 WeakPolarHBondContact O-CA 3.09Å; E478-G488 PolarHBondContact N-O 3.45Å; E478-G488 PolarHBondContact O-N 2.86Å; E478-T691 WeakPolarHBondContact OE1-CA 3.42Å; E478-T691 WeakPolarHBondContact OE1-CB 3.25Å; E478-R692 PolarHBondContact OE1-N 3.01Å; E478-R692 PolarHBondContact OE2-N 3.4Å; E478-R692 VanDerWaalsContact OE2-N 3.16Å; E478-Y693 PolarHBondContact OE2-N 3.04Å; E478-F694 HydrophobicContact CB-CD2 3.72Å; E478-F694 HydrophobicContact CB-CE2 3.85Å
479	Q	97.3	Very high	92.9	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	101.2	164.5	-170.8	67	25.8	0	0	109.8	P438 I439 G441 E442 S481 P485 V486 S487	P438-Q479 HydrophobicContact CB-CB 3.92Å; P438-Q479 HydrophobicContact CB-CG 4.05Å; P438-Q479 VanDerWaalsContact CB-OE1 3.3Å; I439-Q479 WeakPolarHBondContact O-CB 3.4Å; I439-Q479 WeakPolarHBondContact O-CG 3.34Å; G441-Q479 PolarHBondContact N-O 2.93Å; E442-Q479 HydrophobicContact CB-CB 4.36Å; E442-Q479 PolarHBondContact O-N 3.28Å; Q479-S481 PolarHBondContact NE2-O 3.41Å; Q479-P485 VanDerWaalsContact NE2-C 3.28Å; Q479-V486 PolarHBondContact NE2-O 3.44Å; Q479-S487 PolarHBondContact OE1-OG 2.86Å
480	V	95.4	Very high	93.7	Very high	5 Å²	5	28.2 Å²	28.2	3%	0.03	15%	0.146	C	C	.	.			trans	-88.8	-20.5	-171	-63.1	0	0	0	0	113.9	E478 V486 T691 F694 W701	E478-V480 HydrophobicContact CB-CG1 4.15Å; E478-V480 HydrophobicContact CG-CG1 4.16Å; E478-V480 PolarHBondContact O-N 2.98Å; V480-V486 HydrophobicContact CG2-CB 3.94Å; V480-V486 HydrophobicContact CG2-CG1 3.87Å; V480-V486 VanDerWaalsContact CG2-O 3.24Å; V480-V486 WeakPolarHBondContact CG2-O 3.14Å; V480-V486 PolarHBondContact N-O 2.64Å; V480-T691 HydrophobicContact CB-CG2 3.8Å; V480-T691 HydrophobicContact CG1-CG2 3.9Å; V480-F694 HydrophobicContact CG1-CB 3.72Å; V480-F694 HydrophobicContact CG1-CD2 4.06Å; V480-F694 HydrophobicContact CG1-CG 4.03Å; V480-W701 HydrophobicContact CB-CD2 3.77Å; V480-W701 HydrophobicContact CB-CE3 3.77Å; V480-W701 HydrophobicContact CB-CG 4.4Å; V480-W701 HydrophobicContact CB-CH2 4.02Å; V480-W701 HydrophobicContact CB-CZ2 4.04Å; V480-W701 HydrophobicContact CB-CZ3 3.9Å; V480-W701 HydrophobicContact CG1-CD2 4.31Å; V480-W701 HydrophobicContact CG1-CE3 4.06Å; V480-W701 HydrophobicContact CG1-CZ3 4.41Å; V480-W701 HydrophobicContact CG2-CD2 3.53Å; V480-W701 HydrophobicContact CG2-CE3 4.08Å; V480-W701 HydrophobicContact CG2-CG 3.72Å; V480-W701 HydrophobicContact CG2-CZ2 4.05Å
481	S	92.3	Very high	94.1	Very high	26 Å²	26	25.6 Å²	25.6	18%	0.182	13%	0.129	C	C	.	.			trans	-148	148.9	177.7	174.6	0	0	0	0	111.7	Q479 P484 P485 V486	Q479-S481 PolarHBondContact NE2-O 3.41Å; S481-P484 CarbonylContact C-O 3.44Å; S481-P484 VanDerWaalsContact CB-O 3.3Å; S481-P484 WeakPolarHBondContact CB-O 3.39Å; S481-P484 PolarHBondContact OG-O 3.03Å; S481-P485 CarbonylContact O-C 3.45Å; S481-P485 VanDerWaalsContact O-CA 3.3Å; S481-P485 WeakPolarHBondContact O-CA 3.36Å; S481-V486 PolarHBondContact N-O 3.23Å; S481-V486 VanDerWaalsContact N-O 3.13Å; S481-V486 PolarHBondContact O-N 2.74Å
482	H	84.6	Confident	94.3	Very high	47 Å²	47	24.9 Å²	24.9	22%	0.218	13%	0.127	C	C	.	.	S	Bend	trans	-100.7	-34.7	175.5	-167.9	54.2	0	0	0	113.2	I440 P484 P485 Q675 E679	I440-H482 HydrophobicContact CB-CB 4.4Å; H482-P484 CarbonylContact C-O 3.53Å; H482-P484 VanDerWaalsContact C-O 3.3Å; H482-P484 CarbonylContact O-C 3.59Å; H482-P484 VanDerWaalsContact O-C 3.26Å; H482-P485 WeakPolarHBondContact O-CA 3.49Å; H482-P485 VanDerWaalsContact O-N 3.1Å; H482-Q675 PolarHBondContact CE1-NE2 3.02Å; H482-Q675 PolarHBondContact ND1-NE2 3.47Å; H482-E679 IonicContact CD2-OE2 3.44Å
483	H	82.5	Confident	94.4	Very high	135 Å²	135	21.8 Å²	21.8	63%	0.625	11%	0.113	S	C	*	.	S	Bend	trans	-134.8	92.2	-175.8	-69.3	-31.1	0	0	0	111	E679	H483-E679 IonicContact CD2-OE1 3.04Å; H483-E679 PolarHBondContact CD2-OE1 3.18Å; H483-E679 IonicContact NE2-OE1 3.61Å
484	P	85.1	Confident	94.3	Very high	64 Å²	64	24.7 Å²	24.7	42%	0.416	13%	0.131	S	C	.	.	S	Bend	cis	-71.6	159.8	-1.4	30.2	-34.3	0	0	0	113.1	S481 H482 V486 W505	S481-P484 CarbonylContact C-O 3.44Å; S481-P484 VanDerWaalsContact CB-O 3.3Å; S481-P484 WeakPolarHBondContact CB-O 3.39Å; S481-P484 PolarHBondContact OG-O 3.03Å; H482-P484 CarbonylContact C-O 3.53Å; H482-P484 VanDerWaalsContact C-O 3.3Å; H482-P484 CarbonylContact O-C 3.59Å; H482-P484 VanDerWaalsContact O-C 3.26Å; P484-V486 HydrophobicContact CG-CG2 4.08Å; P484-V486 PolarHBondContact O-N 2.85Å; P484-W505 HydrophobicContact CB-CD2 4.24Å; P484-W505 HydrophobicContact CB-CE3 4.03Å; P484-W505 HydrophobicContact CB-CZ3 4.36Å
485	P	90.3	Very high	94.2	Very high	50 Å²	50	24.8 Å²	24.8	33%	0.325	14%	0.135	S	C	.	.			trans	-78	84.9	-176.2	31.5	-35	0	0	0	111	Q479 S481 H482 W505	Q479-P485 VanDerWaalsContact NE2-C 3.28Å; S481-P485 CarbonylContact O-C 3.45Å; S481-P485 VanDerWaalsContact O-CA 3.3Å; S481-P485 WeakPolarHBondContact O-CA 3.36Å; H482-P485 WeakPolarHBondContact O-CA 3.49Å; H482-P485 VanDerWaalsContact O-N 3.1Å; P485-W505 WeakPolarHBondContact O-CB 3.29Å
486	V	95	Very high	94	Very high	10 Å²	10	26.2 Å²	26.2	6%	0.061	14%	0.14	C	C	.	.			trans	-95.4	130.7	-179.7	-170	0	0	0	0	110.5	Q479 V480 S481 P484 H503 W505	Q479-V486 PolarHBondContact NE2-O 3.44Å; V480-V486 HydrophobicContact CG2-CB 3.94Å; V480-V486 HydrophobicContact CG2-CG1 3.87Å; V480-V486 VanDerWaalsContact CG2-O 3.24Å; V480-V486 WeakPolarHBondContact CG2-O 3.14Å; V480-V486 PolarHBondContact N-O 2.64Å; S481-V486 PolarHBondContact N-O 3.23Å; S481-V486 VanDerWaalsContact N-O 3.13Å; S481-V486 PolarHBondContact O-N 2.74Å; P484-V486 HydrophobicContact CG-CG2 4.08Å; P484-V486 PolarHBondContact O-N 2.85Å; V486-H503 HydrophobicContact CG1-CB 4.21Å; V486-W505 HydrophobicContact CB-CB 4.44Å; V486-W505 HydrophobicContact CG2-CB 4.03Å; V486-W505 HydrophobicContact CG2-CG 4.2Å
487	S	97.2	Very high	93.9	Very high	4 Å²	4	30.6 Å²	30.6	3%	0.028	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	132.3	171.3	-46	0	0	0	0	109.5	E478 Q479 H503 V504	E478-S487 CarbonylContact O-C 3.57Å; E478-S487 WeakPolarHBondContact O-CA 3.09Å; Q479-S487 PolarHBondContact OE1-OG 2.86Å; S487-H503 CarbonylContact O-C 3.51Å; S487-H503 VanDerWaalsContact O-CA 3.31Å; S487-H503 WeakPolarHBondContact O-CA 3.32Å; S487-V504 PolarHBondContact N-O 2.88Å; S487-V504 PolarHBondContact O-N 2.77Å
488	G	97.5	Very high	93.8	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	143.3	171.1	0	0	0	0	0	110.7	A477 E478 T502	A477-G488 CarbonylContact C-O 3.42Å; A477-G488 VanDerWaalsContact CA-O 3.24Å; A477-G488 WeakPolarHBondContact CA-O 3.4Å; E478-G488 PolarHBondContact N-O 3.45Å; E478-G488 PolarHBondContact O-N 2.86Å; G488-T502 CarbonylContact C-O 3.55Å
489	F	97.7	Very high	93.8	Very high	8 Å²	8	30.4 Å²	30.4	4%	0.035	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	138.5	-179.3	-52.7	-82.6	0	0	0	109.8	L385 L386 Y389 F475 V476 A477 T502 V504	L385-F489 HydrophobicContact CD2-CZ 3.93Å; L386-F489 HydrophobicContact CD2-CE1 4.15Å; L386-F489 HydrophobicContact CD2-CZ 4.4Å; Y389-F489 VanDerWaalsContact CB-CE1 3.44Å; Y389-F489 HydrophobicContact CD1-CD2 4.4Å; Y389-F489 HydrophobicContact CD1-CE1 4.23Å; Y389-F489 HydrophobicContact CD1-CE2 4.02Å; Y389-F489 AromaticContact CD1-CZ 3.92Å; Y389-F489 HydrophobicContact CD1-CZ 3.92Å; Y389-F489 HydrophobicContact CD2-CE1 4.1Å; Y389-F489 HydrophobicContact CD2-CE2 4.46Å; Y389-F489 AromaticContact CD2-CZ 3.71Å; Y389-F489 HydrophobicContact CD2-CZ 3.71Å; Y389-F489 HydrophobicContact CE1-CE2 4.22Å; Y389-F489 HydrophobicContact CE1-CZ 4.37Å; Y389-F489 HydrophobicContact CE2-CZ 4.19Å; Y389-F489 HydrophobicContact CG-CD1 4.33Å; Y389-F489 AromaticContact CG-CE1 3.68Å; Y389-F489 HydrophobicContact CG-CE1 3.68Å; Y389-F489 HydrophobicContact CG-CE2 4.15Å; Y389-F489 AromaticContact CG-CZ 3.56Å; Y389-F489 HydrophobicContact CG-CZ 3.56Å; F475-F489 HydrophobicContact CE2-CB 4.48Å; F475-F489 HydrophobicContact CE2-CD1 4.37Å; F475-F489 AromaticContact CZ-CD1 3.73Å; F475-F489 HydrophobicContact CZ-CD1 3.73Å; F475-F489 HydrophobicContact CZ-CE1 4.49Å; V476-F489 CarbonylContact O-C 3.59Å; V476-F489 WeakPolarHBondContact O-CA 3.28Å; A477-F489 HydrophobicContact CB-CD1 3.59Å; A477-F489 HydrophobicContact CB-CE1 3.95Å; F489-T502 PolarHBondContact N-O 3.21Å; F489-T502 PolarHBondContact O-N 3.32Å; F489-T502 VanDerWaalsContact O-O 3.14Å; F489-V504 HydrophobicContact CD2-CG2 4.36Å; F489-V504 HydrophobicContact CE2-CB 4.13Å; F489-V504 HydrophobicContact CE2-CG2 4.08Å
490	Y	97.8	Very high	93.8	Very high	1 Å²	1	31.3 Å²	31.3	0%	0.004	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	132.9	177.8	-179.2	-99.8	0	0	0	109.5	F475 V476 E492 C499 V500 N501 Y703 P706 L707 W708	F475-Y490 CarbonylContact C-O 3.58Å; F475-Y490 WeakPolarHBondContact CA-O 3.08Å; V476-Y490 PolarHBondContact N-O 3.04Å; V476-Y490 PolarHBondContact O-N 2.92Å; Y490-E492 HydrophobicContact CE1-CB 3.84Å; Y490-E492 HydrophobicContact CE1-CG 3.76Å; Y490-E492 WeakPolarHBondContact CE1-OE2 3.35Å; Y490-E492 VanDerWaalsContact CZ-OE2 3.29Å; Y490-E492 PolarHBondContact OH-OE2 3.02Å; Y490-C499 HydrophobicContact CE2-CB 4.03Å; Y490-V500 CarbonylContact C-O 3.59Å; Y490-V500 VanDerWaalsContact CA-O 3.32Å; Y490-V500 WeakPolarHBondContact CA-O 3.32Å; Y490-V500 WeakPolarHBondContact CD2-O 3.38Å; Y490-N501 HydrophobicContact CD2-CB 4.11Å; Y490-Y703 AromaticContact CD1-CD1 3.63Å; Y490-Y703 HydrophobicContact CD1-CD1 3.63Å; Y490-Y703 AromaticContact CD1-CD2 3.97Å; Y490-Y703 HydrophobicContact CD1-CD2 3.97Å; Y490-Y703 AromaticContact CD1-CE1 3.82Å; Y490-Y703 HydrophobicContact CD1-CE1 3.82Å; Y490-Y703 HydrophobicContact CD1-CE2 4.12Å; Y490-Y703 AromaticContact CD1-CG 3.71Å; Y490-Y703 HydrophobicContact CD1-CG 3.71Å; Y490-Y703 VanDerWaalsContact CD2-CB 3.42Å; Y490-Y703 HydrophobicContact CD2-CD1 4.07Å; Y490-Y703 AromaticContact CD2-CG 3.79Å; Y490-Y703 HydrophobicContact CD2-CG 3.79Å; Y490-Y703 AromaticContact CE1-CD1 3.58Å; Y490-Y703 HydrophobicContact CE1-CD1 3.58Å; Y490-Y703 AromaticContact CE1-CE1 3.71Å; Y490-Y703 HydrophobicContact CE1-CE1 3.71Å; Y490-Y703 HydrophobicContact CE1-CG 4.12Å; Y490-Y703 HydrophobicContact CE2-CD1 4.02Å; Y490-Y703 HydrophobicContact CE2-CG 4.19Å; Y490-Y703 AromaticContact CG-CD1 3.87Å; Y490-Y703 HydrophobicContact CG-CD1 3.87Å; Y490-Y703 AromaticContact CG-CD2 3.85Å; Y490-Y703 HydrophobicContact CG-CD2 3.85Å; Y490-Y703 HydrophobicContact CG-CE1 4.48Å; Y490-Y703 HydrophobicContact CG-CE2 4.44Å; Y490-Y703 AromaticContact CG-CG 3.52Å; Y490-Y703 HydrophobicContact CG-CG 3.52Å; Y490-Y703 AromaticContact CZ-CD1 3.79Å; Y490-P706 HydrophobicContact CE2-CB 4.05Å; Y490-L707 PolarHBondContact OH-N 3.27Å; Y490-W708 HydrophobicContact CE2-CH2 4.17Å; Y490-W708 AromaticContact CE2-CZ3 3.82Å; Y490-W708 HydrophobicContact CE2-CZ3 3.82Å
491	A	97.3	Very high	93.9	Very high	2 Å²	2	31.9 Å²	31.9	2%	0.017	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	147.3	169.1	0	0	0	0	0	111.4	M393 R474 F475 C499 V500	M393-A491 HydrophobicContact CE-CB 3.87Å; R474-A491 CarbonylContact O-C 3.54Å; R474-A491 WeakPolarHBondContact O-CA 3.39Å; R474-A491 WeakPolarHBondContact O-CB 3.22Å; F475-A491 HydrophobicContact CB-CB 4.38Å; F475-A491 HydrophobicContact CD2-CB 4.11Å; A491-C499 CarbonylContact O-C 3.53Å; A491-C499 WeakPolarHBondContact O-CA 3.21Å; A491-C499 VanDerWaalsContact O-CB 3.31Å; A491-C499 WeakPolarHBondContact O-CB 3.44Å; A491-V500 HydrophobicContact CB-CG1 3.75Å; A491-V500 PolarHBondContact N-O 2.7Å; A491-V500 PolarHBondContact O-N 2.63Å
492	E	96.4	Very high	94.1	Very high	16 Å²	16	31.4 Å²	31.4	8%	0.075	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	154	-178.7	64	177.1	-163.9	0	0	112.6	V473 R474 Y490 P494 M498 C499	V473-E492 WeakPolarHBondContact CA-O 3.43Å; R474-E492 HydrophobicContact CB-CG 4.3Å; R474-E492 IonicContact CZ-OE1 2.59Å; R474-E492 VanDerWaalsContact CZ-OE1 3.29Å; R474-E492 PolarHBondContact N-O 3.03Å; R474-E492 IonicContact NE-OE1 3.6Å; R474-E492 PolarHBondContact NE-OE1 2.88Å; R474-E492 VanDerWaalsContact NE-OE1 3.14Å; R474-E492 VanDerWaalsContact NH2-CD 3.35Å; R474-E492 IonicContact NH2-OE1 3.1Å; R474-E492 PolarHBondContact NH2-OE1 3.5Å; R474-E492 IonicContact NH2-OE2 3.31Å; R474-E492 PolarHBondContact O-N 2.81Å; Y490-E492 HydrophobicContact CE1-CB 3.84Å; Y490-E492 HydrophobicContact CE1-CG 3.76Å; Y490-E492 WeakPolarHBondContact CE1-OE2 3.35Å; Y490-E492 VanDerWaalsContact CZ-OE2 3.29Å; Y490-E492 PolarHBondContact OH-OE2 3.02Å; E492-P494 HydrophobicContact CG-CG 4.46Å; E492-M498 WeakPolarHBondContact CA-O 3.48Å; E492-C499 HydrophobicContact CB-CB 3.65Å
493	C	96.1	Very high	94.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	95.6	164.6	-179.5	0	0	0	0	107.5	V400 V473 E495 R496 Q497 M498	V400-C493 HydrophobicContact CG1-CB 4.38Å; V473-C493 HydrophobicContact CG2-CB 4.27Å; C493-E495 VanDerWaalsContact C-N 3.26Å; C493-E495 PolarHBondContact O-N 3.49Å; C493-E495 PolarHBondContact SG-OE2 2.8Å; C493-E495 VanDerWaalsContact SG-OE2 3.4Å; C493-R496 HydrophobicContact CB-CB 4.25Å; C493-R496 CarbonylContact O-C 3.58Å; C493-R496 PolarHBondContact O-N 3.09Å; C493-Q497 PolarHBondContact O-N 2.89Å; C493-Q497 VanDerWaalsContact O-N 3.15Å; C493-M498 HydrophobicContact CB-CG 4.04Å; C493-M498 PolarHBondContact N-O 3.33Å; C493-M498 PolarHBondContact O-N 3.19Å
494	P	93.1	Very high	95.2	Very high	60 Å²	60	24.6 Å²	24.6	39%	0.39	13%	0.132	S	C	.	.	G	3₁₀ helix	trans	-55.8	-38.8	-178.9	-27.8	36.4	0	0	0	113.7	E492 R496 Q497 L707	E492-P494 HydrophobicContact CG-CG 4.46Å; P494-R496 PolarHBondContact O-N 3.03Å; P494-Q497 PolarHBondContact O-N 2.95Å; P494-L707 HydrophobicContact CB-CD1 4.15Å; P494-L707 HydrophobicContact CG-CD1 4.37Å
495	E	92.6	Very high	95.5	Very high	77 Å²	77	25.1 Å²	25.1	36%	0.36	13%	0.126	S	C	.	.	G	3₁₀ helix	trans	-66.5	-25.9	-177.9	-51.8	96.4	124.5	0	0	112.6	Y471 Q472 C493	Y471-E495 HydrophobicContact CD1-CB 3.85Å; Y471-E495 HydrophobicContact CE1-CB 4.28Å; Q472-E495 PolarHBondContact N-OE1 3.18Å; C493-E495 VanDerWaalsContact C-N 3.26Å; C493-E495 PolarHBondContact O-N 3.49Å; C493-E495 PolarHBondContact SG-OE2 2.8Å; C493-E495 VanDerWaalsContact SG-OE2 3.4Å
496	R	93	Very high	95.6	Very high	42 Å²	42	24.4 Å²	24.4	16%	0.158	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-100.7	5.9	174	-65.5	-63.6	-146.4	158.9	17.1	112.8	V400 T403 D404 Y471 C493 P494 M498	V400-R496 HydrophobicContact CB-CG 4.28Å; T403-R496 HydrophobicContact CG2-CB 4.36Å; D404-R496 IonicContact OD1-CZ 3.85Å; D404-R496 VanDerWaalsContact OD1-CZ 3.23Å; D404-R496 IonicContact OD1-NH1 3.24Å; D404-R496 PolarHBondContact OD1-NH1 3.23Å; D404-R496 IonicContact OD1-NH2 3.54Å; D404-R496 PolarHBondContact OD1-NH2 3.23Å; D404-R496 VanDerWaalsContact OD1-NH2 3.13Å; D404-R496 IonicContact OD2-CZ 2.63Å; D404-R496 IonicContact OD2-NH1 2.71Å; D404-R496 IonicContact OD2-NH2 2.73Å; D404-R496 PolarHBondContact OD2-NH2 2.82Å; Y471-R496 HydrophobicContact CD1-CG 4.16Å; Y471-R496 HydrophobicContact CE1-CG 4.16Å; Y471-R496 VanDerWaalsContact CE2-NE 3.26Å; Y471-R496 HydrophobicContact CG-CG 4.42Å; Y471-R496 VanDerWaalsContact OH-CZ 3.24Å; Y471-R496 PolarHBondContact OH-NE 3.08Å; C493-R496 HydrophobicContact CB-CB 4.25Å; C493-R496 CarbonylContact O-C 3.58Å; C493-R496 PolarHBondContact O-N 3.09Å; P494-R496 PolarHBondContact O-N 3.03Å; R496-M498 HydrophobicContact CB-CG 4.02Å; R496-M498 HydrophobicContact CB-SD 3.79Å; R496-M498 PolarHBondContact O-N 3.18Å
497	Q	95	Very high	95.3	Very high	91 Å²	91	29.1 Å²	29.1	43%	0.425	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.6	48.2	-176.7	-53.8	-167	-55.8	0	0	112.6	C493 P494 L528	C493-Q497 PolarHBondContact O-N 2.89Å; C493-Q497 VanDerWaalsContact O-N 3.15Å; P494-Q497 PolarHBondContact O-N 2.95Å; Q497-L528 HydrophobicContact CB-CB 4.04Å; Q497-L528 HydrophobicContact CB-CD1 4.43Å; Q497-L528 WeakPolarHBondContact O-CB 3.48Å; Q497-L528 WeakPolarHBondContact O-CG 3.14Å; Q497-L528 PolarHBondContact O-N 3.47Å
498	M	95.9	Very high	94.9	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	149.9	-177.7	75.5	-169.3	-36.1	0	0	112.1	F399 I402 E492 C493 R496 H526 L527	F399-M498 HydrophobicContact CD1-SD 4.44Å; F399-M498 HydrophobicContact CE1-CG 4.19Å; F399-M498 HydrophobicContact CE1-SD 4.19Å; F399-M498 HydrophobicContact CZ-CG 4.4Å; F399-M498 WeakPolarHBondContact O-CE 3.42Å; I402-M498 HydrophobicContact CB-CE 4.14Å; E492-M498 WeakPolarHBondContact CA-O 3.48Å; C493-M498 HydrophobicContact CB-CG 4.04Å; C493-M498 PolarHBondContact N-O 3.33Å; C493-M498 PolarHBondContact O-N 3.19Å; R496-M498 HydrophobicContact CB-CG 4.02Å; R496-M498 HydrophobicContact CB-SD 3.79Å; R496-M498 PolarHBondContact O-N 3.18Å; M498-H526 VanDerWaalsContact CA-O 3.32Å; M498-H526 WeakPolarHBondContact CA-O 3.42Å; M498-L527 HydrophobicContact CB-CD2 4.16Å; M498-L527 HydrophobicContact CE-CD2 3.44Å; M498-L527 VanDerWaalsContact CE-CD2 3.44Å
499	C	97.2	Very high	94.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	155.1	178.2	54.8	0	0	0	0	111.9	Y490 A491 E492 H526 L707 W708	Y490-C499 HydrophobicContact CE2-CB 4.03Å; A491-C499 CarbonylContact O-C 3.53Å; A491-C499 WeakPolarHBondContact O-CA 3.21Å; A491-C499 VanDerWaalsContact O-CB 3.31Å; A491-C499 WeakPolarHBondContact O-CB 3.44Å; E492-C499 HydrophobicContact CB-CB 3.65Å; C499-H526 PolarHBondContact N-O 2.83Å; C499-H526 VanDerWaalsContact N-O 3.11Å; C499-H526 PolarHBondContact O-N 2.88Å; C499-L707 HydrophobicContact CB-CB 4.25Å; C499-W708 VanDerWaalsContact SG-CZ3 3.53Å
500	V	97.4	Very high	94	Very high	20 Å²	20	33.9 Å²	33.9	12%	0.121	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	135.8	176.7	59.7	0	0	0	0	109.8	F399 Y490 A491 C524 L525 F536	F399-V500 HydrophobicContact CE2-CB 4.46Å; F399-V500 HydrophobicContact CE2-CG1 4.13Å; F399-V500 HydrophobicContact CZ-CG1 4.11Å; Y490-V500 CarbonylContact C-O 3.59Å; Y490-V500 VanDerWaalsContact CA-O 3.32Å; Y490-V500 WeakPolarHBondContact CA-O 3.32Å; Y490-V500 WeakPolarHBondContact CD2-O 3.38Å; A491-V500 HydrophobicContact CB-CG1 3.75Å; A491-V500 PolarHBondContact N-O 2.7Å; A491-V500 PolarHBondContact O-N 2.63Å; V500-C524 WeakPolarHBondContact CA-O 3.33Å; V500-L525 HydrophobicContact CB-CD1 4.35Å; V500-F536 HydrophobicContact CG2-CE1 3.79Å; V500-F536 HydrophobicContact CG2-CZ 3.76Å
501	N	96.8	Very high	93.2	Very high	17 Å²	17	37.9 Å²	37.9	9%	0.091	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	127.9	176.1	173.7	16.3	0	0	0	108.8	Y490 G523 C524 W701 A702 W708	Y490-N501 HydrophobicContact CD2-CB 4.11Å; N501-G523 CarbonylContact O-C 3.53Å; N501-G523 WeakPolarHBondContact O-CA 3.02Å; N501-C524 PolarHBondContact N-O 2.87Å; N501-C524 PolarHBondContact O-N 3.46Å; N501-W701 PolarHBondContact OD1-O 3.35Å; N501-A702 WeakPolarHBondContact ND2-CA 3.34Å; N501-A702 WeakPolarHBondContact ND2-CB 3.47Å; N501-W708 HydrophobicContact CB-CH2 3.79Å; N501-W708 HydrophobicContact CB-CZ3 4.29Å
502	T	96.6	Very high	92.4	Very high	15 Å²	15	38 Å²	38	9%	0.092	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	144.3	-175.8	-52.4	0	0	0	0	109.7	G488 F489 V504 E522 G523 L538	G488-T502 CarbonylContact C-O 3.55Å; F489-T502 PolarHBondContact N-O 3.21Å; F489-T502 PolarHBondContact O-N 3.32Å; F489-T502 VanDerWaalsContact O-O 3.14Å; T502-V504 HydrophobicContact CG2-CG2 3.72Å; T502-E522 WeakPolarHBondContact CA-O 3.19Å; T502-G523 WeakPolarHBondContact OG1-CA 3.05Å; T502-L538 HydrophobicContact CG2-CD1 4.3Å
503	H	95.8	Very high	91.6	Very high	36 Å²	36	43.7 Å²	43.7	17%	0.167	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	137.2	166.1	65.1	-79.7	0	0	0	109.3	V486 S487 G521 E522 W701	V486-H503 HydrophobicContact CG1-CB 4.21Å; S487-H503 CarbonylContact O-C 3.51Å; S487-H503 VanDerWaalsContact O-CA 3.31Å; S487-H503 WeakPolarHBondContact O-CA 3.32Å; H503-G521 WeakPolarHBondContact O-CA 3.14Å; H503-E522 PolarHBondContact N-O 2.9Å; H503-E522 PolarHBondContact O-N 3.3Å; H503-W701 HydrophobicContact CB-CB 4.07Å
504	V	94.4	Very high	91.2	Very high	3 Å²	3	44.2 Å²	44.2	2%	0.018	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	142.2	-177.1	-169.6	0	0	0	0	110.7	Y389 S487 F489 T502 M519 I520 L538	Y389-V504 HydrophobicContact CE1-CG2 4.07Å; Y389-V504 WeakPolarHBondContact OH-CG1 3.33Å; S487-V504 PolarHBondContact N-O 2.88Å; S487-V504 PolarHBondContact O-N 2.77Å; F489-V504 HydrophobicContact CD2-CG2 4.36Å; F489-V504 HydrophobicContact CE2-CB 4.13Å; F489-V504 HydrophobicContact CE2-CG2 4.08Å; T502-V504 HydrophobicContact CG2-CG2 3.72Å; V504-M519 HydrophobicContact CG1-CB 4.34Å; V504-I520 CarbonylContact C-O 3.53Å; V504-I520 WeakPolarHBondContact CA-O 3.49Å; V504-L538 HydrophobicContact CG2-CD1 3.57Å
505	W	92.5	Very high	91	Very high	76 Å²	76	42.7 Å²	42.7	29%	0.288	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	163.5	161.5	64.7	-76.8	0	0	0	109.7	P484 P485 V486 K507 I520	P484-W505 HydrophobicContact CB-CD2 4.24Å; P484-W505 HydrophobicContact CB-CE3 4.03Å; P484-W505 HydrophobicContact CB-CZ3 4.36Å; P485-W505 WeakPolarHBondContact O-CB 3.29Å; V486-W505 HydrophobicContact CB-CB 4.44Å; V486-W505 HydrophobicContact CG2-CB 4.03Å; V486-W505 HydrophobicContact CG2-CG 4.2Å; W505-K507 HydrophobicContact CZ3-CB 4.22Å; W505-I520 VanDerWaalsContact CD1-O 3.25Å; W505-I520 HydrophobicContact CD2-CB 4.1Å; W505-I520 HydrophobicContact CD2-CD1 4.32Å; W505-I520 HydrophobicContact CE3-CD1 4.29Å; W505-I520 HydrophobicContact CG-CB 4.37Å; W505-I520 HydrophobicContact CH2-CD1 3.44Å; W505-I520 VanDerWaalsContact CH2-CD1 3.44Å; W505-I520 HydrophobicContact CZ2-CB 4Å; W505-I520 HydrophobicContact CZ2-CD1 3.44Å; W505-I520 VanDerWaalsContact CZ2-CD1 3.44Å; W505-I520 HydrophobicContact CZ2-CG1 4.32Å; W505-I520 HydrophobicContact CZ2-CG2 3.75Å; W505-I520 HydrophobicContact CZ3-CD1 3.88Å; W505-I520 PolarHBondContact N-O 2.69Å; W505-I520 VanDerWaalsContact NE1-CG2 3.3Å; W505-I520 PolarHBondContact O-N 3Å; W505-I520 VanDerWaalsContact O-O 3.1Å
506	T	91.5	Very high	91	Very high	34 Å²	34	39.2 Å²	39.2	21%	0.209	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	142.3	-173.6	67.5	0	0	0	0	111.9	V517 S518 M519	T506-V517 HydrophobicContact CG2-CG1 4.19Å; T506-S518 WeakPolarHBondContact CA-O 3.31Å; T506-M519 HydrophobicContact CG2-CE 4.44Å; T506-M519 HydrophobicContact CG2-SD 3.37Å; T506-M519 WeakPolarHBondContact CG2-SD 3.34Å
507	K	88.6	Confident	90.9	Very high	110 Å²	110	38.6 Å²	38.6	48%	0.478	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	118.9	169.6	-171.2	173.3	-176.1	173.4	0	109.3	W505 S518 I520	W505-K507 HydrophobicContact CZ3-CB 4.22Å; K507-S518 PolarHBondContact N-O 3.44Å; K507-S518 PolarHBondContact O-N 3.39Å; K507-I520 HydrophobicContact CB-CD1 3.98Å
508	S	90	Very high	90.8	Very high	22 Å²	22	36.8 Å²	36.8	15%	0.154	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	130.9	-175	-64.2	0	0	0	0	111.1	D369 L370 G516	D369-S508 WeakPolarHBondContact CA-O 3.17Å; L370-S508 PolarHBondContact N-O 3.42Å; S508-G516 CarbonylContact C-O 3.46Å; S508-G516 WeakPolarHBondContact CA-O 3.45Å
509	K	88.4	Confident	90.6	Very high	89 Å²	89	38.3 Å²	38.3	39%	0.387	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	130.4	-178.7	-173.4	174.1	-177.2	175.8	0	110.8	M511 G516	K509-M511 PolarHBondContact O-N 3.35Å; K509-G516 PolarHBondContact N-O 3.3Å; K509-G516 PolarHBondContact O-N 2.88Å
510	F	87.6	Confident	90.3	Very high	1 Å²	1	41.2 Å²	41.2	0%	0.004	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	124	172.6	-176.3	-111.5	0	0	0	111.4	L55 L361 L364 K365 G367 M368 L370 G512 I515 I546	L55-F510 HydrophobicContact CD1-CE2 4.21Å; L55-F510 HydrophobicContact CD1-CZ 3.61Å; L55-F510 HydrophobicContact CG-CZ 4.03Å; L361-F510 HydrophobicContact CD2-CE2 3.65Å; L361-F510 HydrophobicContact CD2-CZ 4.13Å; L364-F510 HydrophobicContact CB-CD1 3.85Å; L364-F510 HydrophobicContact CB-CD2 4.25Å; L364-F510 HydrophobicContact CB-CE1 3.88Å; L364-F510 HydrophobicContact CB-CE2 4.28Å; L364-F510 HydrophobicContact CB-CG 4.02Å; L364-F510 HydrophobicContact CB-CZ 4.09Å; L364-F510 HydrophobicContact CD1-CD2 3.58Å; L364-F510 HydrophobicContact CD1-CE2 3.71Å; L364-F510 HydrophobicContact CD1-CG 4.08Å; L364-F510 HydrophobicContact CD1-CZ 4.3Å; K365-F510 VanDerWaalsContact O-CD1 3.29Å; K365-F510 WeakPolarHBondContact O-CD1 3.5Å; G367-F510 WeakPolarHBondContact CA-O 3.1Å; G367-F510 PolarHBondContact N-O 3.06Å; M368-F510 PolarHBondContact O-N 2.85Å; L370-F510 HydrophobicContact CD1-CB 4.26Å; L370-F510 HydrophobicContact CD2-CB 4.09Å; L370-F510 HydrophobicContact CG-CB 4.26Å; F510-G512 WeakPolarHBondContact CE2-O 3.39Å; F510-G512 WeakPolarHBondContact CZ-O 3.33Å; F510-I515 HydrophobicContact CD2-CG1 4.29Å; F510-I546 HydrophobicContact CD2-CD1 4.34Å; F510-I546 HydrophobicContact CE2-CD1 3.65Å
511	M	81.8	Confident	90	Very high	85 Å²	85	41.2 Å²	41.2	42%	0.419	22%	0.215	S	C	.	.			trans	-115.4	25.3	-175.7	-58.4	-180	68.6	0	0	112.5	K509 M513 S514 Y542	K509-M511 PolarHBondContact O-N 3.35Å; M511-M513 PolarHBondContact O-N 3.47Å; M511-S514 CarbonylContact C-O 3.54Å; M511-S514 VanDerWaalsContact CA-O 3.32Å; M511-S514 WeakPolarHBondContact CA-O 3.23Å; M511-S514 WeakPolarHBondContact CB-O 3.13Å; M511-S514 PolarHBondContact N-O 3.33Å; M511-Y542 HydrophobicContact CE-CE1 4.4Å; M511-Y542 HydrophobicContact SD-CD1 4.04Å; M511-Y542 HydrophobicContact SD-CE1 3.88Å
512	G	80.6	Confident	89.9	Confident	5 Å²	5	44.9 Å²	44.9	5%	0.052	23%	0.231	C	C	.	.	S	Bend	trans	83.9	-105.1	-176	0	0	0	0	0	109.7	L55 L366 F510 S514 I546	L55-G512 WeakPolarHBondContact CD1-O 3.43Å; L366-G512 VanDerWaalsContact CD1-N 3.33Å; F510-G512 WeakPolarHBondContact CE2-O 3.39Å; F510-G512 WeakPolarHBondContact CZ-O 3.33Å; G512-S514 PolarHBondContact O-N 3.18Å; G512-S514 VanDerWaalsContact O-N 3.16Å; G512-I546 WeakPolarHBondContact O-CD1 3.13Å
513	M	78.6	Confident	89.8	Confident	135 Å²	135	44.1 Å²	44.1	67%	0.665	23%	0.227	S	C	*	.	S	Bend	trans	-77.5	5.4	-179.3	-58.7	-171.9	-59.3	0	0	114.3	L55 M511 S545	L55-M513 HydrophobicContact CD2-CG 4Å; M511-M513 PolarHBondContact O-N 3.47Å; M513-S545 PolarHBondContact O-N 3.47Å
514	S	86.8	Confident	89.9	Confident	10 Å²	10	43.2 Å²	43.2	7%	0.07	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	162.6	179.5	53.5	0	0	0	0	111.2	M511 G512 A543 R544	M511-S514 CarbonylContact C-O 3.54Å; M511-S514 VanDerWaalsContact CA-O 3.32Å; M511-S514 WeakPolarHBondContact CA-O 3.23Å; M511-S514 WeakPolarHBondContact CB-O 3.13Å; M511-S514 PolarHBondContact N-O 3.33Å; G512-S514 PolarHBondContact O-N 3.18Å; G512-S514 VanDerWaalsContact O-N 3.16Å; S514-A543 CarbonylContact C-O 3.59Å; S514-A543 WeakPolarHBondContact CA-O 3.27Å; S514-A543 VanDerWaalsContact CB-O 3.24Å; S514-A543 WeakPolarHBondContact CB-O 3.37Å; S514-R544 PolarHBondContact OG-NH1 3.48Å
515	I	89.9	Confident	90.1	Very high	28 Å²	28	43.1 Å²	43.1	14%	0.144	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	122.8	171.9	-63.7	169.4	0	0	0	107.1	L370 F510 V517 Y542 A543 I546	L370-I515 HydrophobicContact CD1-CB 4.18Å; L370-I515 HydrophobicContact CD1-CD1 3.73Å; L370-I515 HydrophobicContact CD1-CG1 3.7Å; L370-I515 HydrophobicContact CD1-CG2 3.48Å; L370-I515 VanDerWaalsContact CD1-CG2 3.48Å; F510-I515 HydrophobicContact CD2-CG1 4.29Å; I515-V517 HydrophobicContact CG2-CG2 4.24Å; I515-Y542 CarbonylContact O-C 3.56Å; I515-Y542 VanDerWaalsContact O-CA 3.28Å; I515-Y542 WeakPolarHBondContact O-CA 3.41Å; I515-A543 HydrophobicContact CB-CB 4.26Å; I515-A543 PolarHBondContact N-O 2.94Å; I515-A543 PolarHBondContact O-N 3Å; I515-I546 HydrophobicContact CD1-CD1 4.49Å; I515-I546 HydrophobicContact CD1-CG2 4.28Å; I515-I546 HydrophobicContact CG1-CD1 4.19Å; I515-I546 HydrophobicContact CG1-CG2 4.31Å
516	G	91.6	Very high	90.3	Very high	5 Å²	5	40.8 Å²	40.8	5%	0.052	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	131.1	173.4	0	0	0	0	0	110.6	S508 K509	S508-G516 CarbonylContact C-O 3.46Å; S508-G516 WeakPolarHBondContact CA-O 3.45Å; K509-G516 PolarHBondContact N-O 3.3Å; K509-G516 PolarHBondContact O-N 2.88Å
517	V	91.9	Very high	90.5	Very high	28 Å²	28	39.1 Å²	39.1	17%	0.17	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	110.5	178.2	-174.2	0	0	0	0	107.8	T506 I515 M519 C540 A541	T506-V517 HydrophobicContact CG2-CG1 4.19Å; I515-V517 HydrophobicContact CG2-CG2 4.24Å; V517-M519 HydrophobicContact CG1-CE 4.02Å; V517-M519 HydrophobicContact CG1-SD 4.15Å; V517-C540 WeakPolarHBondContact O-CA 3.35Å; V517-A541 WeakPolarHBondContact CA-O 3.4Å; V517-A541 HydrophobicContact CB-CB 4.4Å; V517-A541 PolarHBondContact N-O 2.88Å; V517-A541 PolarHBondContact O-N 3.46Å
518	S	92.3	Very high	90.9	Very high	53 Å²	53	35.9 Å²	35.9	37%	0.371	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	122.6	172.9	-54.9	0	0	0	0	108.9	T506 K507	T506-S518 WeakPolarHBondContact CA-O 3.31Å; K507-S518 PolarHBondContact N-O 3.44Å; K507-S518 PolarHBondContact O-N 3.39Å
519	M	91.4	Very high	91	Very high	33 Å²	33	40.6 Å²	40.6	16%	0.163	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	115.9	172.6	-55.6	-59	-176.4	0	0	107.7	V504 T506 V517 L538 P539 A541	V504-M519 HydrophobicContact CG1-CB 4.34Å; T506-M519 HydrophobicContact CG2-CE 4.44Å; T506-M519 HydrophobicContact CG2-SD 3.37Å; T506-M519 WeakPolarHBondContact CG2-SD 3.34Å; V517-M519 HydrophobicContact CG1-CE 4.02Å; V517-M519 HydrophobicContact CG1-SD 4.15Å; M519-L538 HydrophobicContact CB-CB 3.86Å; M519-L538 HydrophobicContact CG-CB 4.4Å; M519-P539 WeakPolarHBondContact CG-O 3.24Å; M519-A541 HydrophobicContact CE-CB 4.03Å
520	I	91.9	Very high	91.3	Very high	60 Å²	60	38.6 Å²	38.6	31%	0.308	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	125.8	-177.8	-56.7	168.6	0	0	0	107.6	V504 W505 K507	V504-I520 CarbonylContact C-O 3.53Å; V504-I520 WeakPolarHBondContact CA-O 3.49Å; W505-I520 VanDerWaalsContact CD1-O 3.25Å; W505-I520 HydrophobicContact CD2-CB 4.1Å; W505-I520 HydrophobicContact CD2-CD1 4.32Å; W505-I520 HydrophobicContact CE3-CD1 4.29Å; W505-I520 HydrophobicContact CG-CB 4.37Å; W505-I520 HydrophobicContact CH2-CD1 3.44Å; W505-I520 VanDerWaalsContact CH2-CD1 3.44Å; W505-I520 HydrophobicContact CZ2-CB 4Å; W505-I520 HydrophobicContact CZ2-CD1 3.44Å; W505-I520 VanDerWaalsContact CZ2-CD1 3.44Å; W505-I520 HydrophobicContact CZ2-CG1 4.32Å; W505-I520 HydrophobicContact CZ2-CG2 3.75Å; W505-I520 HydrophobicContact CZ3-CD1 3.88Å; W505-I520 PolarHBondContact N-O 2.69Å; W505-I520 VanDerWaalsContact NE1-CG2 3.3Å; W505-I520 PolarHBondContact O-N 3Å; W505-I520 VanDerWaalsContact O-O 3.1Å; K507-I520 HydrophobicContact CB-CD1 3.98Å
521	G	91.8	Very high	91.6	Very high	20 Å²	20	44.3 Å²	44.3	21%	0.206	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151.8	173.1	-173	0	0	0	0	0	111.2	H503	H503-G521 WeakPolarHBondContact O-CA 3.14Å
522	E	93.4	Very high	92.3	Very high	94 Å²	94	40.8 Å²	40.8	44%	0.439	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	144.3	178	-173	173.1	74.4	0	0	109	T502 H503	T502-E522 WeakPolarHBondContact CA-O 3.19Å; H503-E522 PolarHBondContact N-O 2.9Å; H503-E522 PolarHBondContact O-N 3.3Å
523	G	96	Very high	93.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	150.2	170.2	0	0	0	0	0	110.7	N501 T502 T535 F536	N501-G523 CarbonylContact O-C 3.53Å; N501-G523 WeakPolarHBondContact O-CA 3.02Å; T502-G523 WeakPolarHBondContact OG1-CA 3.05Å; G523-T535 CarbonylContact O-C 3.56Å; G523-T535 WeakPolarHBondContact O-CA 3.41Å; G523-F536 VanDerWaalsContact C-CD1 3.43Å; G523-F536 PolarHBondContact N-O 3.39Å; G523-F536 WeakPolarHBondContact O-CD1 3.29Å; G523-F536 PolarHBondContact O-N 2.98Å
524	C	96.8	Very high	94.1	Very high	16 Å²	16	39 Å²	39	11%	0.108	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	109.2	-177.5	-168.8	0	0	0	0	110.1	V500 N501 H526 E533 Y534	V500-C524 WeakPolarHBondContact CA-O 3.33Å; N501-C524 PolarHBondContact N-O 2.87Å; N501-C524 PolarHBondContact O-N 3.46Å; C524-H526 PolarHBondContact SG-CE1 2.93Å; C524-E533 VanDerWaalsContact SG-CD 3.59Å; C524-E533 WeakPolarHBondContact SG-CG 3.37Å; C524-E533 PolarHBondContact SG-OE1 3.33Å; C524-Y534 WeakPolarHBondContact CA-O 3.37Å
525	L	97.8	Very high	94.6	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	127.5	173.2	168.9	68.2	0	0	0	109.3	F399 I402 F415 V500 L527 E533 Y534 F536	F399-L525 HydrophobicContact CE2-CD1 3.91Å; F399-L525 HydrophobicContact CZ-CD1 4.28Å; I402-L525 HydrophobicContact CD1-CD2 4.04Å; I402-L525 HydrophobicContact CG2-CD2 4.32Å; F415-L525 HydrophobicContact CD1-CD2 3.95Å; F415-L525 HydrophobicContact CD2-CD2 3.77Å; F415-L525 HydrophobicContact CE1-CB 4.34Å; F415-L525 HydrophobicContact CE1-CD2 4.02Å; F415-L525 HydrophobicContact CE2-CD2 3.87Å; F415-L525 HydrophobicContact CG-CD2 3.85Å; F415-L525 HydrophobicContact CZ-CB 4.17Å; F415-L525 HydrophobicContact CZ-CD2 3.99Å; V500-L525 HydrophobicContact CB-CD1 4.35Å; L525-L527 HydrophobicContact CD1-CD2 4.08Å; L525-L527 HydrophobicContact CD2-CD2 4.17Å; L525-L527 HydrophobicContact CG-CD2 4.08Å; L525-E533 CarbonylContact O-C 3.49Å; L525-E533 WeakPolarHBondContact O-CA 3.49Å; L525-Y534 HydrophobicContact CD2-CD2 4.42Å; L525-Y534 PolarHBondContact N-O 2.95Å; L525-Y534 PolarHBondContact O-N 2.99Å; L525-F536 HydrophobicContact CB-CE1 4.48Å
526	H	97.4	Very high	95	Very high	27 Å²	27	40.2 Å²	40.2	13%	0.125	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	124.4	175	-61.2	79	0	0	0	109.5	M498 C499 C524 L528 W708	M498-H526 VanDerWaalsContact CA-O 3.32Å; M498-H526 WeakPolarHBondContact CA-O 3.42Å; C499-H526 PolarHBondContact N-O 2.83Å; C499-H526 VanDerWaalsContact N-O 3.11Å; C499-H526 PolarHBondContact O-N 2.88Å; C524-H526 PolarHBondContact SG-CE1 2.93Å; H526-L528 HydrophobicContact CB-CD2 3.9Å; H526-W708 HydrophobicContact CB-CE3 4.43Å; H526-W708 AromaticContact CE1-CE3 3.83Å; H526-W708 AromaticContact CE1-CZ3 3.75Å; H526-W708 AromaticContact CG-CE3 3.89Å; H526-W708 AromaticContact ND1-CE3 3.66Å; H526-W708 AromaticContact ND1-CZ3 3.63Å
527	L	96.9	Very high	95.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	93.8	168.7	-53	-174.4	0	0	0	107.3	I402 R411 M498 L525 E529 H530 D531 E532 Y534	I402-L527 HydrophobicContact CG2-CD1 3.94Å; I402-L527 HydrophobicContact CG2-CD2 4.18Å; R411-L527 HydrophobicContact CB-CD1 4.47Å; M498-L527 HydrophobicContact CB-CD2 4.16Å; M498-L527 HydrophobicContact CE-CD2 3.44Å; M498-L527 VanDerWaalsContact CE-CD2 3.44Å; L525-L527 HydrophobicContact CD1-CD2 4.08Å; L525-L527 HydrophobicContact CD2-CD2 4.17Å; L525-L527 HydrophobicContact CG-CD2 4.08Å; L527-E529 PolarHBondContact O-N 3.47Å; L527-H530 HydrophobicContact CB-CB 4.44Å; L527-H530 PolarHBondContact O-N 2.84Å; L527-D531 PolarHBondContact O-N 3.37Å; L527-E532 HydrophobicContact CB-CB 4.39Å; L527-E532 PolarHBondContact N-O 2.73Å; L527-E532 PolarHBondContact O-N 2.95Å; L527-Y534 HydrophobicContact CD1-CD2 4.36Å; L527-Y534 HydrophobicContact CD1-CE2 3.52Å; L527-Y534 HydrophobicContact CG-CD2 4.33Å; L527-Y534 HydrophobicContact CG-CE2 3.89Å
528	L	95	Very high	95.3	Very high	41 Å²	41	41.5 Å²	41.5	22%	0.215	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-33.3	-168	-51	176	0	0	0	112.2	Q497 H526 H530 D531 L707 W708	Q497-L528 HydrophobicContact CB-CB 4.04Å; Q497-L528 HydrophobicContact CB-CD1 4.43Å; Q497-L528 WeakPolarHBondContact O-CB 3.48Å; Q497-L528 WeakPolarHBondContact O-CG 3.14Å; Q497-L528 PolarHBondContact O-N 3.47Å; H526-L528 HydrophobicContact CB-CD2 3.9Å; L528-H530 PolarHBondContact O-N 2.75Å; L528-D531 PolarHBondContact O-N 3.16Å; L528-D531 VanDerWaalsContact O-N 3.12Å; L528-L707 HydrophobicContact CD1-CB 4.23Å; L528-L707 HydrophobicContact CD1-CD2 3.87Å; L528-L707 HydrophobicContact CD1-CG 3.74Å; L528-W708 HydrophobicContact CD1-CB 4.45Å; L528-W708 HydrophobicContact CD2-CB 3.54Å
529	E	93.6	Very high	95.4	Very high	121 Å²	121	39.2 Å²	39.2	57%	0.565	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-36.4	175.3	-173.4	-179.5	179.7	0	0	112.2	T403 L527	T403-E529 PolarHBondContact OG1-OE2 3.47Å; L527-E529 PolarHBondContact O-N 3.47Å
530	H	93.9	Very high	95.5	Very high	47 Å²	47	39.1 Å²	39.1	22%	0.218	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-6.3	179.4	-59.4	-75.2	0	0	0	112.9	T403 R411 L527 L528 E532 K564	T403-H530 PolarHBondContact O-NE2 2.81Å; T403-H530 PolarHBondContact OG1-CD2 2.87Å; T403-H530 VanDerWaalsContact OG1-CD2 3.3Å; T403-H530 PolarHBondContact OG1-NE2 2.74Å; R411-H530 PolarHBondContact NH1-ND1 2.89Å; L527-H530 HydrophobicContact CB-CB 4.44Å; L527-H530 PolarHBondContact O-N 2.84Å; L528-H530 PolarHBondContact O-N 2.75Å; H530-E532 HydrophobicContact CB-CB 4.25Å; H530-E532 HydrophobicContact CB-CG 3.97Å; H530-E532 PolarHBondContact O-N 3.33Å; H530-K564 PolarHBondContact O-NZ 3.4Å
531	D	94.9	Very high	95.5	Very high	122 Å²	122	36.6 Å²	36.6	65%	0.652	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.9	46.2	-169.3	172.1	59.7	0	0	0	110.4	L527 L528 K564	L527-D531 PolarHBondContact O-N 3.37Å; L528-D531 PolarHBondContact O-N 3.16Å; L528-D531 VanDerWaalsContact O-N 3.12Å; D531-K564 VanDerWaalsContact CG-NZ 3.29Å; D531-K564 WeakPolarHBondContact O-CD 3.42Å; D531-K564 WeakPolarHBondContact O-CE 3.41Å; D531-K564 PolarHBondContact O-NZ 3.32Å; D531-K564 IonicContact OD2-NZ 3.82Å; D531-K564 PolarHBondContact OD2-NZ 3.38Å
532	E	96.7	Very high	95.5	Very high	10 Å²	10	38 Å²	38	5%	0.047	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	139.9	-178.9	-75.9	178.7	162	0	0	111.9	R411 L527 H530 Y534 K564	R411-E532 IonicContact CZ-OE1 3.09Å; R411-E532 IonicContact CZ-OE2 3.18Å; R411-E532 IonicContact NE-OE1 2.59Å; R411-E532 IonicContact NE-OE2 3.04Å; R411-E532 PolarHBondContact NE-OE2 3.19Å; R411-E532 IonicContact NH2-OE1 2.83Å; R411-E532 PolarHBondContact NH2-OE1 2.77Å; R411-E532 IonicContact NH2-OE2 3.21Å; R411-E532 PolarHBondContact NH2-OE2 2.95Å; R411-E532 VanDerWaalsContact NH2-OE2 3.12Å; L527-E532 HydrophobicContact CB-CB 4.39Å; L527-E532 PolarHBondContact N-O 2.73Å; L527-E532 PolarHBondContact O-N 2.95Å; H530-E532 HydrophobicContact CB-CB 4.25Å; H530-E532 HydrophobicContact CB-CG 3.97Å; H530-E532 PolarHBondContact O-N 3.33Å; E532-Y534 HydrophobicContact CB-CD2 4.49Å; E532-Y534 HydrophobicContact CB-CE2 3.77Å; E532-Y534 PolarHBondContact OE2-OH 3.43Å; E532-K564 HydrophobicContact CG-CD 4.24Å
533	E	97	Very high	95.3	Very high	102 Å²	102	34.8 Å²	34.8	48%	0.477	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	129.2	178.9	-170.9	-173.9	153	0	0	109.2	C524 L525 C562	C524-E533 VanDerWaalsContact SG-CD 3.59Å; C524-E533 WeakPolarHBondContact SG-CG 3.37Å; C524-E533 PolarHBondContact SG-OE1 3.33Å; L525-E533 CarbonylContact O-C 3.49Å; L525-E533 WeakPolarHBondContact O-CA 3.49Å; E533-C562 WeakPolarHBondContact O-CA 3.42Å; E533-C562 WeakPolarHBondContact O-CB 3.46Å; E533-C562 PolarHBondContact O-SG 2.87Å
534	Y	98.4	Very high	94.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	113.1	179.4	-61.6	-106.3	0	0	0	109.7	R411 M412 F415 C524 L525 L527 E532 I560 A561 C562	R411-Y534 WeakPolarHBondContact CB-OH 3.32Å; M412-Y534 HydrophobicContact CB-CE1 4.33Å; M412-Y534 HydrophobicContact CE-CD1 3.64Å; M412-Y534 HydrophobicContact CE-CE1 3.6Å; M412-Y534 HydrophobicContact SD-CD1 4.09Å; M412-Y534 HydrophobicContact SD-CE1 4.04Å; F415-Y534 AromaticContact CD1-CD1 3.84Å; F415-Y534 HydrophobicContact CD1-CD1 3.84Å; F415-Y534 AromaticContact CD1-CG 4Å; F415-Y534 HydrophobicContact CD1-CG 4Å; F415-Y534 HydrophobicContact CE1-CD1 4.44Å; F415-Y534 HydrophobicContact CE1-CG 4.27Å; C524-Y534 WeakPolarHBondContact CA-O 3.37Å; L525-Y534 HydrophobicContact CD2-CD2 4.42Å; L525-Y534 PolarHBondContact N-O 2.95Å; L525-Y534 PolarHBondContact O-N 2.99Å; L527-Y534 HydrophobicContact CD1-CD2 4.36Å; L527-Y534 HydrophobicContact CD1-CE2 3.52Å; L527-Y534 HydrophobicContact CG-CD2 4.33Å; L527-Y534 HydrophobicContact CG-CE2 3.89Å; E532-Y534 HydrophobicContact CB-CD2 4.49Å; E532-Y534 HydrophobicContact CB-CE2 3.77Å; E532-Y534 PolarHBondContact OE2-OH 3.43Å; Y534-I560 HydrophobicContact CD1-CG2 4.42Å; Y534-A561 CarbonylContact C-O 3.5Å; Y534-A561 VanDerWaalsContact CA-O 3.31Å; Y534-A561 WeakPolarHBondContact CA-O 3.33Å; Y534-C562 HydrophobicContact CD1-CB 3.7Å; Y534-C562 HydrophobicContact CE1-CB 3.75Å; Y534-C562 HydrophobicContact CG-CB 4.15Å
535	T	97.8	Very high	94.3	Very high	45 Å²	45	39 Å²	39	28%	0.276	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	137.9	173.3	59	0	0	0	0	110	G523 I560 A561	G523-T535 CarbonylContact O-C 3.56Å; G523-T535 WeakPolarHBondContact O-CA 3.41Å; T535-I560 CarbonylContact O-C 3.53Å; T535-I560 VanDerWaalsContact O-CA 3.28Å; T535-I560 WeakPolarHBondContact O-CA 3.26Å; T535-A561 PolarHBondContact N-O 3.15Å; T535-A561 PolarHBondContact O-N 2.99Å
536	F	97.7	Very high	93.5	Very high	19 Å²	19	39.7 Å²	39.7	8%	0.083	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	155.3	-179.5	67.6	-84.8	0	0	0	113.5	F415 Y419 V500 G523 L525 N559 I560	F415-F536 HydrophobicContact CE1-CB 4.49Å; F415-F536 HydrophobicContact CE1-CD1 4.04Å; F415-F536 HydrophobicContact CE1-CG 4.47Å; F415-F536 HydrophobicContact CZ-CB 4.41Å; F415-F536 AromaticContact CZ-CD1 3.55Å; F415-F536 HydrophobicContact CZ-CD1 3.55Å; F415-F536 AromaticContact CZ-CE1 3.88Å; F415-F536 HydrophobicContact CZ-CE1 3.88Å; F415-F536 AromaticContact CZ-CG 3.98Å; F415-F536 HydrophobicContact CZ-CG 3.98Å; Y419-F536 HydrophobicContact CD2-CD2 4.29Å; Y419-F536 AromaticContact CE2-CD2 3.78Å; Y419-F536 HydrophobicContact CE2-CD2 3.78Å; Y419-F536 HydrophobicContact CE2-CE2 4.23Å; V500-F536 HydrophobicContact CG2-CE1 3.79Å; V500-F536 HydrophobicContact CG2-CZ 3.76Å; G523-F536 VanDerWaalsContact C-CD1 3.43Å; G523-F536 PolarHBondContact N-O 3.39Å; G523-F536 WeakPolarHBondContact O-CD1 3.29Å; G523-F536 PolarHBondContact O-N 2.98Å; L525-F536 HydrophobicContact CB-CE1 4.48Å; F536-N559 VanDerWaalsContact CA-O 3.25Å; F536-N559 WeakPolarHBondContact CA-O 3.21Å; F536-I560 HydrophobicContact CB-CB 4.45Å; F536-I560 HydrophobicContact CB-CG1 3.85Å
537	T	95.8	Very high	92.4	Very high	41 Å²	41	40.8 Å²	40.8	25%	0.252	21%	0.214	S	C	.	.			trans	-113.2	170.9	177.1	63.3	0	0	0	0	111.4	Y419 V558 N559	Y419-T537 PolarHBondContact OH-O 3.4Å; T537-V558 WeakPolarHBondContact O-CG1 3.43Å; T537-V558 WeakPolarHBondContact OG1-CA 3.46Å; T537-N559 PolarHBondContact N-O 2.88Å; T537-N559 PolarHBondContact OG1-N 3.01Å
538	L	94.2	Very high	91.4	Very high	19 Å²	19	44.6 Å²	44.6	10%	0.099	24%	0.237	C	C	.	.			trans	-104.8	152.6	175.3	-68.2	102.3	0	0	0	112.6	Y389 F392 T502 V504 M519	Y389-L538 HydrophobicContact CE1-CD2 3.69Å; F392-L538 HydrophobicContact CE2-CD2 4.16Å; T502-L538 HydrophobicContact CG2-CD1 4.3Å; V504-L538 HydrophobicContact CG2-CD1 3.57Å; M519-L538 HydrophobicContact CB-CB 3.86Å; M519-L538 HydrophobicContact CG-CB 4.4Å
539	P	94.8	Very high	90.6	Very high	6 Å²	6	45.9 Å²	45.9	4%	0.039	25%	0.246	C	C	.	.			trans	-72.4	158.6	175.3	32.2	-36.1	0	0	0	111.5	Y419 F423 M519 L554 V558 F573	Y419-P539 VanDerWaalsContact OH-CD 3.31Å; Y419-P539 WeakPolarHBondContact OH-CD 3.14Å; F423-P539 HydrophobicContact CE1-CG 3.84Å; F423-P539 HydrophobicContact CZ-CG 3.96Å; M519-P539 WeakPolarHBondContact CG-O 3.24Å; P539-L554 HydrophobicContact CG-CD1 4.34Å; P539-L554 HydrophobicContact CG-CD2 4.34Å; P539-V558 HydrophobicContact CB-CG2 4.01Å; P539-F573 HydrophobicContact CB-CD2 3.65Å; P539-F573 HydrophobicContact CB-CE2 3.89Å; P539-F573 HydrophobicContact CB-CG 4.12Å; P539-F573 HydrophobicContact CG-CD2 4.31Å; P539-F573 HydrophobicContact CG-CE2 4.08Å; P539-F573 HydrophobicContact CG-CZ 4.34Å
540	C	93.3	Very high	90.2	Very high	31 Å²	31	41 Å²	41	21%	0.209	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	152.6	166.3	-63.6	0	0	0	0	110.1	V517 Y542 L554 G555	V517-C540 WeakPolarHBondContact O-CA 3.35Å; C540-Y542 HydrophobicContact CB-CE2 4.02Å; C540-L554 WeakPolarHBondContact O-CA 3.45Å; C540-G555 WeakPolarHBondContact CA-O 3.27Å; C540-G555 WeakPolarHBondContact CB-O 3.44Å; C540-G555 PolarHBondContact N-O 3.19Å; C540-G555 PolarHBondContact O-N 2.91Å
541	A	92.4	Very high	89.8	Confident	7 Å²	7	41.3 Å²	41.3	6%	0.058	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	147.1	172.7	0	0	0	0	0	110.4	V517 M519 E553 L554	V517-A541 WeakPolarHBondContact CA-O 3.4Å; V517-A541 HydrophobicContact CB-CB 4.4Å; V517-A541 PolarHBondContact N-O 2.88Å; V517-A541 PolarHBondContact O-N 3.46Å; M519-A541 HydrophobicContact CE-CB 4.03Å; A541-E553 CarbonylContact C-O 3.55Å; A541-E553 WeakPolarHBondContact CA-O 3.1Å; A541-L554 HydrophobicContact CB-CD2 4.19Å
542	Y	91.1	Very high	89.5	Confident	50 Å²	50	36.8 Å²	36.8	20%	0.196	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	122.2	177.1	-59.6	-92.1	0	0	0	109	M511 I515 C540 R544 E553 T575	M511-Y542 HydrophobicContact CE-CE1 4.4Å; M511-Y542 HydrophobicContact SD-CD1 4.04Å; M511-Y542 HydrophobicContact SD-CE1 3.88Å; I515-Y542 CarbonylContact O-C 3.56Å; I515-Y542 VanDerWaalsContact O-CA 3.28Å; I515-Y542 WeakPolarHBondContact O-CA 3.41Å; C540-Y542 HydrophobicContact CB-CE2 4.02Å; Y542-R544 PolarHBondContact O-N 3.07Å; Y542-E553 PolarHBondContact N-O 3.39Å; Y542-E553 PolarHBondContact O-N 3.27Å; Y542-T575 HydrophobicContact CD2-CG2 4.01Å; Y542-T575 HydrophobicContact CE2-CG2 3.88Å
543	A	90.1	Very high	89.2	Confident	25 Å²	25	36.4 Å²	36.4	21%	0.207	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	108.3	165.2	0	0	0	0	0	107.8	S514 I515 I546	S514-A543 CarbonylContact C-O 3.59Å; S514-A543 WeakPolarHBondContact CA-O 3.27Å; S514-A543 VanDerWaalsContact CB-O 3.24Å; S514-A543 WeakPolarHBondContact CB-O 3.37Å; I515-A543 HydrophobicContact CB-CB 4.26Å; I515-A543 PolarHBondContact N-O 2.94Å; I515-A543 PolarHBondContact O-N 3Å; A543-I546 HydrophobicContact CB-CG2 4.31Å
544	R	87.5	Confident	89.1	Confident	56 Å²	56	31.9 Å²	31.9	21%	0.211	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	163	179.4	-62.4	-59	-166.6	173	5.7	110.2	S514 Y542 I546 P550 W551 E553	S514-R544 PolarHBondContact OG-NH1 3.48Å; Y542-R544 PolarHBondContact O-N 3.07Å; R544-I546 VanDerWaalsContact C-N 3.27Å; R544-I546 PolarHBondContact O-N 3.37Å; R544-P550 WeakPolarHBondContact O-CA 3.32Å; R544-W551 HydrophobicContact CB-CD2 3.93Å; R544-W551 HydrophobicContact CB-CG 4.25Å; R544-W551 HydrophobicContact CB-CH2 4.4Å; R544-W551 HydrophobicContact CB-CZ2 3.64Å; R544-W551 HydrophobicContact CG-CD2 4.34Å; R544-W551 HydrophobicContact CG-CH2 3.93Å; R544-W551 HydrophobicContact CG-CZ2 3.6Å; R544-W551 HydrophobicContact CG-CZ3 4.45Å; R544-W551 PolarHBondContact N-O 2.92Å; R544-W551 PolarHBondContact O-N 3.06Å; R544-E553 HydrophobicContact CG-CB 4.11Å; R544-E553 IonicContact CZ-OE2 3.44Å; R544-E553 IonicContact NE-OE2 3.17Å; R544-E553 PolarHBondContact NE-OE2 3.42Å; R544-E553 IonicContact NH2-OE2 2.91Å; R544-E553 PolarHBondContact NH2-OE2 3.39Å
545	S	83.3	Confident	88.8	Confident	48 Å²	48	31.9 Å²	31.9	34%	0.336	18%	0.179	S	C	.	.			trans	57.6	34.8	169.1	-62.2	0	0	0	0	114.9	M513 L547 T548 V549 W551	M513-S545 PolarHBondContact O-N 3.47Å; S545-L547 PolarHBondContact O-N 3.46Å; S545-T548 WeakPolarHBondContact CB-OG1 3.19Å; S545-T548 CarbonylContact O-C 3.56Å; S545-T548 PolarHBondContact O-N 2.86Å; S545-T548 PolarHBondContact O-OG1 3.38Å; S545-T548 VanDerWaalsContact O-OG1 3.07Å; S545-V549 VanDerWaalsContact CB-O 3.27Å; S545-V549 WeakPolarHBondContact CB-O 3.47Å; S545-V549 CarbonylContact O-C 3.56Å; S545-W551 PolarHBondContact OG-NE1 3.38Å
546	I	82.4	Confident	88.5	Confident	16 Å²	16	31.2 Å²	31.2	8%	0.082	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-9.7	-175.3	68	-177.8	0	0	0	115.3	I357 L361 F510 G512 I515 A543 R544	I357-I546 WeakPolarHBondContact CG2-O 3.38Å; L361-I546 HydrophobicContact CD1-CG1 4.39Å; L361-I546 HydrophobicContact CD2-CD1 3.72Å; L361-I546 HydrophobicContact CD2-CG1 4.37Å; F510-I546 HydrophobicContact CD2-CD1 4.34Å; F510-I546 HydrophobicContact CE2-CD1 3.65Å; G512-I546 WeakPolarHBondContact O-CD1 3.13Å; I515-I546 HydrophobicContact CD1-CD1 4.49Å; I515-I546 HydrophobicContact CD1-CG2 4.28Å; I515-I546 HydrophobicContact CG1-CD1 4.19Å; I515-I546 HydrophobicContact CG1-CG2 4.31Å; A543-I546 HydrophobicContact CB-CG2 4.31Å; R544-I546 VanDerWaalsContact C-N 3.27Å; R544-I546 PolarHBondContact O-N 3.37Å
547	L	72.9	Confident	88.4	Confident	51 Å²	51	37.4 Å²	37.4	27%	0.267	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-9.9	174.8	-77.3	172.9	0	0	0	113.5	L55 L358 L361 S545	L55-L547 HydrophobicContact CD1-CD1 4.11Å; L55-L547 HydrophobicContact CD1-CD2 4.31Å; L55-L547 HydrophobicContact CD1-CG 4.2Å; L55-L547 HydrophobicContact CD2-CD1 4.05Å; L358-L547 HydrophobicContact CD2-CD2 3.75Å; L361-L547 HydrophobicContact CD1-CD2 3.23Å; L361-L547 HydrophobicContact CD1-CG 3.91Å; S545-L547 PolarHBondContact O-N 3.46Å
548	T	76.1	Confident	88.4	Confident	80 Å²	80	35.4 Å²	35.4	49%	0.491	20%	0.195	S	C	.	.	S	Bend	trans	-129.7	-130.8	-176.7	53.9	0	0	0	0	107.5	V350 S545 P550	V350-T548 WeakPolarHBondContact CG1-O 3.44Å; S545-T548 WeakPolarHBondContact CB-OG1 3.19Å; S545-T548 CarbonylContact O-C 3.56Å; S545-T548 PolarHBondContact O-N 2.86Å; S545-T548 PolarHBondContact O-OG1 3.38Å; S545-T548 VanDerWaalsContact O-OG1 3.07Å; T548-P550 WeakPolarHBondContact O-CD 3.32Å
549	V	79.7	Confident	88.6	Confident	67 Å²	67	38.5 Å²	38.5	41%	0.406	21%	0.212	S	C	.	.	S	Bend	trans	-85.5	112.6	170.2	-175.4	0	0	0	0	108.7	L347 I431 S545	L347-V549 HydrophobicContact CD2-CG1 3.98Å; L347-V549 HydrophobicContact CD2-CG2 4.1Å; I431-V549 HydrophobicContact CG1-CG1 3.94Å; S545-V549 VanDerWaalsContact CB-O 3.27Å; S545-V549 WeakPolarHBondContact CB-O 3.47Å; S545-V549 CarbonylContact O-C 3.56Å
550	P	83.9	Confident	88.7	Confident	20 Å²	20	38.2 Å²	38.2	13%	0.13	21%	0.21	C	C	.	.			trans	-73.8	144.7	-179	33	-36.5	0	0	0	110.3	I431 A432 R544 T548	I431-P550 CarbonylContact C-O 3.57Å; I431-P550 WeakPolarHBondContact CA-O 3.46Å; I431-P550 HydrophobicContact CG2-CG 4.01Å; A432-P550 HydrophobicContact CB-CB 4.07Å; A432-P550 HydrophobicContact CB-CG 4.46Å; A432-P550 PolarHBondContact N-O 2.95Å; R544-P550 WeakPolarHBondContact O-CA 3.32Å; T548-P550 WeakPolarHBondContact O-CD 3.32Å
551	W	85.9	Confident	89	Confident	53 Å²	53	38.3 Å²	38.3	20%	0.201	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	154.8	176.8	63.1	-83.9	0	0	0	111.1	R544 S545 E553 L583 H584	R544-W551 HydrophobicContact CB-CD2 3.93Å; R544-W551 HydrophobicContact CB-CG 4.25Å; R544-W551 HydrophobicContact CB-CH2 4.4Å; R544-W551 HydrophobicContact CB-CZ2 3.64Å; R544-W551 HydrophobicContact CG-CD2 4.34Å; R544-W551 HydrophobicContact CG-CH2 3.93Å; R544-W551 HydrophobicContact CG-CZ2 3.6Å; R544-W551 HydrophobicContact CG-CZ3 4.45Å; R544-W551 PolarHBondContact N-O 2.92Å; R544-W551 PolarHBondContact O-N 3.06Å; S545-W551 PolarHBondContact OG-NE1 3.38Å; W551-E553 HydrophobicContact CE3-CB 4.22Å; W551-E553 HydrophobicContact CH2-CB 3.91Å; W551-E553 HydrophobicContact CH2-CG 4.1Å; W551-E553 HydrophobicContact CZ3-CB 3.51Å; W551-E553 HydrophobicContact CZ3-CG 3.93Å; W551-L583 HydrophobicContact CH2-CD2 3.58Å; W551-L583 HydrophobicContact CZ2-CD2 4.24Å; W551-L583 HydrophobicContact CZ3-CD2 4.1Å; W551-H584 AromaticContact CZ3-CE1 3.95Å
552	V	89.2	Confident	89.2	Confident	27 Å²	27	38 Å²	38	16%	0.164	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	130.9	-175.4	-178.1	0	0	0	0	110.8	A432 H584	A432-V552 HydrophobicContact CB-CG2 3.47Å; A432-V552 VanDerWaalsContact CB-CG2 3.47Å; V552-H584 PolarHBondContact O-CE1 2.89Å
553	E	91	Very high	89.4	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	131.5	171	-171.6	173.1	-127.6	0	0	110	A541 Y542 R544 W551 T575 K576	A541-E553 CarbonylContact C-O 3.55Å; A541-E553 WeakPolarHBondContact CA-O 3.1Å; Y542-E553 PolarHBondContact N-O 3.39Å; Y542-E553 PolarHBondContact O-N 3.27Å; R544-E553 HydrophobicContact CG-CB 4.11Å; R544-E553 IonicContact CZ-OE2 3.44Å; R544-E553 IonicContact NE-OE2 3.17Å; R544-E553 PolarHBondContact NE-OE2 3.42Å; R544-E553 IonicContact NH2-OE2 2.91Å; R544-E553 PolarHBondContact NH2-OE2 3.39Å; W551-E553 HydrophobicContact CE3-CB 4.22Å; W551-E553 HydrophobicContact CH2-CB 3.91Å; W551-E553 HydrophobicContact CH2-CG 4.1Å; W551-E553 HydrophobicContact CZ3-CB 3.51Å; W551-E553 HydrophobicContact CZ3-CG 3.93Å; E553-T575 HydrophobicContact CG-CG2 4.38Å; E553-K576 VanDerWaalsContact OE1-CB 3.32Å; E553-K576 WeakPolarHBondContact OE1-CB 3.49Å; E553-K576 PolarHBondContact OE1-N 2.9Å
554	L	93	Very high	89.6	Confident	8 Å²	8	47.8 Å²	47.8	4%	0.042	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	143.7	170.1	-60.7	-178.3	0	0	0	110.1	F423 P539 C540 A541 F573 W606	F423-L554 HydrophobicContact CB-CD1 4.04Å; F423-L554 HydrophobicContact CD1-CD1 3.87Å; F423-L554 HydrophobicContact CG-CD1 3.9Å; P539-L554 HydrophobicContact CG-CD1 4.34Å; P539-L554 HydrophobicContact CG-CD2 4.34Å; C540-L554 WeakPolarHBondContact O-CA 3.45Å; A541-L554 HydrophobicContact CB-CD2 4.19Å; L554-F573 HydrophobicContact CB-CB 4.21Å; L554-F573 HydrophobicContact CB-CD1 3.7Å; L554-F573 HydrophobicContact CB-CE1 4.38Å; L554-F573 HydrophobicContact CB-CG 4.13Å; L554-F573 HydrophobicContact CD1-CD1 4.02Å; L554-F573 HydrophobicContact CD1-CE1 3.84Å; L554-W606 HydrophobicContact CB-CZ2 4.46Å; L554-W606 HydrophobicContact CD1-CD2 3.96Å; L554-W606 HydrophobicContact CD1-CE3 4.2Å; L554-W606 HydrophobicContact CD1-CG 4.49Å; L554-W606 HydrophobicContact CD1-CH2 4.28Å; L554-W606 HydrophobicContact CD1-CZ2 3.99Å; L554-W606 HydrophobicContact CD1-CZ3 4.35Å; L554-W606 HydrophobicContact CG-CH2 4.4Å; L554-W606 HydrophobicContact CG-CZ2 3.87Å
555	G	92.8	Very high	90	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	165.4	179.1	0	0	0	0	0	113.7	C540 F573	C540-G555 WeakPolarHBondContact CA-O 3.27Å; C540-G555 WeakPolarHBondContact CB-O 3.44Å; C540-G555 PolarHBondContact N-O 3.19Å; C540-G555 PolarHBondContact O-N 2.91Å; G555-F573 CarbonylContact C-O 3.58Å; G555-F573 WeakPolarHBondContact CA-O 3.49Å
556	G	92	Very high	90.6	Very high	31 Å²	31	44.2 Å²	44.2	32%	0.32	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	96.6	-176.5	176.9	0	0	0	0	0	113.3	F573	G556-F573 PolarHBondContact N-O 3.37Å; G556-F573 VanDerWaalsContact N-O 3.08Å; G556-F573 PolarHBondContact O-N 3.48Å
557	K	94.8	Very high	91.4	Very high	148 Å²	148	44.9 Å²	44.9	64%	0.643	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-105.9	136.2	-177.9	-65.2	-174.6	179.1	-177.4	0	110.1	I571 T572	K557-I571 CarbonylContact C-O 3.3Å; K557-I571 WeakPolarHBondContact CA-O 3.31Å; K557-T572 HydrophobicContact CG-CG2 4.33Å
558	V	97.1	Very high	92.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	139.4	172.6	166.1	0	0	0	0	107.8	Y419 T537 P539 I560 I571 F573	Y419-V558 HydrophobicContact CE1-CG1 3.91Å; T537-V558 WeakPolarHBondContact O-CG1 3.43Å; T537-V558 WeakPolarHBondContact OG1-CA 3.46Å; P539-V558 HydrophobicContact CB-CG2 4.01Å; V558-I560 HydrophobicContact CG1-CG1 4.46Å; V558-I571 HydrophobicContact CB-CB 4.17Å; V558-I571 HydrophobicContact CG1-CD1 4.42Å; V558-I571 PolarHBondContact N-O 2.82Å; V558-I571 PolarHBondContact O-N 3.46Å; V558-F573 HydrophobicContact CG2-CD2 4.4Å; V558-F573 HydrophobicContact CG2-CE2 4.15Å
559	N	97	Very high	93.7	Very high	84 Å²	84	39.5 Å²	39.5	45%	0.449	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	140.3	172.7	-55.8	-69.5	0	0	0	108.8	F536 T537 A569	F536-N559 VanDerWaalsContact CA-O 3.25Å; F536-N559 WeakPolarHBondContact CA-O 3.21Å; T537-N559 PolarHBondContact N-O 2.88Å; T537-N559 PolarHBondContact OG1-N 3.01Å; N559-A569 WeakPolarHBondContact CA-O 3.39Å
560	I	98.4	Very high	94.6	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	131.5	167.1	-56.9	-178.1	0	0	0	106.4	M412 F415 V416 Y419 Y534 T535 F536 V558 S568 A569 I571	M412-I560 HydrophobicContact CE-CG2 4.31Å; M412-I560 HydrophobicContact SD-CG2 3.81Å; F415-I560 HydrophobicContact CD1-CD1 4.37Å; F415-I560 HydrophobicContact CD1-CG2 3.54Å; F415-I560 HydrophobicContact CE1-CD1 4.25Å; F415-I560 HydrophobicContact CE1-CG2 3.47Å; F415-I560 VanDerWaalsContact CE1-CG2 3.47Å; V416-I560 HydrophobicContact CG2-CD1 4.19Å; Y419-I560 HydrophobicContact CD1-CD1 4.42Å; Y419-I560 HydrophobicContact CD2-CD1 4.32Å; Y419-I560 HydrophobicContact CG-CD1 4.05Å; Y534-I560 HydrophobicContact CD1-CG2 4.42Å; T535-I560 CarbonylContact O-C 3.53Å; T535-I560 VanDerWaalsContact O-CA 3.28Å; T535-I560 WeakPolarHBondContact O-CA 3.26Å; F536-I560 HydrophobicContact CB-CB 4.45Å; F536-I560 HydrophobicContact CB-CG1 3.85Å; V558-I560 HydrophobicContact CG1-CG1 4.46Å; I560-S568 CarbonylContact O-C 3.54Å; I560-S568 WeakPolarHBondContact O-CA 3.47Å; I560-S568 WeakPolarHBondContact O-CB 3.32Å; I560-A569 HydrophobicContact CB-CB 4.25Å; I560-A569 PolarHBondContact N-O 3.22Å; I560-A569 PolarHBondContact O-N 3.48Å; I560-I571 HydrophobicContact CD1-CD1 3.82Å; I560-I571 HydrophobicContact CG1-CD1 4.39Å
561	A	98.1	Very high	95.2	Very high	32 Å²	32	37.5 Å²	37.5	26%	0.264	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	139.5	-178.9	0	0	0	0	0	111.9	Y534 T535	Y534-A561 CarbonylContact C-O 3.5Å; Y534-A561 VanDerWaalsContact CA-O 3.31Å; Y534-A561 WeakPolarHBondContact CA-O 3.33Å; T535-A561 PolarHBondContact N-O 3.15Å; T535-A561 PolarHBondContact O-N 2.99Å
562	C	97.8	Very high	95.8	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.007	20%	0.203	C	C	.	.			trans	-119.3	112	167.7	-179.8	0	0	0	0	108.9	M412 E533 Y534 K564 S565 G566 Y567	M412-C562 HydrophobicContact CE-CB 4.09Å; E533-C562 WeakPolarHBondContact O-CA 3.42Å; E533-C562 WeakPolarHBondContact O-CB 3.46Å; E533-C562 PolarHBondContact O-SG 2.87Å; Y534-C562 HydrophobicContact CD1-CB 3.7Å; Y534-C562 HydrophobicContact CE1-CB 3.75Å; Y534-C562 HydrophobicContact CG-CB 4.15Å; C562-K564 VanDerWaalsContact C-N 3.34Å; C562-K564 PolarHBondContact O-N 2.98Å; C562-S565 VanDerWaalsContact CB-OG 3.28Å; C562-S565 WeakPolarHBondContact CB-OG 3.44Å; C562-S565 PolarHBondContact SG-OG 2.97Å; C562-G566 PolarHBondContact O-N 3.37Å; C562-Y567 PolarHBondContact N-O 2.91Å
563	N	94.5	Very high	96.1	Very high	163 Å²	163	35.6 Å²	35.6	87%	0.872	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-35.3	-175.9	-171.1	64	0	0	0	112.1
564	K	95	Very high	96	Very high	118 Å²	118	39.1 Å²	39.1	51%	0.513	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-48.2	-179.4	-178.4	-178.6	175.6	-178.6	0	112.5	H530 D531 E532 C562 G566	H530-K564 PolarHBondContact O-NZ 3.4Å; D531-K564 VanDerWaalsContact CG-NZ 3.29Å; D531-K564 WeakPolarHBondContact O-CD 3.42Å; D531-K564 WeakPolarHBondContact O-CE 3.41Å; D531-K564 PolarHBondContact O-NZ 3.32Å; D531-K564 IonicContact OD2-NZ 3.82Å; D531-K564 PolarHBondContact OD2-NZ 3.38Å; E532-K564 HydrophobicContact CG-CD 4.24Å; C562-K564 VanDerWaalsContact C-N 3.34Å; C562-K564 PolarHBondContact O-N 2.98Å; K564-G566 VanDerWaalsContact C-N 3.32Å
565	S	95.6	Very high	95.8	Very high	18 Å²	18	41.3 Å²	41.3	13%	0.126	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-17.3	-179.5	67.9	0	0	0	0	113.1	C562 Y567	C562-S565 VanDerWaalsContact CB-OG 3.28Å; C562-S565 WeakPolarHBondContact CB-OG 3.44Å; C562-S565 PolarHBondContact SG-OG 2.97Å; S565-Y567 WeakPolarHBondContact O-CD2 3.46Å; S565-Y567 PolarHBondContact O-N 2.93Å; S565-Y567 PolarHBondContact OG-N 3.46Å
566	G	96.4	Very high	95	Very high	11 Å²	11	46.6 Å²	46.6	11%	0.113	25%	0.249	C	C	.	.			trans	75.7	5.1	-177	0	0	0	0	0	113.8	C562 K564 N593 P594	C562-G566 PolarHBondContact O-N 3.37Å; K564-G566 VanDerWaalsContact C-N 3.32Å; G566-N593 VanDerWaalsContact O-CB 3.26Å; G566-N593 WeakPolarHBondContact O-CB 3.05Å; G566-N593 VanDerWaalsContact O-CG 3.29Å; G566-N593 PolarHBondContact O-N 2.87Å; G566-N593 PolarHBondContact O-ND2 2.65Å; G566-P594 WeakPolarHBondContact O-CD 3.46Å
567	Y	98.3	Very high	93.7	Very high	30 Å²	30	48.4 Å²	48.4	12%	0.118	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	145.6	175.8	-74.3	-94.1	0	0	0	111.6	P408 E409 M412 C562 S565 V590 K591 H592 V599	P408-Y567 HydrophobicContact CB-CD2 4.1Å; P408-Y567 HydrophobicContact CB-CE2 4.04Å; E409-Y567 HydrophobicContact CB-CE1 3.8Å; E409-Y567 HydrophobicContact CB-CE2 4.41Å; E409-Y567 HydrophobicContact CG-CE1 3.9Å; E409-Y567 PolarHBondContact OE2-OH 2.84Å; M412-Y567 VanDerWaalsContact CE-O 3.28Å; M412-Y567 WeakPolarHBondContact CE-O 3.27Å; C562-Y567 PolarHBondContact N-O 2.91Å; S565-Y567 WeakPolarHBondContact O-CD2 3.46Å; S565-Y567 PolarHBondContact O-N 2.93Å; S565-Y567 PolarHBondContact OG-N 3.46Å; Y567-V590 HydrophobicContact CD1-CG1 4.48Å; Y567-K591 CarbonylContact C-O 3.42Å; Y567-K591 VanDerWaalsContact CA-O 3.32Å; Y567-K591 WeakPolarHBondContact CA-O 3.42Å; Y567-H592 HydrophobicContact CD1-CB 4.08Å; Y567-H592 AromaticContact CD2-CD2 3.89Å; Y567-H592 HydrophobicContact CE1-CB 3.76Å; Y567-H592 AromaticContact CE2-CD2 3.61Å; Y567-H592 AromaticContact CZ-CD2 3.81Å; Y567-V599 HydrophobicContact CD1-CG2 4.33Å; Y567-V599 HydrophobicContact CE1-CG1 4.14Å; Y567-V599 HydrophobicContact CE1-CG2 4.05Å
568	S	98.2	Very high	91.5	Very high	17 Å²	17	49.5 Å²	49.5	12%	0.119	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	157.3	168.8	69.1	0	0	0	0	111.2	I560 V590 K591 N593	I560-S568 CarbonylContact O-C 3.54Å; I560-S568 WeakPolarHBondContact O-CA 3.47Å; I560-S568 WeakPolarHBondContact O-CB 3.32Å; S568-V590 CarbonylContact O-C 3.6Å; S568-V590 WeakPolarHBondContact O-CA 3.38Å; S568-K591 PolarHBondContact N-O 2.97Å; S568-K591 PolarHBondContact O-N 3.12Å; S568-N593 PolarHBondContact OG-OD1 3.31Å
569	A	98.5	Very high	88.9	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.008	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	136.9	170.3	0	0	0	0	0	110.4	M412 V416 N559 I560 E589 V590	M412-A569 HydrophobicContact SD-CB 4.37Å; V416-A569 HydrophobicContact CG2-CB 3.51Å; N559-A569 WeakPolarHBondContact CA-O 3.39Å; I560-A569 HydrophobicContact CB-CB 4.25Å; I560-A569 PolarHBondContact N-O 3.22Å; I560-A569 PolarHBondContact O-N 3.48Å; A569-E589 CarbonylContact C-O 3.51Å; A569-E589 VanDerWaalsContact CA-O 3.24Å; A569-E589 WeakPolarHBondContact CA-O 3.29Å; A569-V590 HydrophobicContact CB-CG2 4.05Å
570	V	98.3	Very high	86.9	Confident	45 Å²	45	58.3 Å²	58.3	27%	0.273	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	114.6	172.1	-179	0	0	0	0	108	A588 E589	V570-A588 VanDerWaalsContact O-CA 3.29Å; V570-A588 WeakPolarHBondContact O-CA 3.24Å; V570-E589 PolarHBondContact N-O 2.82Å; V570-E589 PolarHBondContact O-N 3.32Å
571	I	98.4	Very high	85.3	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	131.5	179.3	-54	169.9	0	0	0	107.9	V416 Y419 L420 K557 V558 I560 F573 V586 T587 A588	V416-I571 HydrophobicContact CG1-CD1 4.4Å; Y419-I571 HydrophobicContact CD1-CD1 3.51Å; Y419-I571 HydrophobicContact CE1-CD1 3.89Å; Y419-I571 HydrophobicContact CG-CD1 4.36Å; L420-I571 HydrophobicContact CD2-CD1 4.42Å; L420-I571 HydrophobicContact CD2-CG2 3.74Å; K557-I571 CarbonylContact C-O 3.3Å; K557-I571 WeakPolarHBondContact CA-O 3.31Å; V558-I571 HydrophobicContact CB-CB 4.17Å; V558-I571 HydrophobicContact CG1-CD1 4.42Å; V558-I571 PolarHBondContact N-O 2.82Å; V558-I571 PolarHBondContact O-N 3.46Å; I560-I571 HydrophobicContact CD1-CD1 3.82Å; I560-I571 HydrophobicContact CG1-CD1 4.39Å; I571-F573 HydrophobicContact CG2-CD2 4.12Å; I571-F573 HydrophobicContact CG2-CE2 3.65Å; I571-F573 HydrophobicContact CG2-CZ 4.24Å; I571-V586 HydrophobicContact CG2-CG2 3.7Å; I571-T587 CarbonylContact C-O 3.55Å; I571-A588 HydrophobicContact CB-CB 4.3Å; I571-A588 HydrophobicContact CG1-CB 3.78Å; I571-A588 HydrophobicContact CG2-CB 4.39Å
572	T	97	Very high	84.3	Confident	37 Å²	37	65.5 Å²	65.5	23%	0.227	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	112.2	178.7	-57.4	0	0	0	0	109.5	K557 Q574 V586 T587	K557-T572 HydrophobicContact CG-CG2 4.33Å; T572-Q574 HydrophobicContact CG2-CG 4.29Å; T572-V586 WeakPolarHBondContact O-CA 3.45Å; T572-T587 PolarHBondContact N-O 2.98Å; T572-T587 PolarHBondContact O-N 2.63Å
573	F	95.5	Very high	83.6	Confident	3 Å²	3	68.3 Å²	68.3	1%	0.013	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	119.3	168.8	-67.9	-96.1	0	0	0	108.2	Y419 L420 F423 P539 L554 G555 G556 V558 I571 V586 W606	Y419-F573 HydrophobicContact CE1-CE2 4.32Å; Y419-F573 HydrophobicContact CE1-CZ 4.39Å; L420-F573 HydrophobicContact CD2-CZ 4.22Å; F423-F573 HydrophobicContact CD2-CE1 4.28Å; F423-F573 AromaticContact CD2-CZ 3.99Å; F423-F573 HydrophobicContact CD2-CZ 3.99Å; F423-F573 HydrophobicContact CE2-CE1 4.43Å; F423-F573 AromaticContact CE2-CZ 3.71Å; F423-F573 HydrophobicContact CE2-CZ 3.71Å; F423-F573 HydrophobicContact CZ-CZ 4.31Å; P539-F573 HydrophobicContact CB-CD2 3.65Å; P539-F573 HydrophobicContact CB-CE2 3.89Å; P539-F573 HydrophobicContact CB-CG 4.12Å; P539-F573 HydrophobicContact CG-CD2 4.31Å; P539-F573 HydrophobicContact CG-CE2 4.08Å; P539-F573 HydrophobicContact CG-CZ 4.34Å; L554-F573 HydrophobicContact CB-CB 4.21Å; L554-F573 HydrophobicContact CB-CD1 3.7Å; L554-F573 HydrophobicContact CB-CE1 4.38Å; L554-F573 HydrophobicContact CB-CG 4.13Å; L554-F573 HydrophobicContact CD1-CD1 4.02Å; L554-F573 HydrophobicContact CD1-CE1 3.84Å; G555-F573 CarbonylContact C-O 3.58Å; G555-F573 WeakPolarHBondContact CA-O 3.49Å; G556-F573 PolarHBondContact N-O 3.37Å; G556-F573 VanDerWaalsContact N-O 3.08Å; G556-F573 PolarHBondContact O-N 3.48Å; V558-F573 HydrophobicContact CG2-CD2 4.4Å; V558-F573 HydrophobicContact CG2-CE2 4.15Å; I571-F573 HydrophobicContact CG2-CD2 4.12Å; I571-F573 HydrophobicContact CG2-CE2 3.65Å; I571-F573 HydrophobicContact CG2-CZ 4.24Å; F573-V586 HydrophobicContact CD1-CB 4.43Å; F573-V586 HydrophobicContact CD1-CG2 4.11Å; F573-V586 HydrophobicContact CE1-CG2 4.11Å; F573-V586 HydrophobicContact CG-CG2 4.34Å; F573-V586 HydrophobicContact CZ-CG2 4.32Å; F573-W606 AromaticContact CD1-CD1 3.74Å; F573-W606 HydrophobicContact CD1-CG 4.21Å; F573-W606 HydrophobicContact CE1-CB 4Å; F573-W606 HydrophobicContact CE1-CG 4.02Å
574	Q	90.3	Very high	83.3	Confident	74 Å²	74	61.8 Å²	61.8	35%	0.346	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-95.6	119.7	-174.4	-60.1	179	12.3	0	0	109.5	T572 K585 T587	T572-Q574 HydrophobicContact CG2-CG 4.29Å; Q574-K585 HydrophobicContact CB-CB 3.97Å; Q574-K585 HydrophobicContact CG-CB 4.48Å; Q574-K585 PolarHBondContact N-O 3.38Å; Q574-T587 VanDerWaalsContact NE2-CG2 3.34Å; Q574-T587 PolarHBondContact NE2-OG1 3.3Å
575	T	87.6	Confident	83.2	Confident	55 Å²	55	60.1 Å²	60.1	34%	0.337	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-72.2	149.3	168.6	57.3	0	0	0	0	110.1	Y542 E553 P577	Y542-T575 HydrophobicContact CD2-CG2 4.01Å; Y542-T575 HydrophobicContact CE2-CG2 3.88Å; E553-T575 HydrophobicContact CG-CG2 4.38Å; T575-P577 WeakPolarHBondContact O-CD 3.27Å
576	K	76.5	Confident	83.3	Confident	110 Å²	110	59.4 Å²	59.4	48%	0.478	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-49.3	122.9	179.6	-168.9	-170.2	-175.4	172.3	0	111.4	E553 L583	E553-K576 VanDerWaalsContact OE1-CB 3.32Å; E553-K576 WeakPolarHBondContact OE1-CB 3.49Å; E553-K576 PolarHBondContact OE1-N 2.9Å; K576-L583 HydrophobicContact CB-CD2 3.91Å; K576-L583 HydrophobicContact CD-CD2 3.71Å; K576-L583 HydrophobicContact CG-CD2 3.85Å
577	P	64.6	Low	83.3	Confident	70 Å²	70	61.1 Å²	61.1	46%	0.455	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-63.9	153.4	169.8	-18.9	31.6	0	0	0	111.4	T575 Y579	T575-P577 WeakPolarHBondContact O-CD 3.27Å; P577-Y579 PolarHBondContact O-N 2.87Å
578	F	48	Very low	83.3	Confident	170 Å²	170	59.9 Å²	59.9	75%	0.746	32%	0.317	S	S	*	.	S	Bend	trans	-62.5	-28.2	178.6	-71.4	-82.6	0	0	0	113.6	E102	E102-F578 HydrophobicContact CG-CZ 4.45Å; E102-F578 WeakPolarHBondContact OE1-CE1 3.27Å; E102-F578 WeakPolarHBondContact OE1-CZ 3.36Å
579	Y	44	Very low	83.3	Confident	216 Å²	216	62 Å²	62	85%	0.847	33%	0.325	S	S	*	.	S	Bend	trans	-117.1	102.6	-178.8	-62.8	-79.4	0	0	0	111.6	P577	P577-Y579 PolarHBondContact O-N 2.87Å
580	G	53.3	Low	83.3	Confident	54 Å²	54	62 Å²	62	56%	0.557	33%	0.325	S	S	*	.	S	Bend	trans	58.1	-177.4	175.4	0	0	0	0	0	114.4
581	G	64.8	Low	83.2	Confident	56 Å²	56	62.2 Å²	62.2	58%	0.577	32%	0.323	S	S	*	.			trans	107.7	159.2	177.8	0	0	0	0	0	114.2
582	K	76.9	Confident	83.2	Confident	127 Å²	127	64.1 Å²	64.1	55%	0.552	33%	0.331	S	S	*	.			trans	-77.8	146.4	177	-58.5	-172.4	169.1	-169.4	0	111	K585 E605	K582-K585 HydrophobicContact CB-CG 4.37Å; K582-E605 WeakPolarHBondContact CD-OE1 3.39Å; K582-E605 IonicContact NZ-OE1 2.83Å; K582-E605 PolarHBondContact NZ-OE1 3.18Å
583	L	85	Confident	83.1	Confident	60 Å²	60	66.5 Å²	66.5	31%	0.314	34%	0.342	S	S	.	.	S	Bend	trans	-73.2	166.5	172.8	-66.6	175.3	0	0	0	110.7	W551 K576 K585	W551-L583 HydrophobicContact CH2-CD2 3.58Å; W551-L583 HydrophobicContact CZ2-CD2 4.24Å; W551-L583 HydrophobicContact CZ3-CD2 4.1Å; K576-L583 HydrophobicContact CB-CD2 3.91Å; K576-L583 HydrophobicContact CD-CD2 3.71Å; K576-L583 HydrophobicContact CG-CD2 3.85Å; L583-K585 PolarHBondContact O-N 2.91Å
584	H	88.1	Confident	83.1	Confident	26 Å²	26	71 Å²	71	12%	0.12	37%	0.372	C	S	.	.	S	Bend	trans	59.4	22.9	167.4	-50.6	-63.9	0	0	0	115.4	W551 V552 V586 E605 W606 N607	W551-H584 AromaticContact CZ3-CE1 3.95Å; V552-H584 PolarHBondContact O-CE1 2.89Å; H584-V586 PolarHBondContact O-N 2.99Å; H584-E605 WeakPolarHBondContact O-CA 3.49Å; H584-W606 HydrophobicContact CB-CD2 4.4Å; H584-W606 HydrophobicContact CB-CG 4.35Å; H584-W606 HydrophobicContact CB-CZ2 4.35Å; H584-W606 AromaticContact CE1-CZ2 3.89Å; H584-W606 AromaticContact CG-CE2 3.92Å; H584-W606 AromaticContact CG-CZ2 3.96Å; H584-W606 AromaticContact CG-NE1 3.84Å; H584-W606 AromaticContact ND1-CE2 3.48Å; H584-W606 AromaticContact ND1-CZ2 3.17Å; H584-W606 WeakPolarHBondContact ND1-CZ2 3.48Å; H584-W606 AromaticContact ND1-NE1 3.55Å; H584-W606 PolarHBondContact O-N 2.92Å; H584-N607 WeakPolarHBondContact CB-OD1 3.29Å; H584-N607 PolarHBondContact CD2-ND2 2.96Å
585	K	92.8	Very high	83.4	Confident	83 Å²	83	71.8 Å²	71.8	36%	0.361	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	137.3	178.8	-78.7	-173.3	173.5	-167.7	0	111.5	Q574 K582 L583 G604	Q574-K585 HydrophobicContact CB-CB 3.97Å; Q574-K585 HydrophobicContact CG-CB 4.48Å; Q574-K585 PolarHBondContact N-O 3.38Å; K582-K585 HydrophobicContact CB-CG 4.37Å; L583-K585 PolarHBondContact O-N 2.91Å; K585-G604 CarbonylContact C-O 3.57Å; K585-G604 WeakPolarHBondContact CA-O 3.46Å
586	V	96.3	Very high	83.7	Confident	2 Å²	2	75.1 Å²	75.1	1%	0.012	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	143.3	174.5	66.8	0	0	0	0	110.2	L420 I571 T572 F573 H584 Q603 G604 W606 L610	L420-V586 HydrophobicContact CD2-CG1 4.41Å; L420-V586 HydrophobicContact CD2-CG2 3.69Å; I571-V586 HydrophobicContact CG2-CG2 3.7Å; T572-V586 WeakPolarHBondContact O-CA 3.45Å; F573-V586 HydrophobicContact CD1-CB 4.43Å; F573-V586 HydrophobicContact CD1-CG2 4.11Å; F573-V586 HydrophobicContact CE1-CG2 4.11Å; F573-V586 HydrophobicContact CG-CG2 4.34Å; F573-V586 HydrophobicContact CZ-CG2 4.32Å; H584-V586 PolarHBondContact O-N 2.99Å; V586-Q603 WeakPolarHBondContact O-CA 3.46Å; V586-G604 PolarHBondContact N-O 2.93Å; V586-G604 PolarHBondContact O-N 3.22Å; V586-W606 HydrophobicContact CB-CB 4.36Å; V586-W606 HydrophobicContact CG1-CB 4.07Å; V586-L610 HydrophobicContact CG1-CD2 3.48Å; V586-L610 VanDerWaalsContact CG1-CD2 3.48Å
587	T	97.5	Very high	84.6	Confident	48 Å²	48	71.9 Å²	71.9	29%	0.294	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	138.4	172.6	52.4	0	0	0	0	109.6	I571 T572 Q574 V602 Q603	I571-T587 CarbonylContact C-O 3.55Å; T572-T587 PolarHBondContact N-O 2.98Å; T572-T587 PolarHBondContact O-N 2.63Å; Q574-T587 VanDerWaalsContact NE2-CG2 3.34Å; Q574-T587 PolarHBondContact NE2-OG1 3.3Å; T587-V602 CarbonylContact C-O 3.51Å; T587-V602 WeakPolarHBondContact CA-O 3.42Å; T587-Q603 HydrophobicContact CG2-CB 4.43Å
588	A	98.3	Very high	86.1	Confident	3 Å²	3	70.4 Å²	70.4	3%	0.025	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	149	174.2	0	0	0	0	0	111.9	V416 V570 I571 R601 V602	V416-A588 HydrophobicContact CG1-CB 4.36Å; V570-A588 VanDerWaalsContact O-CA 3.29Å; V570-A588 WeakPolarHBondContact O-CA 3.24Å; I571-A588 HydrophobicContact CB-CB 4.3Å; I571-A588 HydrophobicContact CG1-CB 3.78Å; I571-A588 HydrophobicContact CG2-CB 4.39Å; A588-R601 CarbonylContact O-C 3.42Å; A588-R601 WeakPolarHBondContact O-CA 3.28Å; A588-V602 HydrophobicContact CB-CB 3.88Å; A588-V602 HydrophobicContact CB-CG2 4Å; A588-V602 PolarHBondContact N-O 2.85Å; A588-V602 PolarHBondContact O-N 2.63Å
589	E	97.9	Very high	88.4	Confident	62 Å²	62	62.8 Å²	62.8	29%	0.29	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	122.6	170.1	-64.5	-175.3	168.5	0	0	109.3	A569 V570 K591 R601	A569-E589 CarbonylContact C-O 3.51Å; A569-E589 VanDerWaalsContact CA-O 3.24Å; A569-E589 WeakPolarHBondContact CA-O 3.29Å; V570-E589 PolarHBondContact N-O 2.82Å; V570-E589 PolarHBondContact O-N 3.32Å; E589-K591 WeakPolarHBondContact OE2-CE 3.47Å; E589-K591 IonicContact OE2-NZ 3.68Å; E589-K591 PolarHBondContact OE2-NZ 3.27Å; E589-R601 VanDerWaalsContact CD-NH1 3.3Å; E589-R601 IonicContact OE1-CZ 2.86Å; E589-R601 IonicContact OE1-NH1 2.77Å; E589-R601 PolarHBondContact OE1-NH1 2.74Å; E589-R601 IonicContact OE1-NH2 2.7Å
590	V	98.2	Very high	91	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	128.6	170.8	-171.3	0	0	0	0	108.7	M412 I413 V416 Y567 S568 A569 V598 V599 C600	M412-V590 HydrophobicContact CB-CG1 4.38Å; M412-V590 HydrophobicContact CG-CG1 3.52Å; I413-V590 HydrophobicContact CG1-CG1 4.47Å; I413-V590 HydrophobicContact CG1-CG2 4.43Å; V416-V590 HydrophobicContact CG2-CG2 4.06Å; Y567-V590 HydrophobicContact CD1-CG1 4.48Å; S568-V590 CarbonylContact O-C 3.6Å; S568-V590 WeakPolarHBondContact O-CA 3.38Å; A569-V590 HydrophobicContact CB-CG2 4.05Å; V590-V598 WeakPolarHBondContact O-CA 3.5Å; V590-V599 HydrophobicContact CB-CG2 3.83Å; V590-V599 HydrophobicContact CG1-CG2 3.59Å; V590-V599 WeakPolarHBondContact O-CG2 3.16Å; V590-V599 PolarHBondContact O-N 3.49Å; V590-C600 HydrophobicContact CB-CB 4.02Å; V590-C600 HydrophobicContact CG2-CB 4Å; V590-C600 PolarHBondContact N-O 2.83Å
591	K	97.2	Very high	93.1	Very high	51 Å²	51	55.6 Å²	55.6	22%	0.222	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	144.3	-174.8	-72.8	175.8	-177.5	164.1	0	111.3	Y567 S568 E589 A597 V598	Y567-K591 CarbonylContact C-O 3.42Å; Y567-K591 VanDerWaalsContact CA-O 3.32Å; Y567-K591 WeakPolarHBondContact CA-O 3.42Å; S568-K591 PolarHBondContact N-O 2.97Å; S568-K591 PolarHBondContact O-N 3.12Å; E589-K591 WeakPolarHBondContact OE2-CE 3.47Å; E589-K591 IonicContact OE2-NZ 3.68Å; E589-K591 PolarHBondContact OE2-NZ 3.27Å; K591-A597 CarbonylContact C-O 3.45Å; K591-A597 VanDerWaalsContact CA-O 3.29Å; K591-A597 WeakPolarHBondContact CA-O 3.42Å; K591-V598 HydrophobicContact CD-CG2 4.25Å; K591-V598 HydrophobicContact CG-CB 4.49Å; K591-V598 HydrophobicContact CG-CG2 3.8Å
592	H	97.4	Very high	94.7	Very high	40 Å²	40	53.2 Å²	53.2	19%	0.185	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	108.5	162.4	-177.4	-122	0	0	0	108.5	Y567 T595 N596 A597	Y567-H592 HydrophobicContact CD1-CB 4.08Å; Y567-H592 AromaticContact CD2-CD2 3.89Å; Y567-H592 HydrophobicContact CE1-CB 3.76Å; Y567-H592 AromaticContact CE2-CD2 3.61Å; Y567-H592 AromaticContact CZ-CD2 3.81Å; H592-T595 WeakPolarHBondContact ND1-CG2 3.27Å; H592-T595 PolarHBondContact ND1-OG1 3.41Å; H592-T595 PolarHBondContact O-N 3.17Å; H592-N596 WeakPolarHBondContact O-CA 3.18Å; H592-N596 PolarHBondContact O-N 3.37Å; H592-A597 PolarHBondContact N-O 3.38Å; H592-A597 PolarHBondContact O-N 3.13Å
593	N	95.5	Very high	95.7	Very high	86 Å²	86	52 Å²	52	46%	0.46	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-42.6	-171.5	-60.5	-35.2	0	0	0	113.4	G566 S568 T595 N596	G566-N593 VanDerWaalsContact O-CB 3.26Å; G566-N593 WeakPolarHBondContact O-CB 3.05Å; G566-N593 VanDerWaalsContact O-CG 3.29Å; G566-N593 PolarHBondContact O-N 2.87Å; G566-N593 PolarHBondContact O-ND2 2.65Å; S568-N593 PolarHBondContact OG-OD1 3.31Å; N593-T595 PolarHBondContact O-N 2.83Å; N593-N596 PolarHBondContact O-N 3.03Å
594	P	95.9	Very high	96.2	Very high	97 Å²	97	50.3 Å²	50.3	63%	0.63	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-36.4	179.9	-25.1	35.3	0	0	0	114.4	G566	G566-P594 WeakPolarHBondContact O-CD 3.46Å
595	T	95.6	Very high	96.5	Very high	91 Å²	91	51.5 Å²	51.5	56%	0.558	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-8.5	-179.7	59.7	0	0	0	0	113.1	H592 N593 A597	H592-T595 WeakPolarHBondContact ND1-CG2 3.27Å; H592-T595 PolarHBondContact ND1-OG1 3.41Å; H592-T595 PolarHBondContact O-N 3.17Å; N593-T595 PolarHBondContact O-N 2.83Å; T595-A597 PolarHBondContact O-N 2.95Å; T595-A597 VanDerWaalsContact O-N 3.13Å; T595-A597 WeakPolarHBondContact OG1-CB 3.42Å; T595-A597 PolarHBondContact OG1-N 3.45Å
596	N	94	Very high	96.5	Very high	126 Å²	126	47.8 Å²	47.8	67%	0.674	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	24.7	-170.4	-161.4	27.9	0	0	0	113.3	H592 N593	H592-N596 WeakPolarHBondContact O-CA 3.18Å; H592-N596 PolarHBondContact O-N 3.37Å; N593-N596 PolarHBondContact O-N 3.03Å
597	A	95.3	Very high	96.2	Very high	42 Å²	42	50.4 Å²	50.4	35%	0.347	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	130.9	179.8	0	0	0	0	0	110	K591 H592 T595	K591-A597 CarbonylContact C-O 3.45Å; K591-A597 VanDerWaalsContact CA-O 3.29Å; K591-A597 WeakPolarHBondContact CA-O 3.42Å; H592-A597 PolarHBondContact N-O 3.38Å; H592-A597 PolarHBondContact O-N 3.13Å; T595-A597 PolarHBondContact O-N 2.95Å; T595-A597 VanDerWaalsContact O-N 3.13Å; T595-A597 WeakPolarHBondContact OG1-CB 3.42Å; T595-A597 PolarHBondContact OG1-N 3.45Å
598	V	96.8	Very high	96	Very high	38 Å²	38	48.7 Å²	48.7	23%	0.23	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	120.2	171	178.8	0	0	0	0	108	V590 K591 R601 T615	V590-V598 WeakPolarHBondContact O-CA 3.5Å; K591-V598 HydrophobicContact CD-CG2 4.25Å; K591-V598 HydrophobicContact CG-CB 4.49Å; K591-V598 HydrophobicContact CG-CG2 3.8Å; V598-R601 HydrophobicContact CG1-CG 3.84Å; V598-T615 WeakPolarHBondContact O-CG2 3.24Å
599	V	96.2	Very high	95.9	Very high	11 Å²	11	51.6 Å²	51.6	7%	0.067	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	-30	-174.3	-63.8	0	0	0	0	112.9	E409 Y567 V590 T615	E409-V599 HydrophobicContact CG-CB 4.11Å; E409-V599 HydrophobicContact CG-CG1 4.45Å; E409-V599 HydrophobicContact CG-CG2 3.97Å; Y567-V599 HydrophobicContact CD1-CG2 4.33Å; Y567-V599 HydrophobicContact CE1-CG1 4.14Å; Y567-V599 HydrophobicContact CE1-CG2 4.05Å; V590-V599 HydrophobicContact CB-CG2 3.83Å; V590-V599 HydrophobicContact CG1-CG2 3.59Å; V590-V599 WeakPolarHBondContact O-CG2 3.16Å; V590-V599 PolarHBondContact O-N 3.49Å; V599-T615 PolarHBondContact O-N 3.48Å
600	C	97.5	Very high	95.9	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.007	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	141.2	178	-176.3	0	0	0	0	110.4	I413 V590 S613 Y614	I413-C600 HydrophobicContact CD1-CB 3.86Å; I413-C600 HydrophobicContact CG1-CB 3.92Å; V590-C600 HydrophobicContact CB-CB 4.02Å; V590-C600 HydrophobicContact CG2-CB 4Å; V590-C600 PolarHBondContact N-O 2.83Å; C600-S613 WeakPolarHBondContact CA-O 3.35Å; C600-Y614 HydrophobicContact CB-CD1 4.35Å
601	R	98.3	Very high	95.9	Very high	118 Å²	118	51.8 Å²	51.8	45%	0.445	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	137	170	-65.6	177.7	177.2	-78	-4.8	108.5	A588 E589 V598 F612 S613	A588-R601 CarbonylContact O-C 3.42Å; A588-R601 WeakPolarHBondContact O-CA 3.28Å; E589-R601 VanDerWaalsContact CD-NH1 3.3Å; E589-R601 IonicContact OE1-CZ 2.86Å; E589-R601 IonicContact OE1-NH1 2.77Å; E589-R601 PolarHBondContact OE1-NH1 2.74Å; E589-R601 IonicContact OE1-NH2 2.7Å; V598-R601 HydrophobicContact CG1-CG 3.84Å; R601-F612 CarbonylContact O-C 3.26Å; R601-F612 WeakPolarHBondContact O-CA 3.14Å; R601-S613 PolarHBondContact N-O 2.98Å; R601-S613 PolarHBondContact O-N 2.69Å
602	V	98.2	Very high	95.9	Very high	5 Å²	5	49.4 Å²	49.4	3%	0.03	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	137.5	175.1	-164.2	0	0	0	0	108.8	V416 L420 T587 A588 L610 E611 F612	V416-V602 HydrophobicContact CG1-CG2 4.32Å; L420-V602 HydrophobicContact CD1-CB 4.26Å; L420-V602 HydrophobicContact CD1-CG1 3.81Å; L420-V602 HydrophobicContact CD1-CG2 4.46Å; T587-V602 CarbonylContact C-O 3.51Å; T587-V602 WeakPolarHBondContact CA-O 3.42Å; A588-V602 HydrophobicContact CB-CB 3.88Å; A588-V602 HydrophobicContact CB-CG2 4Å; A588-V602 PolarHBondContact N-O 2.85Å; A588-V602 PolarHBondContact O-N 2.63Å; V602-L610 HydrophobicContact CG1-CB 4.42Å; V602-E611 CarbonylContact C-O 3.52Å; V602-E611 VanDerWaalsContact CA-O 3.26Å; V602-E611 WeakPolarHBondContact CA-O 3.27Å; V602-F612 HydrophobicContact CB-CD1 4.43Å; V602-F612 HydrophobicContact CB-CE1 4.43Å; V602-F612 HydrophobicContact CG1-CD1 4.23Å; V602-F612 HydrophobicContact CG1-CD2 4.06Å; V602-F612 HydrophobicContact CG1-CE1 4.07Å; V602-F612 HydrophobicContact CG1-CE2 3.89Å; V602-F612 HydrophobicContact CG1-CG 4.2Å; V602-F612 HydrophobicContact CG1-CZ 3.88Å; V602-F612 HydrophobicContact CG2-CD1 3.42Å; V602-F612 VanDerWaalsContact CG2-CD1 3.42Å; V602-F612 HydrophobicContact CG2-CE1 3.45Å; V602-F612 VanDerWaalsContact CG2-CE1 3.45Å; V602-F612 HydrophobicContact CG2-CG 4.06Å; V602-F612 HydrophobicContact CG2-CZ 4.12Å
603	Q	97.1	Very high	96	Very high	102 Å²	102	49.2 Å²	49.2	48%	0.477	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	147.7	172.8	63.7	-179.9	9.8	0	0	110.2	V586 T587 E611	V586-Q603 WeakPolarHBondContact O-CA 3.46Å; T587-Q603 HydrophobicContact CG2-CB 4.43Å; Q603-E611 HydrophobicContact CG-CB 4.24Å; Q603-E611 PolarHBondContact N-O 3.04Å; Q603-E611 PolarHBondContact NE2-OE2 3.4Å; Q603-E611 PolarHBondContact O-N 3.13Å
604	G	95.5	Very high	96	Very high	24 Å²	24	47.5 Å²	47.5	25%	0.247	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	154.9	-150.6	177	0	0	0	0	0	113.6	K585 V586 V609	K585-G604 CarbonylContact C-O 3.57Å; K585-G604 WeakPolarHBondContact CA-O 3.46Å; V586-G604 PolarHBondContact N-O 2.93Å; V586-G604 PolarHBondContact O-N 3.22Å; G604-V609 CarbonylContact C-O 3.56Å; G604-V609 WeakPolarHBondContact CA-O 3.32Å
605	E	94.1	Very high	95.7	Very high	51 Å²	51	47.8 Å²	47.8	24%	0.238	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	121.1	-179.5	-61.9	172.6	-123.6	0	0	108	K582 H584 N607 G608 V609	K582-E605 WeakPolarHBondContact CD-OE1 3.39Å; K582-E605 IonicContact NZ-OE1 2.83Å; K582-E605 PolarHBondContact NZ-OE1 3.18Å; H584-E605 WeakPolarHBondContact O-CA 3.49Å; E605-N607 PolarHBondContact O-N 3.29Å; E605-N607 VanDerWaalsContact O-N 3.12Å; E605-G608 CarbonylContact O-C 3.54Å; E605-G608 PolarHBondContact O-N 3.32Å; E605-V609 PolarHBondContact N-O 2.83Å
606	W	93.2	Very high	95.5	Very high	6 Å²	6	47.7 Å²	47.7	2%	0.023	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-16.8	-173.7	62.6	-102.3	0	0	0	113.8	F423 R427 L554 F573 H584 V586	F423-W606 HydrophobicContact CB-CE3 3.81Å; F423-W606 HydrophobicContact CB-CZ3 4.12Å; R427-W606 HydrophobicContact CB-CH2 4.1Å; R427-W606 HydrophobicContact CB-CZ3 4.26Å; R427-W606 HydrophobicContact CG-CH2 4.44Å; L554-W606 HydrophobicContact CB-CZ2 4.46Å; L554-W606 HydrophobicContact CD1-CD2 3.96Å; L554-W606 HydrophobicContact CD1-CE3 4.2Å; L554-W606 HydrophobicContact CD1-CG 4.49Å; L554-W606 HydrophobicContact CD1-CH2 4.28Å; L554-W606 HydrophobicContact CD1-CZ2 3.99Å; L554-W606 HydrophobicContact CD1-CZ3 4.35Å; L554-W606 HydrophobicContact CG-CH2 4.4Å; L554-W606 HydrophobicContact CG-CZ2 3.87Å; F573-W606 AromaticContact CD1-CD1 3.74Å; F573-W606 HydrophobicContact CD1-CG 4.21Å; F573-W606 HydrophobicContact CE1-CB 4Å; F573-W606 HydrophobicContact CE1-CG 4.02Å; H584-W606 HydrophobicContact CB-CD2 4.4Å; H584-W606 HydrophobicContact CB-CG 4.35Å; H584-W606 HydrophobicContact CB-CZ2 4.35Å; H584-W606 AromaticContact CE1-CZ2 3.89Å; H584-W606 AromaticContact CG-CE2 3.92Å; H584-W606 AromaticContact CG-CZ2 3.96Å; H584-W606 AromaticContact CG-NE1 3.84Å; H584-W606 AromaticContact ND1-CE2 3.48Å; H584-W606 AromaticContact ND1-CZ2 3.17Å; H584-W606 WeakPolarHBondContact ND1-CZ2 3.48Å; H584-W606 AromaticContact ND1-NE1 3.55Å; H584-W606 PolarHBondContact O-N 2.92Å; V586-W606 HydrophobicContact CB-CB 4.36Å; V586-W606 HydrophobicContact CG1-CB 4.07Å
607	N	91.3	Very high	95.3	Very high	56 Å²	56	44.9 Å²	44.9	30%	0.299	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	17.9	173.6	67.1	-21.3	0	0	0	112.8	H424 H584 E605 V624	H424-N607 HydrophobicContact CB-CB 4.26Å; H584-N607 WeakPolarHBondContact CB-OD1 3.29Å; H584-N607 PolarHBondContact CD2-ND2 2.96Å; E605-N607 PolarHBondContact O-N 3.29Å; E605-N607 VanDerWaalsContact O-N 3.12Å; N607-V624 VanDerWaalsContact C-CG2 3.45Å
608	G	93.6	Very high	95.2	Very high	13 Å²	13	48.9 Å²	48.9	13%	0.134	28%	0.28	C	S	.	.	S	Bend	trans	-144.8	-115	-177.3	0	0	0	0	0	111.6	E605 V624	E605-G608 CarbonylContact O-C 3.54Å; E605-G608 PolarHBondContact O-N 3.32Å; G608-V624 VanDerWaalsContact O-CG2 3.32Å; G608-V624 WeakPolarHBondContact O-CG2 3.4Å; G608-V624 PolarHBondContact O-N 3.23Å
609	V	96	Very high	95.2	Very high	64 Å²	64	50.9 Å²	50.9	39%	0.388	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	131.4	-176.4	-177.4	0	0	0	0	110.5	G604 E605 V621 D623	G604-V609 CarbonylContact C-O 3.56Å; G604-V609 WeakPolarHBondContact CA-O 3.32Å; E605-V609 PolarHBondContact N-O 2.83Å; V609-V621 HydrophobicContact CG1-CG1 3.38Å; V609-D623 HydrophobicContact CG2-CB 4.33Å
610	L	97.4	Very high	95.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	133.2	173.7	-61.4	169.2	0	0	0	109.5	L420 T421 V586 V602 F612 V621 V622 V624	L420-L610 HydrophobicContact CB-CD1 3.77Å; L420-L610 HydrophobicContact CD1-CD1 4.49Å; T421-L610 HydrophobicContact CG2-CD1 4.48Å; V586-L610 HydrophobicContact CG1-CD2 3.48Å; V586-L610 VanDerWaalsContact CG1-CD2 3.48Å; V602-L610 HydrophobicContact CG1-CB 4.42Å; L610-F612 HydrophobicContact CB-CE2 4Å; L610-V621 CarbonylContact O-C 3.57Å; L610-V621 WeakPolarHBondContact O-CA 3.46Å; L610-V622 HydrophobicContact CB-CB 4.45Å; L610-V622 PolarHBondContact N-O 2.94Å; L610-V622 PolarHBondContact O-N 3.08Å; L610-V624 HydrophobicContact CD1-CG1 3.82Å; L610-V624 HydrophobicContact CG-CG1 4.27Å
611	E	98.1	Very high	95.2	Very high	65 Å²	65	58.1 Å²	58.1	30%	0.304	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	120.9	176.3	-177.3	-176.2	-164.4	0	0	109.3	V602 Q603 K620 V621	V602-E611 CarbonylContact C-O 3.52Å; V602-E611 VanDerWaalsContact CA-O 3.26Å; V602-E611 WeakPolarHBondContact CA-O 3.27Å; Q603-E611 HydrophobicContact CG-CB 4.24Å; Q603-E611 PolarHBondContact N-O 3.04Å; Q603-E611 PolarHBondContact NE2-OE2 3.4Å; Q603-E611 PolarHBondContact O-N 3.13Å; E611-K620 WeakPolarHBondContact CA-O 3.34Å; E611-V621 HydrophobicContact CG-CG2 4.44Å
612	F	98	Very high	95.1	Very high	1 Å²	1	53 Å²	53	0%	0.004	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	130.8	174.6	-66.7	-110.2	0	0	0	108.5	E417 L420 R601 V602 L610 Y614 T619 K620 V622	E417-F612 HydrophobicContact CB-CE1 4.13Å; E417-F612 HydrophobicContact CB-CZ 3.9Å; E417-F612 HydrophobicContact CG-CZ 4.06Å; L420-F612 HydrophobicContact CD1-CZ 4.47Å; R601-F612 CarbonylContact O-C 3.26Å; R601-F612 WeakPolarHBondContact O-CA 3.14Å; V602-F612 HydrophobicContact CB-CD1 4.43Å; V602-F612 HydrophobicContact CB-CE1 4.43Å; V602-F612 HydrophobicContact CG1-CD1 4.23Å; V602-F612 HydrophobicContact CG1-CD2 4.06Å; V602-F612 HydrophobicContact CG1-CE1 4.07Å; V602-F612 HydrophobicContact CG1-CE2 3.89Å; V602-F612 HydrophobicContact CG1-CG 4.2Å; V602-F612 HydrophobicContact CG1-CZ 3.88Å; V602-F612 HydrophobicContact CG2-CD1 3.42Å; V602-F612 VanDerWaalsContact CG2-CD1 3.42Å; V602-F612 HydrophobicContact CG2-CE1 3.45Å; V602-F612 VanDerWaalsContact CG2-CE1 3.45Å; V602-F612 HydrophobicContact CG2-CG 4.06Å; V602-F612 HydrophobicContact CG2-CZ 4.12Å; L610-F612 HydrophobicContact CB-CE2 4Å; F612-Y614 HydrophobicContact CB-CE2 4.11Å; F612-T619 CarbonylContact O-C 3.54Å; F612-T619 WeakPolarHBondContact O-CA 3.28Å; F612-K620 HydrophobicContact CB-CB 4.21Å; F612-K620 PolarHBondContact N-O 3.34Å; F612-K620 PolarHBondContact O-N 2.81Å; F612-V622 HydrophobicContact CD2-CG2 4.31Å; F612-V622 HydrophobicContact CE2-CB 4.47Å; F612-V622 HydrophobicContact CE2-CG2 4.01Å
613	S	97.7	Very high	94.9	Very high	37 Å²	37	54.3 Å²	54.3	26%	0.259	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	124.7	176.1	-49.3	0	0	0	0	109.7	C600 R601	C600-S613 WeakPolarHBondContact CA-O 3.35Å; R601-S613 PolarHBondContact N-O 2.98Å; R601-S613 PolarHBondContact O-N 2.69Å
614	Y	95.6	Very high	94.7	Very high	49 Å²	49	49.5 Å²	49.5	19%	0.192	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	161.5	-175.8	-55.4	-81.4	0	0	0	111.8	I413 C600 F612 S616 G617 E618 K620	I413-Y614 HydrophobicContact CD1-CD1 4.27Å; I413-Y614 HydrophobicContact CD1-CE1 4.1Å; I413-Y614 HydrophobicContact CG2-CE1 4.03Å; C600-Y614 HydrophobicContact CB-CD1 4.35Å; F612-Y614 HydrophobicContact CB-CE2 4.11Å; Y614-S616 PolarHBondContact O-N 3.37Å; Y614-G617 PolarHBondContact O-N 3.4Å; Y614-E618 HydrophobicContact CD2-CB 4.1Å; Y614-E618 HydrophobicContact CD2-CG 4.32Å; Y614-E618 WeakPolarHBondContact CD2-O 3.47Å; Y614-E618 PolarHBondContact N-O 3.23Å; Y614-K620 HydrophobicContact CE2-CB 3.82Å
615	T	90.7	Very high	94.5	Very high	104 Å²	104	52.8 Å²	52.8	64%	0.638	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-22.4	175.6	51.2	0	0	0	0	113.7	V598 V599 G617	V598-T615 WeakPolarHBondContact O-CG2 3.24Å; V599-T615 PolarHBondContact O-N 3.48Å; T615-G617 PolarHBondContact O-N 3.41Å
616	S	90.3	Very high	94.4	Very high	89 Å²	89	58 Å²	58	62%	0.622	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-15.3	173.4	59.6	0	0	0	0	113.6	Y614 E618	Y614-S616 PolarHBondContact O-N 3.37Å; S616-E618 VanDerWaalsContact C-N 3.31Å; S616-E618 WeakPolarHBondContact OG-CB 3.37Å; S616-E618 PolarHBondContact OG-N 2.9Å
617	G	90.1	Very high	94.3	Very high	66 Å²	66	59.8 Å²	59.8	68%	0.68	34%	0.343	S	S	*	.	S	Bend	trans	87.5	-3.3	-169.9	0	0	0	0	0	113.9	Y614 T615	Y614-G617 PolarHBondContact O-N 3.4Å; T615-G617 PolarHBondContact O-N 3.41Å
618	E	94.3	Very high	94.2	Very high	127 Å²	127	60.6 Å²	60.6	59%	0.593	35%	0.352	S	S	*	.			trans	-69	147.8	171.9	-173.9	176.2	178.5	0	0	111	Y614 S616	Y614-E618 HydrophobicContact CD2-CB 4.1Å; Y614-E618 HydrophobicContact CD2-CG 4.32Å; Y614-E618 WeakPolarHBondContact CD2-O 3.47Å; Y614-E618 PolarHBondContact N-O 3.23Å; S616-E618 VanDerWaalsContact C-N 3.31Å; S616-E618 WeakPolarHBondContact OG-CB 3.37Å; S616-E618 PolarHBondContact OG-N 2.9Å
619	T	95.5	Very high	94	Very high	79 Å²	79	62.8 Å²	62.8	49%	0.485	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	138.8	170.5	59.3	0	0	0	0	111	F612	F612-T619 CarbonylContact O-C 3.54Å; F612-T619 WeakPolarHBondContact O-CA 3.28Å
620	K	96.4	Very high	93.7	Very high	72 Å²	72	61.5 Å²	61.5	31%	0.313	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	131.8	174.7	173.4	-177	175.6	-175.1	0	109	E417 E611 F612 Y614 V622	E417-K620 WeakPolarHBondContact OE1-CE 3.31Å; E417-K620 IonicContact OE1-NZ 2.8Å; E417-K620 PolarHBondContact OE1-NZ 2.8Å; E417-K620 IonicContact OE2-NZ 3.86Å; E417-K620 PolarHBondContact OE2-NZ 2.83Å; E611-K620 WeakPolarHBondContact CA-O 3.34Å; F612-K620 HydrophobicContact CB-CB 4.21Å; F612-K620 PolarHBondContact N-O 3.34Å; F612-K620 PolarHBondContact O-N 2.81Å; Y614-K620 HydrophobicContact CE2-CB 3.82Å; K620-V622 HydrophobicContact CD-CG2 4.46Å; K620-V622 HydrophobicContact CG-CG2 4.32Å
621	V	97.4	Very high	93.4	Very high	93 Å²	93	66.9 Å²	66.9	56%	0.564	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.6	178.4	-180	0	0	0	0	109.3	V609 L610 E611	V609-V621 HydrophobicContact CG1-CG1 3.38Å; L610-V621 CarbonylContact O-C 3.57Å; L610-V621 WeakPolarHBondContact O-CA 3.46Å; E611-V621 HydrophobicContact CG-CG2 4.44Å
622	V	96.1	Very high	93.1	Very high	10 Å²	10	64.5 Å²	64.5	6%	0.061	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	115.6	176.8	-178.2	0	0	0	0	108.3	T421 L610 F612 K620 L627	T421-V622 HydrophobicContact CG2-CG1 4.19Å; L610-V622 HydrophobicContact CB-CB 4.45Å; L610-V622 PolarHBondContact N-O 2.94Å; L610-V622 PolarHBondContact O-N 3.08Å; F612-V622 HydrophobicContact CD2-CG2 4.31Å; F612-V622 HydrophobicContact CE2-CB 4.47Å; F612-V622 HydrophobicContact CE2-CG2 4.01Å; K620-V622 HydrophobicContact CD-CG2 4.46Å; K620-V622 HydrophobicContact CG-CG2 4.32Å; V622-L627 HydrophobicContact CG1-CD1 4.15Å; V622-L627 HydrophobicContact CG1-CD2 4.42Å
623	D	95.1	Very high	93	Very high	33 Å²	33	65.9 Å²	65.9	18%	0.176	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	102.7	172.1	-174.1	-16.6	0	0	0	108.7	V609 T625 K626	V609-D623 HydrophobicContact CG2-CB 4.33Å; D623-T625 PolarHBondContact O-N 3.16Å; D623-T625 WeakPolarHBondContact OD1-CB 3.26Å; D623-T625 PolarHBondContact OD1-N 2.95Å; D623-T625 PolarHBondContact OD1-OG1 3.32Å; D623-K626 HydrophobicContact CB-CB 4.41Å; D623-K626 HydrophobicContact CB-CD 4.11Å; D623-K626 HydrophobicContact CB-CG 4.33Å; D623-K626 PolarHBondContact O-N 2.91Å; D623-K626 VanDerWaalsContact O-N 3.12Å; D623-K626 VanDerWaalsContact OD2-CD 3.31Å; D623-K626 WeakPolarHBondContact OD2-CD 3.41Å; D623-K626 WeakPolarHBondContact OD2-CE 3.38Å; D623-K626 IonicContact OD2-NZ 3.3Å; D623-K626 PolarHBondContact OD2-NZ 3.04Å
624	V	93.2	Very high	92.8	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-64.1	-26.9	-173.4	-47.8	0	0	0	0	111.5	T421 H424 N607 G608 L610 K626 L627	T421-V624 HydrophobicContact CG2-CG1 4.07Å; H424-V624 HydrophobicContact CB-CG2 3.99Å; H424-V624 PolarHBondContact NE2-O 3.21Å; N607-V624 VanDerWaalsContact C-CG2 3.45Å; G608-V624 VanDerWaalsContact O-CG2 3.32Å; G608-V624 WeakPolarHBondContact O-CG2 3.4Å; G608-V624 PolarHBondContact O-N 3.23Å; L610-V624 HydrophobicContact CD1-CG1 3.82Å; L610-V624 HydrophobicContact CG-CG1 4.27Å; V624-K626 PolarHBondContact O-N 2.71Å; V624-L627 HydrophobicContact CB-CD1 4.43Å; V624-L627 PolarHBondContact O-N 3.44Å
625	T	90.1	Very high	92.7	Very high	94 Å²	94	62.6 Å²	62.6	58%	0.577	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-71.7	-15.3	-179.4	72.1	0	0	0	0	113.6	D623	D623-T625 PolarHBondContact O-N 3.16Å; D623-T625 WeakPolarHBondContact OD1-CB 3.26Å; D623-T625 PolarHBondContact OD1-N 2.95Å; D623-T625 PolarHBondContact OD1-OG1 3.32Å
626	K	92.3	Very high	92.8	Very high	161 Å²	161	59.4 Å²	59.4	70%	0.7	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-104.3	-4.2	-179.7	-65.7	179.3	-178.6	136.9	0	113.1	D623 V624	D623-K626 HydrophobicContact CB-CB 4.41Å; D623-K626 HydrophobicContact CB-CD 4.11Å; D623-K626 HydrophobicContact CB-CG 4.33Å; D623-K626 PolarHBondContact O-N 2.91Å; D623-K626 VanDerWaalsContact O-N 3.12Å; D623-K626 VanDerWaalsContact OD2-CD 3.31Å; D623-K626 WeakPolarHBondContact OD2-CD 3.41Å; D623-K626 WeakPolarHBondContact OD2-CE 3.38Å; D623-K626 IonicContact OD2-NZ 3.3Å; D623-K626 PolarHBondContact OD2-NZ 3.04Å; V624-K626 PolarHBondContact O-N 2.71Å
627	L	90.8	Very high	92.9	Very high	42 Å²	42	58.1 Å²	58.1	22%	0.22	32%	0.317	C	S	.	.	S	Bend	trans	-70	137.3	179.1	-67.1	175.9	0	0	0	110	H395 L398 T421 V622 V624 V629	H395-L627 WeakPolarHBondContact CE1-CB 3.2Å; L398-L627 HydrophobicContact CD1-CD1 4.23Å; T421-L627 HydrophobicContact CG2-CD1 3.7Å; V622-L627 HydrophobicContact CG1-CD1 4.15Å; V622-L627 HydrophobicContact CG1-CD2 4.42Å; V624-L627 HydrophobicContact CB-CD1 4.43Å; V624-L627 PolarHBondContact O-N 3.44Å; L627-V629 PolarHBondContact O-N 2.71Å
628	P	89.3	Confident	93	Very high	74 Å²	74	62.3 Å²	62.3	48%	0.481	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-65.5	130.7	174.4	28.3	-33.1	0	0	0	109.4	H395	H395-P628 PolarHBondContact CE1-O 3.36Å; H395-P628 PolarHBondContact ND1-O 3.28Å
629	V	88.9	Confident	92.9	Very high	59 Å²	59	61.3 Å²	61.3	36%	0.358	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-96.2	120.6	177.5	178	0	0	0	0	108.4	E425 L627	E425-V629 HydrophobicContact CG-CG1 4.13Å; E425-V629 HydrophobicContact CG-CG2 3.85Å; E425-V629 VanDerWaalsContact OE1-CG2 3.32Å; E425-V629 WeakPolarHBondContact OE1-CG2 3.27Å; L627-V629 PolarHBondContact O-N 2.71Å
630	T	90.8	Very high	92.8	Very high	36 Å²	36	57.7 Å²	57.7	22%	0.221	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-86.7	119.9	174.6	-53.8	0	0	0	0	108.9	S394 P396 W448	S394-T630 PolarHBondContact O-N 2.78Å; P396-T630 HydrophobicContact CG-CG2 4.01Å; W448-T630 HydrophobicContact CB-CG2 4.43Å; W448-T630 PolarHBondContact NE1-O 2.71Å
631	R	90.6	Very high	92.6	Very high	113 Å²	113	54.9 Å²	54.9	43%	0.426	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-70.3	137.3	178.8	-65.4	-172.6	-178.9	175.9	0.2	110.6	E337	E337-R631 HydrophobicContact CG-CB 3.9Å; E337-R631 WeakPolarHBondContact OE1-CD 3.28Å
632	K	92.7	Very high	92.4	Very high	16 Å²	16	54.5 Å²	54.5	7%	0.07	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-64.2	151.7	170.7	63.2	-165.2	174.5	-158.1	0	110.1	D338 E387 A390 D391 F444 C446 S447 W448 V634	D338-K632 HydrophobicContact CB-CG 4.03Å; D338-K632 WeakPolarHBondContact CB-O 3.26Å; D338-K632 PolarHBondContact N-O 2.89Å; D338-K632 VanDerWaalsContact OD2-CE 3.32Å; D338-K632 WeakPolarHBondContact OD2-CE 3.46Å; E387-K632 IonicContact OE1-NZ 2.77Å; E387-K632 PolarHBondContact OE1-NZ 2.87Å; A390-K632 HydrophobicContact CB-CD 4.4Å; D391-K632 IonicContact OD1-NZ 3.8Å; D391-K632 PolarHBondContact OD1-NZ 3.11Å; F444-K632 HydrophobicContact CZ-CD 4.47Å; C446-K632 HydrophobicContact CB-CB 4.23Å; S447-K632 CarbonylContact O-C 3.6Å; W448-K632 HydrophobicContact CD2-CB 4.42Å; W448-K632 HydrophobicContact CH2-CB 4.46Å; W448-K632 HydrophobicContact CZ2-CB 3.61Å; K632-V634 HydrophobicContact CD-CG2 4.45Å; K632-V634 HydrophobicContact CG-CG2 4.05Å
633	R	94.4	Very high	92.3	Very high	30 Å²	30	55.6 Å²	55.6	11%	0.113	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	130.9	171.3	-59.3	176.4	66	-120.8	6.5	108.2	P332 E335 V336 C446 S447	P332-R633 PolarHBondContact O-NH1 2.88Å; P332-R633 PolarHBondContact O-NH2 3.44Å; E335-R633 HydrophobicContact CB-CB 3.85Å; E335-R633 PolarHBondContact O-NH2 3.35Å; E335-R633 IonicContact OE2-NH1 2.84Å; V336-R633 CarbonylContact O-C 3.59Å; V336-R633 WeakPolarHBondContact O-CA 3.35Å; C446-R633 CarbonylContact C-O 3.56Å; C446-R633 WeakPolarHBondContact CA-O 3.08Å; C446-R633 WeakPolarHBondContact CB-O 3.36Å; S447-R633 PolarHBondContact N-O 2.97Å; S447-R633 WeakPolarHBondContact O-CB 3.5Å; S447-R633 PolarHBondContact O-N 3.5Å
634	V	94.5	Very high	92.3	Very high	3 Å²	3	54.2 Å²	54.2	2%	0.018	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	143.3	-175.7	-171.2	0	0	0	0	108.5	V336 F444 C446 K632	V336-V634 WeakPolarHBondContact CG2-O 3.42Å; V336-V634 PolarHBondContact N-O 3.5Å; V336-V634 PolarHBondContact O-N 3.04Å; F444-V634 HydrophobicContact CE2-CG1 4.38Å; F444-V634 HydrophobicContact CZ-CG2 4.16Å; C446-V634 HydrophobicContact CB-CG2 3.99Å; K632-V634 HydrophobicContact CD-CG2 4.45Å; K632-V634 HydrophobicContact CG-CG2 4.05Å
635	R	93.4	Very high	92.5	Very high	13 Å²	13	54.3 Å²	54.3	5%	0.049	28%	0.28	C	S	.	.			trans	-61.9	141.5	173.7	-65.9	-164.4	-69.7	-168.2	5.2	110.9	E328 V330 D334 E335 Q640 E644	E328-R635 IonicContact OE1-CZ 2.69Å; E328-R635 IonicContact OE1-NH1 3.1Å; E328-R635 PolarHBondContact OE1-NH1 3.24Å; E328-R635 VanDerWaalsContact OE1-NH1 3.1Å; E328-R635 IonicContact OE1-NH2 3.27Å; E328-R635 PolarHBondContact OE1-NH2 3.18Å; V330-R635 HydrophobicContact CG1-CG 4.23Å; D334-R635 HydrophobicContact CB-CG 4.17Å; E335-R635 HydrophobicContact CG-CG 3.74Å; R635-Q640 HydrophobicContact CB-CG 4.2Å; R635-Q640 PolarHBondContact O-NE2 2.96Å; R635-E644 IonicContact CZ-OE1 3.02Å; R635-E644 IonicContact NE-OE1 2.77Å; R635-E644 IonicContact NH2-OE1 2.83Å; R635-E644 PolarHBondContact NH2-OE1 3.1Å
636	P	93.2	Very high	92.7	Very high	38 Å²	38	51.5 Å²	51.5	25%	0.247	26%	0.259	C	S	.	.			trans	-54.4	146	169.4	-25	33.8	0	0	0	112	D334 V336 E638 K639 Q640	D334-P636 WeakPolarHBondContact O-CD 3.47Å; V336-P636 HydrophobicContact CG1-CG 4.41Å; V336-P636 HydrophobicContact CG2-CG 4.1Å; P636-E638 VanDerWaalsContact CB-OE2 3.28Å; P636-E638 WeakPolarHBondContact CB-OE2 3.47Å; P636-E638 PolarHBondContact O-N 3.25Å; P636-E638 VanDerWaalsContact O-N 3.07Å; P636-K639 PolarHBondContact O-N 2.91Å; P636-Q640 WeakPolarHBondContact O-CG 3.38Å; P636-Q640 PolarHBondContact O-N 3.44Å
637	I	92.4	Very high	92.9	Very high	61 Å²	61	48.3 Å²	48.3	31%	0.313	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-55.1	-33.3	-173.8	-68	175.9	0	0	0	111.9	K639 Q640 R646 R647	I637-K639 PolarHBondContact O-N 3.27Å; I637-Q640 PolarHBondContact O-N 3.15Å; I637-R646 HydrophobicContact CG1-CB 4.3Å; I637-R647 HydrophobicContact CG2-CB 4.09Å; I637-R647 HydrophobicContact CG2-CG 4.21Å
638	E	92.3	Very high	93.2	Very high	154 Å²	154	47.3 Å²	47.3	72%	0.72	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-66.2	-28.1	-179.4	-56	72.4	-154.6	0	0	112.5	P636	P636-E638 VanDerWaalsContact CB-OE2 3.28Å; P636-E638 WeakPolarHBondContact CB-OE2 3.47Å; P636-E638 PolarHBondContact O-N 3.25Å; P636-E638 VanDerWaalsContact O-N 3.07Å
639	K	92	Very high	93.5	Very high	107 Å²	107	44 Å²	44	47%	0.465	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-94.3	-9.9	177.9	-64.8	-171.5	176.8	-177.3	0	113.4	D334 P636 I637	D334-K639 HydrophobicContact CB-CD 4.1Å; D334-K639 IonicContact OD1-NZ 3.1Å; D334-K639 PolarHBondContact OD1-NZ 2.9Å; P636-K639 PolarHBondContact O-N 2.91Å; I637-K639 PolarHBondContact O-N 3.27Å
640	Q	93.4	Very high	93.9	Very high	3 Å²	3	44.3 Å²	44.3	1%	0.014	21%	0.212	C	C	.	.	S	Bend	trans	-76.3	146.8	-179.7	-68.9	-172	10.4	0	0	111.6	R635 P636 I637 E644 R647	R635-Q640 HydrophobicContact CB-CG 4.2Å; R635-Q640 PolarHBondContact O-NE2 2.96Å; P636-Q640 WeakPolarHBondContact O-CG 3.38Å; P636-Q640 PolarHBondContact O-N 3.44Å; I637-Q640 PolarHBondContact O-N 3.15Å; Q640-E644 WeakPolarHBondContact CA-OE1 3.36Å; Q640-E644 HydrophobicContact CB-CB 3.93Å; Q640-E644 HydrophobicContact CB-CG 4.4Å; Q640-E644 HydrophobicContact CG-CB 4.41Å; Q640-E644 VanDerWaalsContact CG-OE2 3.27Å; Q640-E644 WeakPolarHBondContact CG-OE2 3.33Å; Q640-R647 HydrophobicContact CB-CB 3.98Å; Q640-R647 WeakPolarHBondContact O-CD 3.49Å; Q640-R647 PolarHBondContact O-NH1 3Å; Q640-R647 VanDerWaalsContact OE1-N 3.12Å
641	A	91.7	Very high	94.1	Very high	12 Å²	12	47.4 Å²	47.4	10%	0.099	22%	0.224	C	C	.	.			trans	-65.5	156.3	172.3	0	0	0	0	0	111.8	T643 E644	A641-T643 PolarHBondContact O-N 2.86Å; A641-E644 HydrophobicContact CB-CG 4.25Å; A641-E644 PolarHBondContact N-OE1 3.42Å; A641-E644 WeakPolarHBondContact O-CB 3.2Å; A641-E644 PolarHBondContact O-N 3.3Å
642	P	93.2	Very high	94.3	Very high	85 Å²	85	42 Å²	42	55%	0.552	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-22.6	179.2	-25.7	35	0	0	0	115.1
643	T	93.3	Very high	94.4	Very high	34 Å²	34	42 Å²	42	21%	0.209	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-1.3	178.5	61.3	0	0	0	0	113.4	E442 T443 A641 R692	E442-T643 WeakPolarHBondContact CA-O 3.43Å; T443-T643 PolarHBondContact N-O 2.76Å; A641-T643 PolarHBondContact O-N 2.86Å; T643-R692 PolarHBondContact OG1-NH2 2.98Å
644	E	95.9	Very high	94.3	Very high	3 Å²	3	44.3 Å²	44.3	1%	0.014	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-75.5	138.3	176.4	-82.5	-178	-116.9	0	0	111.6	T443 R635 Q640 A641 R646 R647 L648	T443-E644 CarbonylContact O-C 3.58Å; T443-E644 WeakPolarHBondContact O-CA 3.47Å; R635-E644 IonicContact CZ-OE1 3.02Å; R635-E644 IonicContact NE-OE1 2.77Å; R635-E644 IonicContact NH2-OE1 2.83Å; R635-E644 PolarHBondContact NH2-OE1 3.1Å; Q640-E644 WeakPolarHBondContact CA-OE1 3.36Å; Q640-E644 HydrophobicContact CB-CB 3.93Å; Q640-E644 HydrophobicContact CB-CG 4.4Å; Q640-E644 HydrophobicContact CG-CB 4.41Å; Q640-E644 VanDerWaalsContact CG-OE2 3.27Å; Q640-E644 WeakPolarHBondContact CG-OE2 3.33Å; A641-E644 HydrophobicContact CB-CG 4.25Å; A641-E644 PolarHBondContact N-OE1 3.42Å; A641-E644 WeakPolarHBondContact O-CB 3.2Å; A641-E644 PolarHBondContact O-N 3.3Å; E644-R646 PolarHBondContact O-N 2.98Å; E644-R646 VanDerWaalsContact O-N 3.16Å; E644-R647 PolarHBondContact O-N 3.3Å; E644-L648 VanDerWaalsContact O-CB 3.23Å; E644-L648 WeakPolarHBondContact O-CB 3.3Å; E644-L648 PolarHBondContact O-N 3.46Å
645	S	96.9	Very high	94.3	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.014	22%	0.217	C	C	.	.	H	α-helix	trans	-51	-46.3	-167.7	-60.1	0	0	0	0	114.2	E442 T443 W649	E442-S645 VanDerWaalsContact OE1-CB 3.31Å; E442-S645 WeakPolarHBondContact OE1-CB 3.45Å; E442-S645 PolarHBondContact OE1-OG 3.27Å; T443-S645 PolarHBondContact O-N 3.45Å; T443-S645 PolarHBondContact O-OG 2.86Å; S645-W649 WeakPolarHBondContact O-CB 2.97Å; S645-W649 VanDerWaalsContact O-CD1 3.23Å; S645-W649 PolarHBondContact O-N 3.48Å
646	R	95.4	Very high	94.2	Very high	35 Å²	35	44.4 Å²	44.4	13%	0.132	22%	0.219	C	C	.	.	H	α-helix	trans	-70.8	-42.7	-176.2	-64.1	-175.2	172.8	-170.3	-5.5	112	D338 E387 I637 E644 Q650	D338-R646 IonicContact OD1-CZ 3.14Å; D338-R646 IonicContact OD1-NH1 3.65Å; D338-R646 PolarHBondContact OD1-NH1 3.44Å; D338-R646 IonicContact OD1-NH2 2.65Å; D338-R646 PolarHBondContact OD1-NH2 3.47Å; D338-R646 VanDerWaalsContact OD1-NH2 3.1Å; D338-R646 IonicContact OD2-CZ 3.7Å; D338-R646 IonicContact OD2-NH1 2.68Å; D338-R646 IonicContact OD2-NH2 3.29Å; D338-R646 PolarHBondContact OD2-NH2 3.48Å; E387-R646 IonicContact OE1-CZ 3.92Å; E387-R646 IonicContact OE1-NE 3.19Å; E387-R646 PolarHBondContact OE1-NE 3.28Å; E387-R646 IonicContact OE1-NH2 2.66Å; E387-R646 PolarHBondContact OE1-NH2 3.07Å; E387-R646 WeakPolarHBondContact OE2-CG 3.36Å; E387-R646 IonicContact OE2-NE 3.52Å; E387-R646 PolarHBondContact OE2-NE 2.89Å; I637-R646 HydrophobicContact CG1-CB 4.3Å; E644-R646 PolarHBondContact O-N 2.98Å; E644-R646 VanDerWaalsContact O-N 3.16Å; R646-Q650 WeakPolarHBondContact O-CA 3.46Å; R646-Q650 WeakPolarHBondContact O-CB 3.4Å; R646-Q650 PolarHBondContact O-N 3.44Å
647	R	96	Very high	93.9	Very high	95 Å²	95	48.1 Å²	48.1	36%	0.358	23%	0.228	S	C	.	.	H	α-helix	trans	-66.2	-42.2	174.9	-175.2	171.5	176.1	176.5	2.1	112.1	I637 Q640 E644 Q650	I637-R647 HydrophobicContact CG2-CB 4.09Å; I637-R647 HydrophobicContact CG2-CG 4.21Å; Q640-R647 HydrophobicContact CB-CB 3.98Å; Q640-R647 WeakPolarHBondContact O-CD 3.49Å; Q640-R647 PolarHBondContact O-NH1 3Å; Q640-R647 VanDerWaalsContact OE1-N 3.12Å; E644-R647 PolarHBondContact O-N 3.3Å; R647-Q650 WeakPolarHBondContact O-CG 3.38Å; R647-Q650 PolarHBondContact O-N 3.21Å
648	L	96.8	Very high	93.9	Very high	20 Å²	20	50.3 Å²	50.3	11%	0.105	24%	0.237	C	C	.	.	H	α-helix	trans	-61.9	-47.4	179.6	179.8	70.1	0	0	0	111.8	I439 E442 E644 L671	I439-L648 HydrophobicContact CD1-CD1 3.8Å; I439-L648 HydrophobicContact CD1-CD2 3.45Å; I439-L648 VanDerWaalsContact CD1-CD2 3.45Å; I439-L648 HydrophobicContact CD1-CG 4.2Å; I439-L648 HydrophobicContact CG1-CD2 3.6Å; E442-L648 HydrophobicContact CB-CD2 4.23Å; E442-L648 HydrophobicContact CG-CD2 3.74Å; E442-L648 WeakPolarHBondContact OE2-CD2 3.44Å; E644-L648 VanDerWaalsContact O-CB 3.23Å; E644-L648 WeakPolarHBondContact O-CB 3.3Å; E644-L648 PolarHBondContact O-N 3.46Å; L648-L671 HydrophobicContact CD1-CD2 3.91Å
649	W	96.6	Very high	93.6	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.015	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	7.8	-176.4	-66.7	102.5	0	0	0	113.8	Y436 N437 I439 E442 S645 H651 V652 T653 K668 L671	Y436-W649 HydrophobicContact CD1-CE3 4.45Å; Y436-W649 HydrophobicContact CD2-CB 3.72Å; Y436-W649 AromaticContact CD2-CD1 4Å; Y436-W649 AromaticContact CD2-CD2 3.6Å; Y436-W649 HydrophobicContact CD2-CD2 3.6Å; Y436-W649 AromaticContact CD2-CE3 3.95Å; Y436-W649 HydrophobicContact CD2-CE3 3.95Å; Y436-W649 AromaticContact CD2-CG 3.49Å; Y436-W649 HydrophobicContact CD2-CG 3.49Å; Y436-W649 VanDerWaalsContact CD2-CG 3.49Å; Y436-W649 HydrophobicContact CE2-CB 3.72Å; Y436-W649 HydrophobicContact CE2-CD2 4.3Å; Y436-W649 HydrophobicContact CE2-CE3 4.42Å; Y436-W649 HydrophobicContact CE2-CG 4.02Å; Y436-W649 AromaticContact CG-CD2 3.89Å; Y436-W649 HydrophobicContact CG-CD2 3.89Å; Y436-W649 AromaticContact CG-CE3 3.97Å; Y436-W649 HydrophobicContact CG-CE3 3.97Å; Y436-W649 HydrophobicContact CG-CG 4.26Å; Y436-W649 HydrophobicContact CG-CZ3 4.41Å; N437-W649 WeakPolarHBondContact O-CZ2 3.1Å; I439-W649 HydrophobicContact CG2-CZ2 4.18Å; E442-W649 PolarHBondContact OE2-NE1 3.23Å; S645-W649 WeakPolarHBondContact O-CB 2.97Å; S645-W649 VanDerWaalsContact O-CD1 3.23Å; S645-W649 PolarHBondContact O-N 3.48Å; W649-H651 VanDerWaalsContact C-N 3.32Å; W649-H651 PolarHBondContact O-N 2.96Å; W649-V652 HydrophobicContact CE3-CB 4.14Å; W649-V652 HydrophobicContact CE3-CG1 4.43Å; W649-V652 HydrophobicContact CE3-CG2 3.85Å; W649-V652 HydrophobicContact CZ3-CG2 4.18Å; W649-V652 PolarHBondContact O-N 3.01Å; W649-T653 WeakPolarHBondContact O-CB 3.46Å; W649-T653 PolarHBondContact O-N 3.34Å; W649-T653 PolarHBondContact O-OG1 2.89Å; W649-K668 HydrophobicContact CZ3-CG 4.26Å; W649-L671 HydrophobicContact CD2-CD1 4.23Å; W649-L671 HydrophobicContact CE3-CD1 3.69Å; W649-L671 HydrophobicContact CH2-CD1 4.37Å; W649-L671 HydrophobicContact CZ3-CD1 3.77Å
650	Q	95.7	Very high	93.6	Very high	66 Å²	66	48.2 Å²	48.2	31%	0.308	23%	0.228	S	C	.	.	H	α-helix	trans	-54.9	-42.9	-171.5	70.2	-173.9	-9.4	0	0	113.3	R646 R647 T653 E654	R646-Q650 WeakPolarHBondContact O-CA 3.46Å; R646-Q650 WeakPolarHBondContact O-CB 3.4Å; R646-Q650 PolarHBondContact O-N 3.44Å; R647-Q650 WeakPolarHBondContact O-CG 3.38Å; R647-Q650 PolarHBondContact O-N 3.21Å; Q650-T653 PolarHBondContact O-N 2.92Å; Q650-E654 WeakPolarHBondContact O-CB 3.47Å; Q650-E654 PolarHBondContact O-N 3.07Å
651	H	96.1	Very high	93.4	Very high	102 Å²	102	50.3 Å²	50.3	47%	0.472	24%	0.239	S	C	.	.	H	α-helix	trans	-74.7	-33.8	-175.9	-61.7	-53.3	0	0	0	112.5	W649 A655 H667	W649-H651 VanDerWaalsContact C-N 3.32Å; W649-H651 PolarHBondContact O-N 2.96Å; H651-A655 WeakPolarHBondContact O-CB 3.33Å; H651-A655 PolarHBondContact O-N 3.41Å; H651-A655 VanDerWaalsContact O-N 3.13Å; H651-H667 HydrophobicContact CB-CB 4.25Å
652	V	95	Very high	93.3	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-67.1	-45.6	172.7	-179.8	0	0	0	0	109.6	Y436 W649 E654 A655 L656 H667 K668 L671	Y436-V652 HydrophobicContact CE1-CG1 3.95Å; W649-V652 HydrophobicContact CE3-CB 4.14Å; W649-V652 HydrophobicContact CE3-CG1 4.43Å; W649-V652 HydrophobicContact CE3-CG2 3.85Å; W649-V652 HydrophobicContact CZ3-CG2 4.18Å; W649-V652 PolarHBondContact O-N 3.01Å; V652-E654 PolarHBondContact O-N 2.99Å; V652-A655 PolarHBondContact O-N 3.38Å; V652-L656 HydrophobicContact CG1-CD1 4.29Å; V652-L656 WeakPolarHBondContact O-CG 3.36Å; V652-L656 PolarHBondContact O-N 3.14Å; V652-H667 HydrophobicContact CG2-CB 3.71Å; V652-K668 HydrophobicContact CG2-CB 4.09Å; V652-L671 HydrophobicContact CG2-CD1 4.16Å
653	T	93.8	Very high	93.4	Very high	14 Å²	14	56.6 Å²	56.6	9%	0.086	26%	0.262	C	S	.	.	H	α-helix	trans	-61.1	-45.9	179.7	-57.3	0	0	0	0	111.5	F340 K382 Y436 W649 Q650 L656 R657	F340-T653 HydrophobicContact CE2-CG2 4.4Å; F340-T653 HydrophobicContact CZ-CG2 4.44Å; K382-T653 HydrophobicContact CB-CG2 4.19Å; Y436-T653 PolarHBondContact OH-OG1 3.32Å; W649-T653 WeakPolarHBondContact O-CB 3.46Å; W649-T653 PolarHBondContact O-N 3.34Å; W649-T653 PolarHBondContact O-OG1 2.89Å; Q650-T653 PolarHBondContact O-N 2.92Å; T653-L656 PolarHBondContact O-N 2.99Å; T653-R657 WeakPolarHBondContact O-CG 3.44Å; T653-R657 PolarHBondContact O-N 3.45Å
654	E	93.6	Very high	93.4	Very high	80 Å²	80	55 Å²	55	37%	0.374	25%	0.252	S	S	.	.	H	α-helix	trans	-66.2	-42.7	179.2	-174.8	55.7	-153.2	0	0	112.4	Q650 V652 L656 R657 Q658	Q650-E654 WeakPolarHBondContact O-CB 3.47Å; Q650-E654 PolarHBondContact O-N 3.07Å; V652-E654 PolarHBondContact O-N 2.99Å; E654-L656 VanDerWaalsContact C-N 3.34Å; E654-L656 PolarHBondContact O-N 3.16Å; E654-R657 WeakPolarHBondContact O-CB 3.46Å; E654-R657 PolarHBondContact O-N 2.56Å; E654-R657 IonicContact OE2-NH1 3.67Å; E654-Q658 WeakPolarHBondContact O-CG 3.4Å; E654-Q658 PolarHBondContact O-N 3.18Å; E654-Q658 PolarHBondContact OE1-NE2 3.06Å
655	A	94	Very high	93.3	Very high	2 Å²	2	57.7 Å²	57.7	2%	0.017	27%	0.269	C	S	.	.	H	α-helix	trans	-62.6	-40.6	175.6	0	0	0	0	0	112.1	H651 V652 R657 Q658 K659 D660 K663 A664	H651-A655 WeakPolarHBondContact O-CB 3.33Å; H651-A655 PolarHBondContact O-N 3.41Å; H651-A655 VanDerWaalsContact O-N 3.13Å; V652-A655 PolarHBondContact O-N 3.38Å; A655-R657 PolarHBondContact O-N 3.43Å; A655-Q658 CarbonylContact O-C 3.59Å; A655-Q658 PolarHBondContact O-N 3.48Å; A655-K659 PolarHBondContact O-N 3.37Å; A655-K659 VanDerWaalsContact O-N 3.16Å; A655-D660 PolarHBondContact O-N 3.36Å; A655-K663 HydrophobicContact CB-CB 4.15Å; A655-K663 HydrophobicContact CB-CD 4.38Å; A655-K663 HydrophobicContact CB-CG 4.14Å; A655-A664 HydrophobicContact CB-CB 3.73Å
656	L	90	Very high	93.2	Very high	15 Å²	15	61.3 Å²	61.3	8%	0.079	29%	0.286	C	S	.	.	H	α-helix	trans	-64	-36.9	173.8	-74.2	177.3	0	0	0	112.9	T377 L380 K382 Y436 V652 T653 E654 Q658 K659 I661 A664	T377-L656 HydrophobicContact CG2-CD2 4.14Å; L380-L656 HydrophobicContact CB-CD1 4.32Å; K382-L656 HydrophobicContact CD-CB 4.23Å; K382-L656 HydrophobicContact CG-CB 4.35Å; K382-L656 HydrophobicContact CG-CD1 4.46Å; Y436-L656 HydrophobicContact CE1-CD1 4.03Å; Y436-L656 VanDerWaalsContact OH-CD1 3.29Å; Y436-L656 WeakPolarHBondContact OH-CD1 3.37Å; V652-L656 HydrophobicContact CG1-CD1 4.29Å; V652-L656 WeakPolarHBondContact O-CG 3.36Å; V652-L656 PolarHBondContact O-N 3.14Å; T653-L656 PolarHBondContact O-N 2.99Å; E654-L656 VanDerWaalsContact C-N 3.34Å; E654-L656 PolarHBondContact O-N 3.16Å; L656-Q658 VanDerWaalsContact C-N 3.32Å; L656-K659 PolarHBondContact O-N 2.97Å; L656-K659 VanDerWaalsContact O-N 3.13Å; L656-I661 HydrophobicContact CD2-CD1 4Å; L656-A664 HydrophobicContact CD2-CB 3.84Å; L656-A664 HydrophobicContact CG-CB 3.88Å
657	R	88.6	Confident	93.3	Very high	116 Å²	116	62.3 Å²	62.3	44%	0.438	29%	0.291	S	S	.	.	H	α-helix	trans	-64.1	-38.5	173.8	-74.8	170.7	169.4	-178.8	-11.4	112.3	K382 T653 E654 A655 K659	K382-R657 HydrophobicContact CD-CG 3.67Å; T653-R657 WeakPolarHBondContact O-CG 3.44Å; T653-R657 PolarHBondContact O-N 3.45Å; E654-R657 WeakPolarHBondContact O-CB 3.46Å; E654-R657 PolarHBondContact O-N 2.56Å; E654-R657 IonicContact OE2-NH1 3.67Å; A655-R657 PolarHBondContact O-N 3.43Å; R657-K659 PolarHBondContact O-N 3.45Å
658	Q	91	Very high	93.2	Very high	108 Å²	108	59 Å²	59	51%	0.505	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-0	175.4	-65.4	176.1	7	0	0	112.9	E654 A655 L656 D660	E654-Q658 WeakPolarHBondContact O-CG 3.4Å; E654-Q658 PolarHBondContact O-N 3.18Å; E654-Q658 PolarHBondContact OE1-NE2 3.06Å; A655-Q658 CarbonylContact O-C 3.59Å; A655-Q658 PolarHBondContact O-N 3.48Å; L656-Q658 VanDerWaalsContact C-N 3.32Å; Q658-D660 PolarHBondContact O-N 3.36Å
659	K	87.4	Confident	93	Very high	156 Å²	156	64.8 Å²	64.8	68%	0.678	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	24.9	-173.7	-56.7	-175.3	176	-172.2	0	113.4	A655 L656 R657 I661	A655-K659 PolarHBondContact O-N 3.37Å; A655-K659 VanDerWaalsContact O-N 3.16Å; L656-K659 PolarHBondContact O-N 2.97Å; L656-K659 VanDerWaalsContact O-N 3.13Å; R657-K659 PolarHBondContact O-N 3.45Å; K659-I661 PolarHBondContact O-N 3.22Å
660	D	90.3	Very high	92.9	Very high	61 Å²	61	68.5 Å²	68.5	33%	0.326	32%	0.323	S	S	.	.			trans	-91.4	85.1	175.6	-172.6	-16.7	0	0	0	109.5	A655 Q658 D662 K663 A664	A655-D660 PolarHBondContact O-N 3.36Å; Q658-D660 PolarHBondContact O-N 3.36Å; D660-D662 VanDerWaalsContact C-N 3.34Å; D660-K663 HydrophobicContact CB-CB 4.14Å; D660-K663 WeakPolarHBondContact OD1-CB 3.5Å; D660-K663 PolarHBondContact OD1-N 3.03Å; D660-K663 VanDerWaalsContact OD2-CB 3.25Å; D660-K663 WeakPolarHBondContact OD2-CB 3.36Å; D660-K663 WeakPolarHBondContact OD2-CD 3.48Å; D660-A664 WeakPolarHBondContact O-CB 3.38Å; D660-A664 PolarHBondContact O-N 3.42Å
661	I	89.9	Confident	92.8	Very high	47 Å²	47	66.8 Å²	66.8	24%	0.241	32%	0.316	C	S	.	.	H	α-helix	trans	-67.2	-35.4	-174.7	-54.8	-54.2	0	0	0	111.8	F378 L656 K659 A664 T665	F378-I661 HydrophobicContact CB-CD1 3.91Å; F378-I661 HydrophobicContact CB-CG1 4.36Å; F378-I661 HydrophobicContact CB-CG2 4.38Å; L656-I661 HydrophobicContact CD2-CD1 4Å; K659-I661 PolarHBondContact O-N 3.22Å; I661-A664 PolarHBondContact O-N 3.16Å; I661-T665 WeakPolarHBondContact O-CB 3.39Å; I661-T665 PolarHBondContact O-N 2.94Å; I661-T665 PolarHBondContact O-OG1 3.35Å
662	D	90.7	Very high	92.6	Very high	137 Å²	137	63.6 Å²	63.6	73%	0.733	30%	0.301	S	S	*	.	H	α-helix	trans	-65.9	-47.9	179.5	-71.8	-31.7	0	0	0	110.6	D660 A664 T665 E666	D660-D662 VanDerWaalsContact C-N 3.34Å; D662-A664 PolarHBondContact O-N 3.33Å; D662-T665 WeakPolarHBondContact O-CB 3.34Å; D662-T665 PolarHBondContact O-N 3.45Å; D662-E666 PolarHBondContact O-N 3.36Å
663	K	95.1	Very high	92.5	Very high	92 Å²	92	67.6 Å²	67.6	40%	0.4	32%	0.32	S	S	.	.	H	α-helix	trans	-65.7	-38.6	176.8	-171.5	178.1	180	-175.3	0	112.3	A655 D660 T665 E666 H667	A655-K663 HydrophobicContact CB-CB 4.15Å; A655-K663 HydrophobicContact CB-CD 4.38Å; A655-K663 HydrophobicContact CB-CG 4.14Å; D660-K663 HydrophobicContact CB-CB 4.14Å; D660-K663 WeakPolarHBondContact OD1-CB 3.5Å; D660-K663 PolarHBondContact OD1-N 3.03Å; D660-K663 VanDerWaalsContact OD2-CB 3.25Å; D660-K663 WeakPolarHBondContact OD2-CB 3.36Å; D660-K663 WeakPolarHBondContact OD2-CD 3.48Å; K663-T665 VanDerWaalsContact C-N 3.31Å; K663-T665 PolarHBondContact O-N 3Å; K663-E666 PolarHBondContact O-N 3.37Å; K663-H667 PolarHBondContact O-CD2 3.39Å; K663-H667 VanDerWaalsContact O-CD2 3.25Å; K663-H667 PolarHBondContact O-N 2.96Å
664	A	93.6	Very high	92.5	Very high	0 Å²	0	73.5 Å²	73.5	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-61.2	-42.1	174	0	0	0	0	0	111.4	T377 A655 L656 D660 I661 D662 K668	T377-A664 HydrophobicContact CG2-CB 3.72Å; A655-A664 HydrophobicContact CB-CB 3.73Å; L656-A664 HydrophobicContact CD2-CB 3.84Å; L656-A664 HydrophobicContact CG-CB 3.88Å; D660-A664 WeakPolarHBondContact O-CB 3.38Å; D660-A664 PolarHBondContact O-N 3.42Å; I661-A664 PolarHBondContact O-N 3.16Å; D662-A664 PolarHBondContact O-N 3.33Å; A664-K668 VanDerWaalsContact O-CB 3.27Å; A664-K668 WeakPolarHBondContact O-CB 3.29Å; A664-K668 PolarHBondContact O-N 2.97Å
665	T	92.7	Very high	92.3	Very high	59 Å²	59	70.3 Å²	70.3	36%	0.362	33%	0.326	S	S	.	.	H	α-helix	trans	-63.8	-41.8	177.1	-57.7	0	0	0	0	111.2	T377 I661 D662 K663 K668 R669	T377-T665 VanDerWaalsContact CB-OG1 3.31Å; T377-T665 WeakPolarHBondContact CB-OG1 3.49Å; T377-T665 PolarHBondContact OG1-OG1 2.94Å; I661-T665 WeakPolarHBondContact O-CB 3.39Å; I661-T665 PolarHBondContact O-N 2.94Å; I661-T665 PolarHBondContact O-OG1 3.35Å; D662-T665 WeakPolarHBondContact O-CB 3.34Å; D662-T665 PolarHBondContact O-N 3.45Å; K663-T665 VanDerWaalsContact C-N 3.31Å; K663-T665 PolarHBondContact O-N 3Å; T665-K668 PolarHBondContact O-N 3.24Å; T665-R669 WeakPolarHBondContact O-CB 3.34Å; T665-R669 PolarHBondContact O-N 3.45Å
666	E	95.4	Very high	92.2	Very high	79 Å²	79	75 Å²	75	37%	0.369	34%	0.343	S	S	.	.	H	α-helix	trans	-65.9	-48.6	177.9	-177.3	57	-161.7	0	0	112.3	D662 K663 K668 R669 V670	D662-E666 PolarHBondContact O-N 3.36Å; K663-E666 PolarHBondContact O-N 3.37Å; E666-K668 VanDerWaalsContact C-N 3.28Å; E666-K668 PolarHBondContact O-N 2.98Å; E666-R669 WeakPolarHBondContact O-CB 3.3Å; E666-R669 PolarHBondContact O-N 2.98Å; E666-R669 VanDerWaalsContact O-N 3.11Å; E666-R669 IonicContact OE1-CZ 3.69Å; E666-R669 IonicContact OE1-NE 3.23Å; E666-R669 IonicContact OE1-NH2 3.33Å; E666-R669 PolarHBondContact OE1-NH2 3Å; E666-R669 IonicContact OE2-CZ 3.91Å; E666-R669 IonicContact OE2-NE 3.25Å; E666-R669 PolarHBondContact OE2-NE 3.2Å; E666-R669 IonicContact OE2-NH2 3.76Å; E666-R669 PolarHBondContact OE2-NH2 3.26Å; E666-V670 WeakPolarHBondContact O-CG2 3.39Å; E666-V670 PolarHBondContact O-N 3.03Å
667	H	96.2	Very high	92.3	Very high	55 Å²	55	76.3 Å²	76.3	26%	0.255	36%	0.356	S	S	.	.	H	α-helix	trans	-59.6	-40.4	176.6	-75.1	-50.4	0	0	0	112	H651 V652 K663 V670 L671	H651-H667 HydrophobicContact CB-CB 4.25Å; V652-H667 HydrophobicContact CG2-CB 3.71Å; K663-H667 PolarHBondContact O-CD2 3.39Å; K663-H667 VanDerWaalsContact O-CD2 3.25Å; K663-H667 PolarHBondContact O-N 2.96Å; H667-V670 PolarHBondContact O-N 3.04Å; H667-L671 PolarHBondContact O-N 3.36Å
668	K	94.3	Very high	92.4	Very high	27 Å²	27	73.6 Å²	73.6	12%	0.117	35%	0.348	C	S	.	.	H	α-helix	trans	-62.9	-44	174.6	178	176.2	178.4	-68.2	0	111.4	L380 W649 V652 A664 T665 E666 V670 L671 E672	L380-K668 HydrophobicContact CD1-CD 3.8Å; W649-K668 HydrophobicContact CZ3-CG 4.26Å; V652-K668 HydrophobicContact CG2-CB 4.09Å; A664-K668 VanDerWaalsContact O-CB 3.27Å; A664-K668 WeakPolarHBondContact O-CB 3.29Å; A664-K668 PolarHBondContact O-N 2.97Å; T665-K668 PolarHBondContact O-N 3.24Å; E666-K668 VanDerWaalsContact C-N 3.28Å; E666-K668 PolarHBondContact O-N 2.98Å; K668-V670 VanDerWaalsContact C-N 3.34Å; K668-V670 PolarHBondContact O-N 3.02Å; K668-L671 PolarHBondContact O-N 3.08Å; K668-E672 WeakPolarHBondContact CE-OE1 3.15Å; K668-E672 IonicContact NZ-OE1 2.81Å; K668-E672 PolarHBondContact NZ-OE1 2.73Å; K668-E672 IonicContact NZ-OE2 2.69Å; K668-E672 PolarHBondContact NZ-OE2 2.9Å; K668-E672 WeakPolarHBondContact O-CG 3.4Å; K668-E672 PolarHBondContact O-N 3.29Å
669	R	93.3	Very high	92.4	Very high	141 Å²	141	71.4 Å²	71.4	53%	0.532	34%	0.338	S	S	.	.	H	α-helix	trans	-60.5	-42.8	177.9	-175.4	178.4	73.3	139.9	5.5	111.7	T665 E666 E672 E673	T665-R669 WeakPolarHBondContact O-CB 3.34Å; T665-R669 PolarHBondContact O-N 3.45Å; E666-R669 WeakPolarHBondContact O-CB 3.3Å; E666-R669 PolarHBondContact O-N 2.98Å; E666-R669 VanDerWaalsContact O-N 3.11Å; E666-R669 IonicContact OE1-CZ 3.69Å; E666-R669 IonicContact OE1-NE 3.23Å; E666-R669 IonicContact OE1-NH2 3.33Å; E666-R669 PolarHBondContact OE1-NH2 3Å; E666-R669 IonicContact OE2-CZ 3.91Å; E666-R669 IonicContact OE2-NE 3.25Å; E666-R669 PolarHBondContact OE2-NE 3.2Å; E666-R669 IonicContact OE2-NH2 3.76Å; E666-R669 PolarHBondContact OE2-NH2 3.26Å; R669-E672 PolarHBondContact O-N 3.07Å; R669-E673 WeakPolarHBondContact O-CB 3.35Å; R669-E673 PolarHBondContact O-N 2.93Å
670	V	95.1	Very high	92.6	Very high	82 Å²	82	70.6 Å²	70.6	50%	0.497	33%	0.331	S	S	.	.	H	α-helix	trans	-60.3	-45.5	177.8	170.8	0	0	0	0	111.3	E666 H667 K668 R674	E666-V670 WeakPolarHBondContact O-CG2 3.39Å; E666-V670 PolarHBondContact O-N 3.03Å; H667-V670 PolarHBondContact O-N 3.04Å; K668-V670 VanDerWaalsContact C-N 3.34Å; K668-V670 PolarHBondContact O-N 3.02Å; V670-R674 WeakPolarHBondContact O-CB 3.39Å; V670-R674 PolarHBondContact O-N 2.87Å
671	L	93.6	Very high	92.6	Very high	30 Å²	30	73.5 Å²	73.5	16%	0.157	34%	0.343	C	S	.	.	H	α-helix	trans	-62.9	-46.4	177.4	-72	171.5	0	0	0	112.1	L648 W649 V652 H667 K668 R674 Q675	L648-L671 HydrophobicContact CD1-CD2 3.91Å; W649-L671 HydrophobicContact CD2-CD1 4.23Å; W649-L671 HydrophobicContact CE3-CD1 3.69Å; W649-L671 HydrophobicContact CH2-CD1 4.37Å; W649-L671 HydrophobicContact CZ3-CD1 3.77Å; V652-L671 HydrophobicContact CG2-CD1 4.16Å; H667-L671 PolarHBondContact O-N 3.36Å; K668-L671 PolarHBondContact O-N 3.08Å; L671-R674 PolarHBondContact O-N 3.38Å; L671-Q675 PolarHBondContact O-N 2.7Å
672	E	90.9	Very high	92.7	Very high	35 Å²	35	73.6 Å²	73.6	16%	0.164	34%	0.34	C	S	.	.	H	α-helix	trans	-67.5	-37.9	-180	-69.5	-178	162.1	0	0	112.6	K668 R669 Q675 R676	K668-E672 WeakPolarHBondContact CE-OE1 3.15Å; K668-E672 IonicContact NZ-OE1 2.81Å; K668-E672 PolarHBondContact NZ-OE1 2.73Å; K668-E672 IonicContact NZ-OE2 2.69Å; K668-E672 PolarHBondContact NZ-OE2 2.9Å; K668-E672 WeakPolarHBondContact O-CG 3.4Å; K668-E672 PolarHBondContact O-N 3.29Å; R669-E672 PolarHBondContact O-N 3.07Å; E672-Q675 WeakPolarHBondContact O-CB 3.31Å; E672-Q675 PolarHBondContact O-N 2.99Å; E672-R676 WeakPolarHBondContact O-CG 3.47Å; E672-R676 PolarHBondContact O-N 3.33Å; E672-R676 IonicContact OE2-NH2 2.67Å; E672-R676 PolarHBondContact OE2-NH2 2.97Å
673	E	92.7	Very high	92.6	Very high	83 Å²	83	70.7 Å²	70.7	39%	0.388	34%	0.335	S	S	.	.	H	α-helix	trans	-70.4	-37.4	178.2	-168.6	56	-144.7	0	0	111.8	R669 Q675 R676 A677 R680	R669-E673 WeakPolarHBondContact O-CB 3.35Å; R669-E673 PolarHBondContact O-N 2.93Å; E673-Q675 VanDerWaalsContact C-N 3.32Å; E673-Q675 PolarHBondContact O-N 3.5Å; E673-R676 PolarHBondContact O-N 2.98Å; E673-R676 IonicContact OE2-CZ 3.89Å; E673-R676 IonicContact OE2-NH1 2.99Å; E673-R676 PolarHBondContact OE2-NH1 3.4Å; E673-A677 WeakPolarHBondContact O-CB 3.39Å; E673-A677 PolarHBondContact O-N 2.9Å; E673-R680 IonicContact OE1-NH2 3.55Å; E673-R680 PolarHBondContact OE1-NH2 2.91Å
674	R	93.1	Very high	92.5	Very high	138 Å²	138	73.8 Å²	73.8	52%	0.521	35%	0.351	S	S	.	.	H	α-helix	trans	-57	-48.2	170.3	177.8	-178.1	169.1	-175.3	-3.3	110.7	V670 L671 R676 A677 E678	V670-R674 WeakPolarHBondContact O-CB 3.39Å; V670-R674 PolarHBondContact O-N 2.87Å; L671-R674 PolarHBondContact O-N 3.38Å; R674-R676 PolarHBondContact O-N 3.33Å; R674-A677 PolarHBondContact O-N 3.36Å; R674-E678 WeakPolarHBondContact CG-OE1 3.5Å; R674-E678 IonicContact CZ-OE1 3.39Å; R674-E678 IonicContact NE-OE1 3.28Å; R674-E678 PolarHBondContact NE-OE1 2.97Å; R674-E678 IonicContact NH2-OE1 2.77Å; R674-E678 PolarHBondContact NH2-OE1 3.38Å; R674-E678 WeakPolarHBondContact O-CG 3.32Å; R674-E678 PolarHBondContact O-N 2.95Å
675	Q	91	Very high	92.5	Very high	13 Å²	13	77.5 Å²	77.5	6%	0.061	37%	0.373	C	S	.	.	H	α-helix	trans	-59	-45.2	177	-174.6	-171.6	23.1	0	0	112	I439 I440 H482 L671 E672 E673 A677 E678 E679	I439-Q675 HydrophobicContact CB-CG 4.38Å; I440-Q675 HydrophobicContact CG2-CG 4.24Å; H482-Q675 PolarHBondContact CE1-NE2 3.02Å; H482-Q675 PolarHBondContact ND1-NE2 3.47Å; L671-Q675 PolarHBondContact O-N 2.7Å; E672-Q675 WeakPolarHBondContact O-CB 3.31Å; E672-Q675 PolarHBondContact O-N 2.99Å; E673-Q675 VanDerWaalsContact C-N 3.32Å; E673-Q675 PolarHBondContact O-N 3.5Å; Q675-A677 VanDerWaalsContact C-N 3.3Å; Q675-A677 PolarHBondContact O-N 3.48Å; Q675-E678 PolarHBondContact O-N 3.42Å; Q675-E679 WeakPolarHBondContact O-CB 3.39Å; Q675-E679 PolarHBondContact O-N 3.42Å
676	R	91.4	Very high	92.4	Very high	100 Å²	100	83.2 Å²	83.2	38%	0.377	40%	0.396	S	S	.	.	H	α-helix	trans	-63.1	-35.7	177.3	-70.6	178.1	-156.5	115.2	9.2	112.3	E672 E673 R674 R680	E672-R676 WeakPolarHBondContact O-CG 3.47Å; E672-R676 PolarHBondContact O-N 3.33Å; E672-R676 IonicContact OE2-NH2 2.67Å; E672-R676 PolarHBondContact OE2-NH2 2.97Å; E673-R676 PolarHBondContact O-N 2.98Å; E673-R676 IonicContact OE2-CZ 3.89Å; E673-R676 IonicContact OE2-NH1 2.99Å; E673-R676 PolarHBondContact OE2-NH1 3.4Å; R674-R676 PolarHBondContact O-N 3.33Å; R676-R680 WeakPolarHBondContact O-CG 3.47Å; R676-R680 PolarHBondContact O-N 3.37Å; R676-R680 PolarHBondContact O-NE 3.33Å
677	A	92.9	Very high	92	Very high	43 Å²	43	83.1 Å²	83.1	36%	0.355	40%	0.401	S	S	.	.	H	α-helix	trans	-68.3	-46	175.4	0	0	0	0	0	111.4	E673 R674 Q675 E679 R680 Q681	E673-A677 WeakPolarHBondContact O-CB 3.39Å; E673-A677 PolarHBondContact O-N 2.9Å; R674-A677 PolarHBondContact O-N 3.36Å; Q675-A677 VanDerWaalsContact C-N 3.3Å; Q675-A677 PolarHBondContact O-N 3.48Å; A677-E679 VanDerWaalsContact C-N 3.31Å; A677-E679 PolarHBondContact O-N 3.09Å; A677-R680 PolarHBondContact O-N 3.45Å; A677-Q681 PolarHBondContact O-N 2.91Å
678	E	90.8	Very high	91.5	Very high	60 Å²	60	85.1 Å²	85.1	28%	0.28	42%	0.419	S	S	.	.	H	α-helix	trans	-64.6	-33.7	176.8	-70.4	173.6	-177.1	0	0	112.4	R674 Q675 R682	R674-E678 WeakPolarHBondContact CG-OE1 3.5Å; R674-E678 IonicContact CZ-OE1 3.39Å; R674-E678 IonicContact NE-OE1 3.28Å; R674-E678 PolarHBondContact NE-OE1 2.97Å; R674-E678 IonicContact NH2-OE1 2.77Å; R674-E678 PolarHBondContact NH2-OE1 3.38Å; R674-E678 WeakPolarHBondContact O-CG 3.32Å; R674-E678 PolarHBondContact O-N 2.95Å; Q675-E678 PolarHBondContact O-N 3.42Å; E678-R682 WeakPolarHBondContact O-CB 3.39Å; E678-R682 WeakPolarHBondContact O-CG 3.37Å; E678-R682 PolarHBondContact O-N 2.9Å; E678-R682 PolarHBondContact O-NE 3.45Å; E678-R682 VanDerWaalsContact O-NE 3.12Å
679	E	89.6	Confident	91.2	Very high	62 Å²	62	87.5 Å²	87.5	29%	0.29	43%	0.427	S	S	.	.	H	α-helix	trans	-67.5	-46	172	-175.9	173.9	-159	0	0	112.3	H482 H483 Q675 A677 Q681 R682 A683	H482-E679 IonicContact CD2-OE2 3.44Å; H483-E679 IonicContact CD2-OE1 3.04Å; H483-E679 PolarHBondContact CD2-OE1 3.18Å; H483-E679 IonicContact NE2-OE1 3.61Å; Q675-E679 WeakPolarHBondContact O-CB 3.39Å; Q675-E679 PolarHBondContact O-N 3.42Å; A677-E679 VanDerWaalsContact C-N 3.31Å; A677-E679 PolarHBondContact O-N 3.09Å; E679-Q681 VanDerWaalsContact C-N 3.32Å; E679-Q681 PolarHBondContact O-N 3.26Å; E679-R682 PolarHBondContact O-N 3.43Å; E679-A683 WeakPolarHBondContact O-CB 3.48Å; E679-A683 PolarHBondContact O-N 3.45Å
680	R	91.1	Very high	91	Very high	138 Å²	138	91.2 Å²	91.2	52%	0.521	44%	0.441	S	S	.	.	H	α-helix	trans	-57.7	-46	174.8	-78.1	-177.3	-74.7	158.2	-10.4	111.5	E673 R676 A677 R682 A683 E684	E673-R680 IonicContact OE1-NH2 3.55Å; E673-R680 PolarHBondContact OE1-NH2 2.91Å; R676-R680 WeakPolarHBondContact O-CG 3.47Å; R676-R680 PolarHBondContact O-N 3.37Å; R676-R680 PolarHBondContact O-NE 3.33Å; A677-R680 PolarHBondContact O-N 3.45Å; R680-R682 PolarHBondContact O-N 2.98Å; R680-A683 PolarHBondContact O-N 2.8Å; R680-E684 WeakPolarHBondContact O-CB 3.48Å; R680-E684 VanDerWaalsContact O-CG 3.31Å; R680-E684 WeakPolarHBondContact O-CG 3.31Å; R680-E684 PolarHBondContact O-N 2.87Å
681	Q	91.7	Very high	90.9	Very high	123 Å²	123	88.8 Å²	88.8	58%	0.575	43%	0.426	S	S	*	.	H	α-helix	trans	-60.8	-43.1	177.1	-173.6	-179	3.9	0	0	112	A677 E679 E684 T685	A677-Q681 PolarHBondContact O-N 2.91Å; E679-Q681 VanDerWaalsContact C-N 3.32Å; E679-Q681 PolarHBondContact O-N 3.26Å; Q681-E684 PolarHBondContact O-N 3.36Å; Q681-T685 WeakPolarHBondContact O-CB 3.32Å; Q681-T685 WeakPolarHBondContact O-CG2 3.31Å; Q681-T685 PolarHBondContact O-N 3.48Å; Q681-T685 PolarHBondContact O-OG1 3.4Å
682	R	91.3	Very high	90.8	Very high	49 Å²	49	90.1 Å²	90.1	19%	0.185	43%	0.429	C	S	.	.	H	α-helix	trans	-64.3	-38.4	176.1	-80.2	179.2	-68	158.2	-1	112.8	E678 E679 R680 T685 E686 T687	E678-R682 WeakPolarHBondContact O-CB 3.39Å; E678-R682 WeakPolarHBondContact O-CG 3.37Å; E678-R682 PolarHBondContact O-N 2.9Å; E678-R682 PolarHBondContact O-NE 3.45Å; E678-R682 VanDerWaalsContact O-NE 3.12Å; E679-R682 PolarHBondContact O-N 3.43Å; R680-R682 PolarHBondContact O-N 2.98Å; R682-T685 WeakPolarHBondContact CA-OG1 3.43Å; R682-T685 PolarHBondContact O-OG1 3.15Å; R682-E686 WeakPolarHBondContact O-CA 3.19Å; R682-E686 PolarHBondContact O-N 2.99Å; R682-T687 WeakPolarHBondContact CB-O 3.32Å; R682-T687 PolarHBondContact O-N 3.28Å
683	A	89.6	Confident	91	Very high	75 Å²	75	88.5 Å²	88.5	62%	0.62	42%	0.422	S	S	*	.	H	α-helix	trans	-66.5	-43.2	175.4	0	0	0	0	0	111.8	E679 R680 T685 E686	E679-A683 WeakPolarHBondContact O-CB 3.48Å; E679-A683 PolarHBondContact O-N 3.45Å; R680-A683 PolarHBondContact O-N 2.8Å; A683-T685 VanDerWaalsContact C-N 3.32Å; A683-T685 PolarHBondContact O-N 2.9Å; A683-E686 PolarHBondContact O-N 3.47Å
684	E	93.3	Very high	91.1	Very high	158 Å²	158	84.6 Å²	84.6	74%	0.738	40%	0.403	S	S	*	.	H	α-helix	trans	-65.8	-33.5	177.1	-73.2	169.8	-168.8	0	0	112.8	R680 Q681	R680-E684 WeakPolarHBondContact O-CB 3.48Å; R680-E684 VanDerWaalsContact O-CG 3.31Å; R680-E684 WeakPolarHBondContact O-CG 3.31Å; R680-E684 PolarHBondContact O-N 2.87Å; Q681-E684 PolarHBondContact O-N 3.36Å
685	T	92.8	Very high	91.2	Very high	77 Å²	77	81.7 Å²	81.7	47%	0.472	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	3.6	-180	56.4	0	0	0	0	113.6	Q681 R682 A683 T687	Q681-T685 WeakPolarHBondContact O-CB 3.32Å; Q681-T685 WeakPolarHBondContact O-CG2 3.31Å; Q681-T685 PolarHBondContact O-N 3.48Å; Q681-T685 PolarHBondContact O-OG1 3.4Å; R682-T685 WeakPolarHBondContact CA-OG1 3.43Å; R682-T685 PolarHBondContact O-OG1 3.15Å; A683-T685 VanDerWaalsContact C-N 3.32Å; A683-T685 PolarHBondContact O-N 2.9Å; T685-T687 PolarHBondContact O-N 2.88Å; T685-T687 PolarHBondContact O-OG1 3.46Å; T685-T687 VanDerWaalsContact O-OG1 3.05Å; T685-T687 PolarHBondContact OG1-OG1 3.24Å
686	E	90.1	Very high	91.2	Very high	179 Å²	179	89.1 Å²	89.1	84%	0.836	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	29.1	-174.8	-60.2	-175.4	168.7	0	0	113.8	R682 A683 P688	R682-E686 WeakPolarHBondContact O-CA 3.19Å; R682-E686 PolarHBondContact O-N 2.99Å; A683-E686 PolarHBondContact O-N 3.47Å; E686-P688 WeakPolarHBondContact O-CD 3.39Å
687	T	87.1	Confident	91	Very high	78 Å²	78	88.8 Å²	88.8	48%	0.479	43%	0.429	S	S	.	.			trans	-95.1	111.7	-175.1	-56.2	0	0	0	0	109.3	R682 T685	R682-T687 WeakPolarHBondContact CB-O 3.32Å; R682-T687 PolarHBondContact O-N 3.28Å; T685-T687 PolarHBondContact O-N 2.88Å; T685-T687 PolarHBondContact O-OG1 3.46Å; T685-T687 VanDerWaalsContact O-OG1 3.05Å; T685-T687 PolarHBondContact OG1-OG1 3.24Å
688	P	85.1	Confident	90.7	Very high	96 Å²	96	89.8 Å²	89.8	62%	0.623	44%	0.443	S	S	*	.			trans	-67.9	149.1	-179.6	28.3	-34.5	0	0	0	111.1	E686 R690	E686-P688 WeakPolarHBondContact O-CD 3.39Å; P688-R690 PolarHBondContact O-N 2.89Å
689	W	88.4	Confident	90.2	Very high	78 Å²	78	95.2 Å²	95.2	30%	0.295	47%	0.468	S	S	.	.			trans	-64.6	132.3	167.8	-171	-102.2	0	0	0	109.8	I440	I440-W689 HydrophobicContact CD1-CG 4.05Å; I440-W689 HydrophobicContact CG1-CB 4.39Å; I440-W689 HydrophobicContact CG1-CD2 3.69Å; I440-W689 HydrophobicContact CG1-CE3 4.36Å; I440-W689 HydrophobicContact CG1-CG 3.66Å
690	R	89.1	Confident	90.2	Very high	218 Å²	218	92.9 Å²	92.9	82%	0.823	46%	0.461	S	S	*	.			trans	-104.5	119.7	169.5	-69	-173.4	-178.7	-132.5	2.1	108.6	P688	P688-R690 PolarHBondContact O-N 2.89Å
691	T	93.1	Very high	90.3	Very high	31 Å²	31	88.4 Å²	88.4	19%	0.19	44%	0.444	C	S	.	.			trans	-69.2	154.1	172.2	41.7	0	0	0	0	110.8	E478 V480 F694 W701	E478-T691 WeakPolarHBondContact OE1-CA 3.42Å; E478-T691 WeakPolarHBondContact OE1-CB 3.25Å; V480-T691 HydrophobicContact CB-CG2 3.8Å; V480-T691 HydrophobicContact CG1-CG2 3.9Å; T691-F694 WeakPolarHBondContact CB-O 3.42Å; T691-F694 PolarHBondContact OG1-O 3.14Å; T691-W701 HydrophobicContact CG2-CH2 4.07Å; T691-W701 HydrophobicContact CG2-CZ3 3.71Å
692	R	92.6	Very high	90.4	Very high	58 Å²	58	82.6 Å²	82.6	22%	0.219	42%	0.417	C	S	.	.	S	Bend	trans	-95.8	-35.1	-175.1	-159.5	-173.8	-57.6	160.8	5.1	112.7	E478 T643	E478-R692 PolarHBondContact OE1-N 3.01Å; E478-R692 PolarHBondContact OE2-N 3.4Å; E478-R692 VanDerWaalsContact OE2-N 3.16Å; T643-R692 PolarHBondContact OG1-NH2 2.98Å
693	Y	93.9	Very high	90.6	Very high	2 Å²	2	80.3 Å²	80.3	1%	0.008	41%	0.408	C	S	.	.	S	Bend	trans	-123	-15.7	-170.2	-64.6	-71	0	0	0	114.4	Q327 T443 H445 V476 E478 Y703 S704	Q327-Y693 HydrophobicContact CB-CE1 4.46Å; Q327-Y693 HydrophobicContact CG-CD1 3.57Å; Q327-Y693 HydrophobicContact CG-CE1 3.31Å; T443-Y693 HydrophobicContact CG2-CD2 4Å; T443-Y693 HydrophobicContact CG2-CE2 3.75Å; H445-Y693 AromaticContact CE1-CE1 3.83Å; H445-Y693 AromaticContact CE1-CE2 3.58Å; H445-Y693 AromaticContact CE1-CZ 3.31Å; H445-Y693 PolarHBondContact CE1-OH 3.22Å; H445-Y693 VanDerWaalsContact CE1-OH 3.3Å; H445-Y693 AromaticContact NE2-CE2 3.34Å; H445-Y693 VanDerWaalsContact NE2-CE2 3.34Å; H445-Y693 WeakPolarHBondContact NE2-CE2 3.43Å; H445-Y693 AromaticContact NE2-CZ 3.38Å; H445-Y693 PolarHBondContact NE2-OH 2.6Å; V476-Y693 HydrophobicContact CG1-CD1 4.15Å; V476-Y693 HydrophobicContact CG1-CD2 4.02Å; V476-Y693 HydrophobicContact CG1-CE2 4.46Å; V476-Y693 HydrophobicContact CG1-CG 3.86Å; E478-Y693 PolarHBondContact OE2-N 3.04Å; Y693-Y703 HydrophobicContact CD1-CE2 4.17Å; Y693-Y703 HydrophobicContact CG-CE2 4.38Å; Y693-Y703 CarbonylContact O-C 3.59Å; Y693-Y703 WeakPolarHBondContact O-CA 3.37Å; Y693-Y703 WeakPolarHBondContact O-CD2 3.48Å; Y693-S704 PolarHBondContact O-N 3.35Å; Y693-S704 PolarHBondContact O-OG 3.49Å
694	F	95.3	Very high	90.7	Very high	0 Å²	0	78.4 Å²	78.4	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	139.7	-176.2	-66.5	-97.7	0	0	0	111.3	E478 V480 T691 W701 A702 Y703	E478-F694 HydrophobicContact CB-CD2 3.72Å; E478-F694 HydrophobicContact CB-CE2 3.85Å; V480-F694 HydrophobicContact CG1-CB 3.72Å; V480-F694 HydrophobicContact CG1-CD2 4.06Å; V480-F694 HydrophobicContact CG1-CG 4.03Å; T691-F694 WeakPolarHBondContact CB-O 3.42Å; T691-F694 PolarHBondContact OG1-O 3.14Å; F694-W701 HydrophobicContact CB-CE3 4.16Å; F694-A702 CarbonylContact C-O 3.59Å; F694-A702 WeakPolarHBondContact CA-O 3.34Å; F694-Y703 HydrophobicContact CE1-CD2 4.28Å; F694-Y703 HydrophobicContact CE2-CD2 4.3Å; F694-Y703 HydrophobicContact CZ-CD2 4.09Å
695	D	94.3	Very high	90.6	Very high	78 Å²	78	76.4 Å²	76.4	42%	0.417	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	149.2	170.8	-65.7	-57.6	0	0	0	110.3	E697 W701 A702 S704	D695-E697 PolarHBondContact O-N 2.93Å; D695-W701 WeakPolarHBondContact O-CA 3.4Å; D695-A702 PolarHBondContact N-O 3.01Å; D695-A702 PolarHBondContact O-N 2.95Å; D695-S704 VanDerWaalsContact OD2-CA 3.29Å; D695-S704 WeakPolarHBondContact OD2-CA 3.47Å; D695-S704 WeakPolarHBondContact OD2-CB 3.28Å; D695-S704 PolarHBondContact OD2-OG 3.5Å
696	R	91.4	Very high	90.4	Very high	169 Å²	169	72.8 Å²	72.8	64%	0.638	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.2	119.9	174.1	-172.8	176.4	176.1	176.1	2.3	109.5	G698 W701	R696-G698 PolarHBondContact NE-O 3.14Å; R696-W701 HydrophobicContact CB-CD2 4.48Å; R696-W701 HydrophobicContact CB-CE3 4.18Å; R696-W701 HydrophobicContact CB-CH2 4.24Å; R696-W701 HydrophobicContact CB-CZ2 4.5Å; R696-W701 HydrophobicContact CB-CZ3 4.06Å
697	E	88.1	Confident	90.3	Very high	93 Å²	93	65.5 Å²	65.5	44%	0.435	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	102	176.1	-71.4	-168.8	173.8	0	0	109.3	D695 E699 G700 A702 K709	D695-E697 PolarHBondContact O-N 2.93Å; E697-E699 PolarHBondContact O-N 3.1Å; E697-G700 PolarHBondContact N-O 3.42Å; E697-G700 CarbonylContact O-C 3.45Å; E697-G700 PolarHBondContact O-N 3.38Å; E697-A702 HydrophobicContact CB-CB 4.35Å; E697-A702 VanDerWaalsContact CD-CB 3.42Å; E697-A702 HydrophobicContact CG-CB 3.89Å; E697-A702 WeakPolarHBondContact OE2-CB 3.46Å; E697-K709 IonicContact OE1-NZ 3.69Å; E697-K709 PolarHBondContact OE1-NZ 2.99Å
698	G	86	Confident	90	Very high	63 Å²	63	64.4 Å²	64.4	65%	0.649	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	-121.9	-173.7	0	0	0	0	0	112.4	R696	R696-G698 PolarHBondContact NE-O 3.14Å
699	E	80.7	Confident	89.8	Confident	175 Å²	175	64.3 Å²	64.3	82%	0.818	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-6.5	174.8	-63.5	-61.6	153.3	0	0	113	E697	E697-E699 PolarHBondContact O-N 3.1Å
700	G	88.9	Confident	88.6	Confident	13 Å²	13	64.5 Å²	64.5	13%	0.134	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	-171.4	-177.8	0	0	0	0	0	113.7	E697	E697-G700 PolarHBondContact N-O 3.42Å; E697-G700 CarbonylContact O-C 3.45Å; E697-G700 PolarHBondContact O-N 3.38Å
701	W	93.8	Very high	86.8	Confident	43 Å²	43	56.4 Å²	56.4	16%	0.163	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	140.9	176.2	-66.4	84.3	0	0	0	109.9	V480 N501 H503 T691 F694 D695 R696	V480-W701 HydrophobicContact CB-CD2 3.77Å; V480-W701 HydrophobicContact CB-CE3 3.77Å; V480-W701 HydrophobicContact CB-CG 4.4Å; V480-W701 HydrophobicContact CB-CH2 4.02Å; V480-W701 HydrophobicContact CB-CZ2 4.04Å; V480-W701 HydrophobicContact CB-CZ3 3.9Å; V480-W701 HydrophobicContact CG1-CD2 4.31Å; V480-W701 HydrophobicContact CG1-CE3 4.06Å; V480-W701 HydrophobicContact CG1-CZ3 4.41Å; V480-W701 HydrophobicContact CG2-CD2 3.53Å; V480-W701 HydrophobicContact CG2-CE3 4.08Å; V480-W701 HydrophobicContact CG2-CG 3.72Å; V480-W701 HydrophobicContact CG2-CZ2 4.05Å; N501-W701 PolarHBondContact OD1-O 3.35Å; H503-W701 HydrophobicContact CB-CB 4.07Å; T691-W701 HydrophobicContact CG2-CH2 4.07Å; T691-W701 HydrophobicContact CG2-CZ3 3.71Å; F694-W701 HydrophobicContact CB-CE3 4.16Å; D695-W701 WeakPolarHBondContact O-CA 3.4Å; R696-W701 HydrophobicContact CB-CD2 4.48Å; R696-W701 HydrophobicContact CB-CE3 4.18Å; R696-W701 HydrophobicContact CB-CH2 4.24Å; R696-W701 HydrophobicContact CB-CZ2 4.5Å; R696-W701 HydrophobicContact CB-CZ3 4.06Å
702	A	93.9	Very high	84.2	Confident	2 Å²	2	63.9 Å²	63.9	2%	0.017	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	145.9	177.4	0	0	0	0	0	111.9	N501 F694 D695 E697 S704	N501-A702 WeakPolarHBondContact ND2-CA 3.34Å; N501-A702 WeakPolarHBondContact ND2-CB 3.47Å; F694-A702 CarbonylContact C-O 3.59Å; F694-A702 WeakPolarHBondContact CA-O 3.34Å; D695-A702 PolarHBondContact N-O 3.01Å; D695-A702 PolarHBondContact O-N 2.95Å; E697-A702 HydrophobicContact CB-CB 4.35Å; E697-A702 VanDerWaalsContact CD-CB 3.42Å; E697-A702 HydrophobicContact CG-CB 3.89Å; E697-A702 WeakPolarHBondContact OE2-CB 3.46Å; A702-S704 PolarHBondContact O-N 2.94Å
703	Y	95.1	Very high	81.5	Confident	1 Å²	1	64.8 Å²	64.8	0%	0.004	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	135.9	175.4	-169.5	-114	0	0	0	110.1	Q327 R474 V476 Y490 Y693 F694 K705 P706	Q327-Y703 PolarHBondContact NE2-OH 3.25Å; R474-Y703 PolarHBondContact NH1-OH 3.26Å; R474-Y703 VanDerWaalsContact NH1-OH 3.08Å; R474-Y703 PolarHBondContact NH2-OH 2.9Å; V476-Y703 HydrophobicContact CB-CE2 4.18Å; V476-Y703 HydrophobicContact CG1-CE2 4.07Å; V476-Y703 HydrophobicContact CG2-CE2 4.39Å; Y490-Y703 AromaticContact CD1-CD1 3.63Å; Y490-Y703 HydrophobicContact CD1-CD1 3.63Å; Y490-Y703 AromaticContact CD1-CD2 3.97Å; Y490-Y703 HydrophobicContact CD1-CD2 3.97Å; Y490-Y703 AromaticContact CD1-CE1 3.82Å; Y490-Y703 HydrophobicContact CD1-CE1 3.82Å; Y490-Y703 HydrophobicContact CD1-CE2 4.12Å; Y490-Y703 AromaticContact CD1-CG 3.71Å; Y490-Y703 HydrophobicContact CD1-CG 3.71Å; Y490-Y703 VanDerWaalsContact CD2-CB 3.42Å; Y490-Y703 HydrophobicContact CD2-CD1 4.07Å; Y490-Y703 AromaticContact CD2-CG 3.79Å; Y490-Y703 HydrophobicContact CD2-CG 3.79Å; Y490-Y703 AromaticContact CE1-CD1 3.58Å; Y490-Y703 HydrophobicContact CE1-CD1 3.58Å; Y490-Y703 AromaticContact CE1-CE1 3.71Å; Y490-Y703 HydrophobicContact CE1-CE1 3.71Å; Y490-Y703 HydrophobicContact CE1-CG 4.12Å; Y490-Y703 HydrophobicContact CE2-CD1 4.02Å; Y490-Y703 HydrophobicContact CE2-CG 4.19Å; Y490-Y703 AromaticContact CG-CD1 3.87Å; Y490-Y703 HydrophobicContact CG-CD1 3.87Å; Y490-Y703 AromaticContact CG-CD2 3.85Å; Y490-Y703 HydrophobicContact CG-CD2 3.85Å; Y490-Y703 HydrophobicContact CG-CE1 4.48Å; Y490-Y703 HydrophobicContact CG-CE2 4.44Å; Y490-Y703 AromaticContact CG-CG 3.52Å; Y490-Y703 HydrophobicContact CG-CG 3.52Å; Y490-Y703 AromaticContact CZ-CD1 3.79Å; Y693-Y703 HydrophobicContact CD1-CE2 4.17Å; Y693-Y703 HydrophobicContact CG-CE2 4.38Å; Y693-Y703 CarbonylContact O-C 3.59Å; Y693-Y703 WeakPolarHBondContact O-CA 3.37Å; Y693-Y703 WeakPolarHBondContact O-CD2 3.48Å; F694-Y703 HydrophobicContact CE1-CD2 4.28Å; F694-Y703 HydrophobicContact CE2-CD2 4.3Å; F694-Y703 HydrophobicContact CZ-CD2 4.09Å; Y703-K705 VanDerWaalsContact CD1-C 3.42Å; Y703-K705 WeakPolarHBondContact CD1-O 3.4Å; Y703-K705 HydrophobicContact CE1-CB 4.26Å; Y703-K705 VanDerWaalsContact CE1-O 3.22Å; Y703-K705 WeakPolarHBondContact CE1-O 3.46Å; Y703-K705 PolarHBondContact O-N 3.17Å; Y703-P706 HydrophobicContact CD1-CB 4.4Å; Y703-P706 VanDerWaalsContact O-CD 3.23Å; Y703-P706 WeakPolarHBondContact O-CD 3.45Å
704	S	92.1	Very high	78.7	Confident	35 Å²	35	73.2 Å²	73.2	25%	0.245	36%	0.363	C	S	.	.	S	Bend	trans	-67.7	-34.1	-171.8	-63.5	0	0	0	0	113.2	Y693 D695 A702 P706	Y693-S704 PolarHBondContact O-N 3.35Å; Y693-S704 PolarHBondContact O-OG 3.49Å; D695-S704 VanDerWaalsContact OD2-CA 3.29Å; D695-S704 WeakPolarHBondContact OD2-CA 3.47Å; D695-S704 WeakPolarHBondContact OD2-CB 3.28Å; D695-S704 PolarHBondContact OD2-OG 3.5Å; A702-S704 PolarHBondContact O-N 2.94Å; S704-P706 VanDerWaalsContact C-CD 3.44Å; S704-P706 WeakPolarHBondContact O-CD 3.43Å
705	K	90.2	Very high	75.9	Confident	116 Å²	116	79.4 Å²	79.4	50%	0.504	40%	0.4	S	S	.	.	S	Bend	trans	-123	62.7	179.4	-61.4	-171.3	-167.9	153.1	0	111.7	Y703	Y703-K705 VanDerWaalsContact CD1-C 3.42Å; Y703-K705 WeakPolarHBondContact CD1-O 3.4Å; Y703-K705 HydrophobicContact CE1-CB 4.26Å; Y703-K705 VanDerWaalsContact CE1-O 3.22Å; Y703-K705 WeakPolarHBondContact CE1-O 3.46Å; Y703-K705 PolarHBondContact O-N 3.17Å
706	P	88.8	Confident	72.8	Confident	0 Å²	0	80.2 Å²	80.2	0%	0	41%	0.412	C	S	.	.			trans	-76.9	153.2	-174.8	34.7	-32.1	0	0	0	111.2	Y490 Y703 S704 W708 K709 N710	Y490-P706 HydrophobicContact CE2-CB 4.05Å; Y703-P706 HydrophobicContact CD1-CB 4.4Å; Y703-P706 VanDerWaalsContact O-CD 3.23Å; Y703-P706 WeakPolarHBondContact O-CD 3.45Å; S704-P706 VanDerWaalsContact C-CD 3.44Å; S704-P706 WeakPolarHBondContact O-CD 3.43Å; P706-W708 HydrophobicContact CB-CD2 3.6Å; P706-W708 VanDerWaalsContact CB-CE2 3.47Å; P706-W708 HydrophobicContact CB-CE3 3.6Å; P706-W708 HydrophobicContact CB-CG 4.45Å; P706-W708 HydrophobicContact CB-CH2 3.27Å; P706-W708 HydrophobicContact CB-CZ2 3.31Å; P706-W708 HydrophobicContact CB-CZ3 3.45Å; P706-W708 VanDerWaalsContact CB-CZ3 3.45Å; P706-W708 HydrophobicContact CG-CD2 3.88Å; P706-W708 HydrophobicContact CG-CE3 4.39Å; P706-W708 HydrophobicContact CG-CG 4.43Å; P706-W708 HydrophobicContact CG-CH2 3.97Å; P706-W708 HydrophobicContact CG-CZ2 3.44Å; P706-W708 VanDerWaalsContact CG-CZ2 3.44Å; P706-W708 HydrophobicContact CG-CZ3 4.44Å; P706-W708 PolarHBondContact O-N 2.93Å; P706-K709 HydrophobicContact CG-CB 3.95Å; P706-K709 HydrophobicContact CG-CD 3.61Å; P706-K709 HydrophobicContact CG-CG 3.66Å; P706-K709 PolarHBondContact O-N 3.47Å; P706-N710 PolarHBondContact O-N 2.97Å
707	L	88.7	Confident	69.9	Low	26 Å²	26	77.7 Å²	77.7	14%	0.136	42%	0.419	C	S	.	.	H	α-helix	trans	-56.4	-37.8	-176	-169.2	65.5	0	0	0	112.2	Y490 P494 C499 L528 K709 N710 S711	Y490-L707 PolarHBondContact OH-N 3.27Å; P494-L707 HydrophobicContact CB-CD1 4.15Å; P494-L707 HydrophobicContact CG-CD1 4.37Å; C499-L707 HydrophobicContact CB-CB 4.25Å; L528-L707 HydrophobicContact CD1-CB 4.23Å; L528-L707 HydrophobicContact CD1-CD2 3.87Å; L528-L707 HydrophobicContact CD1-CG 3.74Å; L707-K709 VanDerWaalsContact C-N 3.29Å; L707-K709 PolarHBondContact O-N 2.74Å; L707-N710 PolarHBondContact O-N 3.16Å; L707-S711 PolarHBondContact O-N 3.04Å
708	W	80.9	Confident	67.2	Low	55 Å²	55	84.4 Å²	84.4	21%	0.208	46%	0.457	C	S	.	.	H	α-helix	trans	-68.4	-20.7	179	66.4	89.2	0	0	0	114.7	Y490 C499 N501 H526 L528 P706 S711	Y490-W708 HydrophobicContact CE2-CH2 4.17Å; Y490-W708 AromaticContact CE2-CZ3 3.82Å; Y490-W708 HydrophobicContact CE2-CZ3 3.82Å; C499-W708 VanDerWaalsContact SG-CZ3 3.53Å; N501-W708 HydrophobicContact CB-CH2 3.79Å; N501-W708 HydrophobicContact CB-CZ3 4.29Å; H526-W708 HydrophobicContact CB-CE3 4.43Å; H526-W708 AromaticContact CE1-CE3 3.83Å; H526-W708 AromaticContact CE1-CZ3 3.75Å; H526-W708 AromaticContact CG-CE3 3.89Å; H526-W708 AromaticContact ND1-CE3 3.66Å; H526-W708 AromaticContact ND1-CZ3 3.63Å; L528-W708 HydrophobicContact CD1-CB 4.45Å; L528-W708 HydrophobicContact CD2-CB 3.54Å; P706-W708 HydrophobicContact CB-CD2 3.6Å; P706-W708 VanDerWaalsContact CB-CE2 3.47Å; P706-W708 HydrophobicContact CB-CE3 3.6Å; P706-W708 HydrophobicContact CB-CG 4.45Å; P706-W708 HydrophobicContact CB-CH2 3.27Å; P706-W708 HydrophobicContact CB-CZ2 3.31Å; P706-W708 HydrophobicContact CB-CZ3 3.45Å; P706-W708 VanDerWaalsContact CB-CZ3 3.45Å; P706-W708 HydrophobicContact CG-CD2 3.88Å; P706-W708 HydrophobicContact CG-CE3 4.39Å; P706-W708 HydrophobicContact CG-CG 4.43Å; P706-W708 HydrophobicContact CG-CH2 3.97Å; P706-W708 HydrophobicContact CG-CZ2 3.44Å; P706-W708 VanDerWaalsContact CG-CZ2 3.44Å; P706-W708 HydrophobicContact CG-CZ3 4.44Å; P706-W708 PolarHBondContact O-N 2.93Å; W708-S711 PolarHBondContact O-OG 2.88Å; W708-S711 VanDerWaalsContact O-OG 3.14Å
709	K	80.2	Confident	66.3	Low	95 Å²	95	85.5 Å²	85.5	41%	0.413	45%	0.447	S	S	.	.	H	α-helix	trans	-85	-24.4	175.2	-72.1	-178.4	-170.3	169.2	0	111.8	E697 P706 L707	E697-K709 IonicContact OE1-NZ 3.69Å; E697-K709 PolarHBondContact OE1-NZ 2.99Å; P706-K709 HydrophobicContact CG-CB 3.95Å; P706-K709 HydrophobicContact CG-CD 3.61Å; P706-K709 HydrophobicContact CG-CG 3.66Å; P706-K709 PolarHBondContact O-N 3.47Å; L707-K709 VanDerWaalsContact C-N 3.29Å; L707-K709 PolarHBondContact O-N 2.74Å
710	N	63.8	Low	65.6	Low	81 Å²	81	80.8 Å²	80.8	43%	0.433	43%	0.428	S	S	.	.	H	α-helix	trans	-91	-9.5	-178.7	-73.5	-11	0	0	0	114.3	P706 L707 K712 S713	P706-N710 PolarHBondContact O-N 2.97Å; L707-N710 PolarHBondContact O-N 3.16Å; N710-K712 VanDerWaalsContact C-N 3.26Å; N710-K712 PolarHBondContact O-N 3.45Å; N710-S713 PolarHBondContact O-N 2.88Å; N710-S713 PolarHBondContact O-OG 3.03Å
711	S	50.7	Low	64.3	Low	49 Å²	49	84.6 Å²	84.6	34%	0.343	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-67.9	-18.1	-177.2	57.6	0	0	0	0	114.7	L707 W708 S713 Y714	L707-S711 PolarHBondContact O-N 3.04Å; W708-S711 PolarHBondContact O-OG 2.88Å; W708-S711 VanDerWaalsContact O-OG 3.14Å; S711-S713 PolarHBondContact O-N 2.88Å; S711-Y714 PolarHBondContact O-N 3.47Å
712	K	39.7	Very low	62.5	Low	187 Å²	187	87 Å²	87	81%	0.813	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-69.1	-13.9	173.8	-71.7	-173.4	179.2	178.8	0	114	N710	N710-K712 VanDerWaalsContact C-N 3.26Å; N710-K712 PolarHBondContact O-N 3.45Å
713	S	34.4	Very low	60.6	Low	78 Å²	78	92.3 Å²	92.3	55%	0.545	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-91.2	-15.8	-180	-44.3	0	0	0	0	113.6	N710 S711 S716	N710-S713 PolarHBondContact O-N 2.88Å; N710-S713 PolarHBondContact O-OG 3.03Å; S711-S713 PolarHBondContact O-N 2.88Å; S713-S716 PolarHBondContact O-OG 2.93Å
714	Y	36	Very low	58.3	Low	178 Å²	178	98.4 Å²	98.4	70%	0.698	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-85.8	-13.3	-177.7	-86.6	-85.5	0	0	0	113.8	S711 S716	S711-Y714 PolarHBondContact O-N 3.47Å; Y714-S716 PolarHBondContact O-N 3.47Å
715	V	35.5	Very low	55.8	Low	130 Å²	130	102.9 Å²	102.9	79%	0.788	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-77.8	-6.4	176.7	-174	0	0	0	0	112.3
716	S	29.2	Very low	53.2	Low	95 Å²	95	101.9 Å²	101.9	66%	0.664	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-101.7	3	179.4	44.5	0	0	0	0	115.7	S713 Y714	S713-S716 PolarHBondContact O-OG 2.93Å; Y714-S716 PolarHBondContact O-N 3.47Å
717	C	32.2	Very low	50.2	Low	116 Å²	116	110.4 Å²	110.4	78%	0.784	59%	0.588	S	S	*	*			trans	-132.8	37.9	178.5	-80.7	0	0	0	0	113.6
718	L	31.5	Very low	46.7	Very low	235 Å²	235	118.1 Å²	118.1	100%	1.23	63%	0.629	S	S	*	*			trans	-127.4	0	158.1	-83.1	170.8	0	0	0	109.9

Retrieved 718 of 718 residues in 670.5 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).