A0A087YH04_POEFO Loading...

Phosphofurin acidic cluster sorting protein 2

AlphaFold DB , UniProt , Accession A0A087YH04, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 891 aa.

						>A0A087YH04_POEFO|A0A087YH04
MAERSGRLSFPGSGALNRPVPMNLFATWEIDGSSPNCIPRLCSLTLKKLVVLKELDKELISVVIAVKIQGSKRILRSHEIVLPPSGSVETDLALTFSLQYPHFLKREGNKLQIMLQRRKRYKNRTILGYKTLAMGSIDMAEVMQHPTEGGQVLPLCSNQKDMLGKVAEIWIFSLSSQPIDHEDAALQGGQKIKCSDNYSEEEYESFSSEQEASDDAVQGQDLEDDEFDVRKPKKQRRSIVRTPSITRQQNFKQRVVALLKRFRVSDEVLDSEQDPAEPPPEVEEEDLDLDSVEFENPSDSCPELDDDDSVLSTPKPKLKPYFEGLSLSSSQTEIGSIHSSRSHREPPSPLDLDKTKCGDSTFADDGGRDNATFEQPEAVTPTTELEMDNMDTFLERLPPSGKMTKTESLIISSNRQEAKLAGRRGRSTSLKERQPSRPQNERANSLDNERSLDTRCHLQIPRKTVYDQLNHILVSDNHLPDSIILINTSDWQGQYLSDLLQNHHLPVVCTCTMADIQAAFNTIVSRIQRFCNCNSQTPIPIKIAVAGAQHYLSAVLRLFVDHLSHKTPDWLGYMRFLIIPLGAHPVSKYLGTIDHRYNSLFQDAAWRDLFHKTEAPVIVQESPDVVSRVTQYMEGANGAHQLPIAEAMLTYKQKRKKSFHFDFAVSPTEDSCQKFIPFIGMVKVGIVEQTSAASGDSDDAAPLSSSLLSSTPPQVSPAFKEASPTPPPSPSINTSFCALSTSSSQAELMGLQVDYWVAPTERKKDMEKRDSSSKNTLKCNFRSLQVSRLPPGGAEPSPQPTMSMTVVTKEKNKKVMFLQKKSKDKEVESKSQVIEGISRLICAAKHQQTMLRVLIDGVEWNDVKFFQLAAQWSSHVKHFPVGIFGHTKGPY
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.6	Very low	28.8	Very low	244 Å²	244	161.5 Å²	161.5	100%	1.202	85%	0.854	S	S	*	*				0	133.7	0	-163.1	176.3	-164.8	0	0	107.3
2	A	27.7	Very low	28.5	Very low	87 Å²	87	154.3 Å²	154.3	72%	0.719	85%	0.848	S	S	*	*			trans	46.9	116.1	172.5	0	0	0	0	0	119.9
3	E	29.8	Very low	29.2	Very low	183 Å²	183	152.8 Å²	152.8	86%	0.855	86%	0.855	S	S	*	*			trans	19.6	137.9	135.6	-54.7	179.5	102.9	0	0	121.8
4	R	28.4	Very low	29.4	Very low	252 Å²	252	147.3 Å²	147.3	95%	0.951	85%	0.85	S	S	*	*				-148.1	123.5	125.4	-119.7	173.8	-172.7	-178.9	2.3	112.1
5	S	33.3	Very low	29.5	Very low	118 Å²	118	143.6 Å²	143.6	83%	0.825	84%	0.844	S	S	*	*			trans	-78.9	139.1	179.8	-174.1	0	0	0	0	112
6	G	25.3	Very low	30	Very low	70 Å²	70	145.5 Å²	145.5	72%	0.722	85%	0.848	S	S	*	*			trans	-124.1	79.4	-176.4	0	0	0	0	0	112.4	L8	G6-L8 PolarHBondContact O-N 2.71Å; G6-L8 VanDerWaalsContact O-N 3.07Å
7	R	28.9	Very low	30.7	Very low	226 Å²	226	146.4 Å²	146.4	85%	0.853	85%	0.848	S	S	*	*			trans	-73.9	92	-175.2	-171.6	-170.8	-168.3	-156.9	6.6	112.3	S9	R7-S9 PolarHBondContact O-N 2.86Å
8	L	27.4	Very low	31.9	Very low	172 Å²	172	151.4 Å²	151.4	90%	0.901	85%	0.851	S	S	*	*			trans	-80.1	91.3	168.9	-74.6	175.7	0	0	0	111	G6	G6-L8 PolarHBondContact O-N 2.71Å; G6-L8 VanDerWaalsContact O-N 3.07Å
9	S	25.9	Very low	33.4	Very low	92 Å²	92	145.7 Å²	145.7	64%	0.643	82%	0.821	S	S	*	*			trans	-77.9	132.2	169.3	50	0	0	0	0	111.5	R7 P11	R7-S9 PolarHBondContact O-N 2.86Å; S9-P11 WeakPolarHBondContact O-CD 3.37Å
10	F	30.9	Very low	34.9	Very low	206 Å²	206	144 Å²	144	90%	0.904	81%	0.814	S	S	*	*			trans	-61.3	141.3	171.7	-74.7	-92.6	0	0	0	112.8
11	P	30.3	Very low	36.9	Very low	126 Å²	126	142 Å²	142	82%	0.818	81%	0.806	S	S	*	*			trans	-124.4	144.2	138.7	36.1	-27.2	0	0	0	111.2	S9	S9-P11 WeakPolarHBondContact O-CD 3.37Å
12	G	24.7	Very low	39.5	Very low	76 Å²	76	132.9 Å²	132.9	78%	0.784	76%	0.762	S	S	*	*			trans	109.1	56	172.6	0	0	0	0	0	116.1
13	S	38.5	Very low	42.1	Very low	134 Å²	134	134.4 Å²	134.4	94%	0.937	76%	0.757	S	S	*	*			trans	-69.9	137.2	159.1	-172.3	0	0	0	0	109.4
14	G	31.1	Very low	45	Very low	76 Å²	76	127.2 Å²	127.2	78%	0.784	73%	0.725	S	S	*	*	S	Bend	trans	141.8	-4.2	168.2	0	0	0	0	0	119.4
15	A	32.1	Very low	47.7	Very low	92 Å²	92	122 Å²	122	76%	0.76	71%	0.709	S	S	*	*	S	Bend	trans	-163.1	80	173.9	0	0	0	0	0	114.9
16	L	36.2	Very low	50.1	Low	174 Å²	174	117.4 Å²	117.4	91%	0.911	68%	0.679	S	S	*	*	S	Bend	trans	178.2	52	154.5	-102.6	162.3	0	0	0	112.9
17	N	42.4	Very low	52.6	Low	160 Å²	160	117.8 Å²	117.8	86%	0.856	67%	0.667	S	S	*	*			trans	-149.3	54.3	175.3	-104	-19	0	0	0	112.1
18	R	52.1	Low	54.6	Low	238 Å²	238	111.4 Å²	111.4	90%	0.898	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-83.9	121.7	163.3	-94.7	-173.7	171.4	-178	-2.4	108.4	V20	R18-V20 PolarHBondContact O-N 3.42Å
19	P	60.3	Low	56.1	Low	43 Å²	43	108.2 Å²	108.2	28%	0.279	62%	0.623	S	S	.	*	P	Polyproline II helix	trans	-61	137.8	174.4	26	-34.7	0	0	0	110	P21 D91 A93	P19-P21 WeakPolarHBondContact O-CD 3.49Å; P19-D91 WeakPolarHBondContact CB-O 3.04Å; P19-D91 HydrophobicContact CG-CB 4.25Å; P19-D91 WeakPolarHBondContact CG-O 3.46Å; P19-A93 HydrophobicContact CB-CB 4.28Å; P19-A93 HydrophobicContact CG-CB 4Å
20	V	64.8	Low	57.5	Low	111 Å²	111	108 Å²	108	67%	0.673	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-70.1	121.5	175.6	-179.9	0	0	0	0	108.3	R18 M22	R18-V20 PolarHBondContact O-N 3.42Å; V20-M22 PolarHBondContact O-N 3.19Å
21	P	75.2	Confident	58.1	Low	101 Å²	101	105.3 Å²	105.3	66%	0.656	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-60.1	132.2	178.6	-24.5	35.5	0	0	0	111.5	P19 A93	P19-P21 WeakPolarHBondContact O-CD 3.49Å; P21-A93 WeakPolarHBondContact CA-O 3.44Å; P21-A93 HydrophobicContact CB-CB 4.2Å; P21-A93 HydrophobicContact CG-CB 4.2Å
22	M	84.1	Confident	59.2	Low	54 Å²	54	103 Å²	103	27%	0.266	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-137.3	114.7	-175.6	167.7	171	-79.1	0	0	109.9	V20 L24 H78 A93 L94 T95	V20-M22 PolarHBondContact O-N 3.19Å; M22-L24 HydrophobicContact CG-CD1 4.17Å; M22-L24 HydrophobicContact CG-CD2 4.2Å; M22-L24 HydrophobicContact CG-CG 3.93Å; M22-L24 HydrophobicContact SD-CD1 4.25Å; M22-L24 HydrophobicContact SD-CD2 4.35Å; M22-L24 HydrophobicContact SD-CG 4.43Å; M22-H78 HydrophobicContact CE-CB 4.01Å; M22-H78 HydrophobicContact SD-CB 4.39Å; M22-H78 PolarHBondContact SD-N 3.02Å; M22-H78 VanDerWaalsContact SD-N 3.42Å; M22-H78 PolarHBondContact SD-ND1 3.24Å; M22-H78 VanDerWaalsContact SD-ND1 3.37Å; M22-A93 PolarHBondContact N-O 3.11Å; M22-L94 HydrophobicContact CB-CD2 3.77Å; M22-L94 HydrophobicContact CG-CD2 4.18Å; M22-L94 WeakPolarHBondContact O-CA 3.45Å; M22-L94 HydrophobicContact SD-CD2 4.24Å; M22-T95 PolarHBondContact O-N 3.28Å
23	N	83.2	Confident	60.7	Low	118 Å²	118	102.5 Å²	102.5	63%	0.631	59%	0.593	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.6	125.4	177.3	-62.1	-15.8	0	0	0	109	T95	N23-T95 CarbonylContact C-O 3.59Å; N23-T95 WeakPolarHBondContact CA-O 3.4Å; N23-T95 WeakPolarHBondContact OD1-CB 3.36Å; N23-T95 PolarHBondContact OD1-OG1 3.19Å
24	L	89	Confident	61.8	Low	33 Å²	33	98.5 Å²	98.5	17%	0.173	57%	0.565	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.3	125	-174.6	-67.1	164.3	0	0	0	108.9	M22 L75 R76 T95 F96 S97	M22-L24 HydrophobicContact CG-CD1 4.17Å; M22-L24 HydrophobicContact CG-CD2 4.2Å; M22-L24 HydrophobicContact CG-CG 3.93Å; M22-L24 HydrophobicContact SD-CD1 4.25Å; M22-L24 HydrophobicContact SD-CD2 4.35Å; M22-L24 HydrophobicContact SD-CG 4.43Å; L24-L75 HydrophobicContact CB-CB 4.42Å; L24-L75 HydrophobicContact CB-CD1 4.18Å; L24-L75 HydrophobicContact CB-CD2 4.35Å; L24-R76 WeakPolarHBondContact CD1-O 3.15Å; L24-R76 WeakPolarHBondContact CD2-O 3.14Å; L24-T95 PolarHBondContact N-O 3.36Å; L24-F96 HydrophobicContact CB-CD1 4.04Å; L24-F96 HydrophobicContact CB-CE1 4.45Å; L24-F96 HydrophobicContact CD1-CD1 3.79Å; L24-F96 HydrophobicContact CD1-CE1 3.34Å; L24-F96 HydrophobicContact CD1-CZ 3.82Å; L24-F96 CarbonylContact O-C 3.55Å; L24-F96 WeakPolarHBondContact O-CA 3.3Å; L24-S97 PolarHBondContact O-N 2.87Å
25	F	86.1	Confident	63.2	Low	142 Å²	142	101 Å²	101	62%	0.623	57%	0.568	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-123.9	139.9	-175.3	62.1	-89.2	0	0	0	112.7	L75 S97	F25-L75 WeakPolarHBondContact O-CD2 3.25Å; F25-S97 CarbonylContact C-O 3.59Å; F25-S97 VanDerWaalsContact CA-O 3.23Å; F25-S97 WeakPolarHBondContact CA-O 3.35Å
26	A	82.9	Confident	65.2	Low	22 Å²	22	100 Å²	100	18%	0.182	55%	0.549	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	120.7	171.8	0	0	0	0	0	110	L75 S97 L98 Q99	A26-L75 HydrophobicContact CB-CD1 4.16Å; A26-L75 HydrophobicContact CB-CD2 3.77Å; A26-L75 HydrophobicContact CB-CG 3.98Å; A26-S97 PolarHBondContact N-O 3.26Å; A26-L98 HydrophobicContact CB-CB 4.39Å; A26-L98 WeakPolarHBondContact O-CA 3.46Å; A26-Q99 PolarHBondContact O-N 3.43Å
27	T	79.1	Confident	67.5	Low	77 Å²	77	92.7 Å²	92.7	47%	0.472	51%	0.513	S	S	.	.			trans	-82.5	158.7	165.8	50.8	0	0	0	0	110.9	R73 Q99	T27-R73 WeakPolarHBondContact O-CD 3.3Å; T27-R73 PolarHBondContact O-NH1 3.39Å; T27-Q99 VanDerWaalsContact CB-OE1 3.3Å
28	W	69.8	Low	69.6	Low	93 Å²	93	88.3 Å²	88.3	35%	0.352	49%	0.488	S	S	.	.			trans	-112.8	131.9	171.3	-179.4	-97.2	0	0	0	108.5	Q99 P101	W28-Q99 HydrophobicContact CB-CB 3.92Å; W28-P101 HydrophobicContact CZ2-CG 4.42Å
29	E	59.1	Low	71.3	Confident	104 Å²	104	78.7 Å²	78.7	49%	0.486	46%	0.457	S	S	.	.			trans	-77	132.1	172.2	-84.9	112	-117	0	0	109.5	D31 R73	E29-D31 VanDerWaalsContact C-N 3.27Å; E29-D31 PolarHBondContact O-N 3.34Å; E29-R73 IonicContact OE1-CZ 3.19Å; E29-R73 IonicContact OE1-NH1 3.3Å; E29-R73 PolarHBondContact OE1-NH1 3.27Å; E29-R73 IonicContact OE1-NH2 2.73Å; E29-R73 PolarHBondContact OE1-NH2 3.35Å; E29-R73 IonicContact OE2-CZ 3.72Å; E29-R73 IonicContact OE2-NH2 2.71Å; E29-R73 PolarHBondContact OE2-NH2 3.24Å
30	I	55.7	Low	72.8	Confident	87 Å²	87	78.1 Å²	78.1	45%	0.446	45%	0.449	S	S	.	.			trans	-87.9	1.8	-169.1	-62.5	140.1	0	0	0	111.7	G32 S33	I30-G32 PolarHBondContact O-N 2.97Å; I30-S33 PolarHBondContact O-N 3.34Å
31	D	43.9	Very low	74.1	Confident	150 Å²	150	75.4 Å²	75.4	80%	0.802	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	106.2	-178.4	-62	-32.6	0	0	0	111.5	E29	E29-D31 VanDerWaalsContact C-N 3.27Å; E29-D31 PolarHBondContact O-N 3.34Å
32	G	53.8	Low	74.9	Confident	79 Å²	79	70.6 Å²	70.6	81%	0.814	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	27	174.7	0	0	0	0	0	116	I30 S34	I30-G32 PolarHBondContact O-N 2.97Å; G32-S34 PolarHBondContact O-N 3.19Å
33	S	56.1	Low	75.4	Confident	65 Å²	65	69.6 Å²	69.6	46%	0.455	40%	0.397	S	S	.	.			trans	-58.7	119.5	171.6	58.1	0	0	0	0	111.7	I30	I30-S33 PolarHBondContact O-N 3.34Å
34	S	60.3	Low	75.9	Confident	50 Å²	50	64 Å²	64	35%	0.35	37%	0.367	S	S	.	.			trans	-69.1	150.1	178.9	65.1	0	0	0	0	111.8	G32 N36 C37	G32-S34 PolarHBondContact O-N 3.19Å; S34-N36 PolarHBondContact O-N 3.31Å; S34-C37 PolarHBondContact O-N 3.08Å; S34-C37 PolarHBondContact O-SG 2.74Å
35	P	61.4	Low	76.2	Confident	129 Å²	129	64.1 Å²	64.1	84%	0.838	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	14.1	-170.5	28.7	-37.5	0	0	0	115.3
36	N	74.9	Confident	76.6	Confident	70 Å²	70	57.4 Å²	57.4	37%	0.374	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	13	-179.1	-70.9	-77.6	0	0	0	113.2	S34 F103 L104	S34-N36 PolarHBondContact O-N 3.31Å; N36-F103 WeakPolarHBondContact O-CA 3.47Å; N36-L104 PolarHBondContact O-N 2.98Å
37	C	83.1	Confident	77	Confident	21 Å²	21	62 Å²	62	14%	0.142	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	152.2	174.1	64.9	0	0	0	0	113.8	S34 P101 H102 F103	S34-C37 PolarHBondContact O-N 3.08Å; S34-C37 PolarHBondContact O-SG 2.74Å; C37-P101 HydrophobicContact CB-CB 3.87Å; C37-P101 VanDerWaalsContact SG-CB 3.6Å; C37-H102 CarbonylContact C-O 3.52Å; C37-H102 WeakPolarHBondContact CA-O 3.44Å; C37-H102 WeakPolarHBondContact CB-O 3.3Å; C37-F103 HydrophobicContact CB-CD1 3.63Å; C37-F103 HydrophobicContact CB-CE1 3.85Å; C37-F103 HydrophobicContact CB-CG 4.03Å; C37-F103 HydrophobicContact CB-CZ 4.44Å
38	I	86.7	Confident	77.6	Confident	67 Å²	67	60.3 Å²	60.3	34%	0.344	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	127.3	175.3	-59.2	179.6	0	0	0	108.2	R40 H102 L104	I38-R40 HydrophobicContact CG2-CG 4.16Å; I38-R40 PolarHBondContact O-N 3.43Å; I38-H102 PolarHBondContact N-O 3.22Å; I38-H102 PolarHBondContact O-N 3.1Å; I38-L104 HydrophobicContact CD1-CD1 4.23Å; I38-L104 HydrophobicContact CD1-CD2 3.97Å; I38-L104 HydrophobicContact CD1-CG 4.43Å; I38-L104 HydrophobicContact CG1-CD1 4.35Å; I38-L104 HydrophobicContact CG1-CD2 4.4Å; I38-L104 HydrophobicContact CG1-CG 4.45Å
39	P	88.7	Confident	78.8	Confident	36 Å²	36	55.9 Å²	55.9	23%	0.234	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	126.1	170.3	-24.2	36.5	0	0	0	111.4	I179	P39-I179 HydrophobicContact CB-CB 4.21Å; P39-I179 HydrophobicContact CB-CD1 4.32Å; P39-I179 PolarHBondContact O-N 2.81Å
40	R	90.6	Very high	80.4	Confident	31 Å²	31	52.1 Å²	52.1	12%	0.117	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	149.9	-179.5	-60.6	-163.9	78.1	92.4	-11.4	112.8	I38 Q99 Y100 H102 M143 S176 Q177	I38-R40 HydrophobicContact CG2-CG 4.16Å; I38-R40 PolarHBondContact O-N 3.43Å; R40-Q99 CarbonylContact O-C 3.49Å; R40-Q99 VanDerWaalsContact O-CA 3.32Å; R40-Q99 WeakPolarHBondContact O-CA 3.49Å; R40-Y100 HydrophobicContact CB-CD1 4.18Å; R40-Y100 HydrophobicContact CB-CE1 3.66Å; R40-Y100 PolarHBondContact N-O 2.75Å; R40-Y100 WeakPolarHBondContact O-CD1 3.43Å; R40-Y100 PolarHBondContact O-N 3.38Å; R40-H102 HydrophobicContact CG-CB 3.98Å; R40-M143 WeakPolarHBondContact CD-SD 3.26Å; R40-M143 VanDerWaalsContact CZ-SD 3.54Å; R40-M143 PolarHBondContact NE-SD 3.38Å; R40-S176 WeakPolarHBondContact CD-OG 3.43Å; R40-S176 PolarHBondContact NE-O 3.26Å; R40-S176 PolarHBondContact NE-OG 2.83Å; R40-S176 PolarHBondContact NH2-O 3.37Å; R40-Q177 CarbonylContact C-O 3.58Å; R40-Q177 WeakPolarHBondContact CA-O 3.39Å; R40-Q177 VanDerWaalsContact CB-O 3.27Å; R40-Q177 WeakPolarHBondContact CB-O 3.16Å
41	L	92.3	Very high	82.2	Confident	55 Å²	55	48.1 Å²	48.1	29%	0.288	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	112.4	171.1	178.5	61.8	0	0	0	109.1	Q99 S176 Q177 I179	L41-Q99 HydrophobicContact CD1-CG 4.07Å; L41-S176 WeakPolarHBondContact O-CA 3.36Å; L41-Q177 PolarHBondContact N-O 3.08Å; L41-Q177 PolarHBondContact O-N 3.28Å; L41-I179 HydrophobicContact CB-CD1 4.4Å; L41-I179 HydrophobicContact CB-CG1 4.1Å
42	C	92.8	Very high	84.3	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	128.6	170	166.3	0	0	0	0	109.6	S97 L98 Y100 M139 S175	C42-S97 CarbonylContact O-C 3.33Å; C42-S97 WeakPolarHBondContact O-CA 3.48Å; C42-L98 HydrophobicContact CB-CD1 3.74Å; C42-L98 HydrophobicContact CB-CG 3.87Å; C42-L98 PolarHBondContact N-O 2.87Å; C42-L98 PolarHBondContact O-N 3.02Å; C42-Y100 HydrophobicContact CB-CD1 3.96Å; C42-Y100 HydrophobicContact CB-CE1 3.65Å; C42-M139 HydrophobicContact CB-CE 3.98Å; C42-S175 WeakPolarHBondContact CA-O 3.37Å
43	S	93.9	Very high	85.8	Confident	32 Å²	32	45.9 Å²	45.9	22%	0.224	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	121.7	174.4	-71.3	0	0	0	0	110.6	F96 L174 S175	S43-F96 WeakPolarHBondContact CA-O 3.43Å; S43-L174 WeakPolarHBondContact O-CA 3.26Å; S43-S175 PolarHBondContact N-O 2.83Å; S43-S175 PolarHBondContact O-N 3.36Å
44	L	94.7	Very high	87.1	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	125.6	-172.8	172.6	76	0	0	0	109.9	L46 V66 T95 F96 L111 I113 I171 L174	L44-L46 HydrophobicContact CD1-CD2 3.78Å; L44-L46 HydrophobicContact CD2-CD1 4.27Å; L44-L46 HydrophobicContact CD2-CD2 4.03Å; L44-L46 HydrophobicContact CD2-CG 4.19Å; L44-L46 HydrophobicContact CG-CD2 3.84Å; L44-L46 HydrophobicContact CG-CG 4.16Å; L44-V66 HydrophobicContact CD2-CG1 4.05Å; L44-V66 HydrophobicContact CD2-CG2 4.12Å; L44-T95 CarbonylContact O-C 3.5Å; L44-T95 WeakPolarHBondContact O-CA 3.36Å; L44-F96 HydrophobicContact CB-CB 4.29Å; L44-F96 HydrophobicContact CD2-CB 4.4Å; L44-F96 HydrophobicContact CD2-CD2 4.08Å; L44-F96 HydrophobicContact CD2-CG 4.43Å; L44-F96 PolarHBondContact N-O 3.08Å; L44-F96 PolarHBondContact O-N 3.35Å; L44-L111 HydrophobicContact CD2-CD2 4.37Å; L44-I113 HydrophobicContact CD1-CD1 4.21Å; L44-I113 HydrophobicContact CD2-CD1 3.72Å; L44-I113 HydrophobicContact CD2-CG1 4.28Å; L44-I171 HydrophobicContact CD1-CD1 4.47Å; L44-I171 HydrophobicContact CD1-CG1 4.24Å; L44-I171 HydrophobicContact CD1-CG2 3.87Å; L44-L174 HydrophobicContact CB-CD1 4.04Å; L44-L174 HydrophobicContact CD1-CB 4.17Å; L44-L174 HydrophobicContact CD1-CD1 3.9Å; L44-L174 HydrophobicContact CD1-CD2 4.25Å; L44-L174 HydrophobicContact CD1-CG 4.33Å
45	T	93.9	Very high	88.3	Confident	37 Å²	37	47.6 Å²	47.6	23%	0.227	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	123.6	174.7	-49.2	0	0	0	0	110.1	F172 S173	T45-F172 HydrophobicContact CG2-CB 4.18Å; T45-F172 HydrophobicContact CG2-CD1 4.19Å; T45-F172 PolarHBondContact O-N 2.83Å; T45-S173 VanDerWaalsContact CB-OG 3.27Å; T45-S173 WeakPolarHBondContact CB-OG 3.36Å; T45-S173 PolarHBondContact N-O 3.13Å; T45-S173 PolarHBondContact OG1-OG 2.9Å
46	L	94.4	Very high	89.4	Confident	1 Å²	1	43 Å²	43	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	128.1	179.6	-53.2	-178.7	0	0	0	110.2	L44 I64 L92 L94 F96 I113 I169 I171	L44-L46 HydrophobicContact CD1-CD2 3.78Å; L44-L46 HydrophobicContact CD2-CD1 4.27Å; L44-L46 HydrophobicContact CD2-CD2 4.03Å; L44-L46 HydrophobicContact CD2-CG 4.19Å; L44-L46 HydrophobicContact CG-CD2 3.84Å; L44-L46 HydrophobicContact CG-CG 4.16Å; L46-I64 HydrophobicContact CD1-CG2 4.01Å; L46-L92 HydrophobicContact CB-CD1 3.93Å; L46-L92 CarbonylContact O-C 3.53Å; L46-L92 VanDerWaalsContact O-CB 3.26Å; L46-L92 WeakPolarHBondContact O-CB 3.23Å; L46-L94 HydrophobicContact CB-CB 4.38Å; L46-L94 PolarHBondContact N-O 3.26Å; L46-L94 PolarHBondContact O-N 2.8Å; L46-F96 HydrophobicContact CD1-CD2 4.22Å; L46-F96 HydrophobicContact CD1-CE2 3.61Å; L46-F96 HydrophobicContact CD1-CZ 4.41Å; L46-F96 HydrophobicContact CG-CD2 4.44Å; L46-F96 HydrophobicContact CG-CE2 4.17Å; L46-I113 HydrophobicContact CD2-CD1 4.28Å; L46-I169 HydrophobicContact CD1-CD1 3.7Å; L46-I169 HydrophobicContact CD1-CG1 4.28Å; L46-I169 HydrophobicContact CD2-CG1 4.47Å; L46-I171 HydrophobicContact CD2-CB 4.4Å; L46-I171 HydrophobicContact CD2-CG1 3.72Å
47	K	91.1	Very high	89.6	Confident	119 Å²	119	47.5 Å²	47.5	52%	0.517	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-20	-170.7	-178.8	175.1	178.1	-176.1	0	114.6	L92 W170 F172	K47-L92 WeakPolarHBondContact CA-O 3.44Å; K47-L92 PolarHBondContact O-N 3.42Å; K47-W170 PolarHBondContact N-O 2.96Å; K47-F172 HydrophobicContact CB-CB 4.03Å; K47-F172 HydrophobicContact CD-CB 4.47Å; K47-F172 HydrophobicContact CD-CD2 3.94Å; K47-F172 HydrophobicContact CD-CG 4.48Å
48	K	93.5	Very high	89.4	Confident	41 Å²	41	55.2 Å²	55.2	18%	0.178	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	142.8	179.9	-162.2	175.5	-179	177.3	0	111.9	V50 E89 T90 I169 W170	K48-V50 HydrophobicContact CD-CG2 4.4Å; K48-V50 HydrophobicContact CG-CG2 4.36Å; K48-E89 VanDerWaalsContact CE-CG 3.43Å; K48-E89 WeakPolarHBondContact CE-OE1 3.32Å; K48-E89 IonicContact NZ-OE1 2.76Å; K48-E89 PolarHBondContact NZ-OE1 2.78Å; K48-T90 CarbonylContact C-O 3.45Å; K48-T90 WeakPolarHBondContact CA-O 3.3Å; K48-I169 WeakPolarHBondContact O-CA 3.5Å; K48-I169 WeakPolarHBondContact O-CG1 3.16Å; K48-W170 HydrophobicContact CB-CB 3.8Å; K48-W170 HydrophobicContact CB-CG 3.83Å; K48-W170 HydrophobicContact CD-CD2 4.45Å; K48-W170 HydrophobicContact CD-CG 4.48Å; K48-W170 PolarHBondContact O-N 3.17Å
49	L	94.2	Very high	89.2	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	134.8	166.5	173.2	63.1	0	0	0	108.8	V51 I64 I80 T90 L92 L115 A167 I169	L49-V51 HydrophobicContact CD1-CG2 4.3Å; L49-V51 HydrophobicContact CD2-CG2 4.26Å; L49-V51 HydrophobicContact CG-CG2 4.18Å; L49-I64 HydrophobicContact CD2-CD1 4.36Å; L49-I80 HydrophobicContact CD2-CD1 4.23Å; L49-T90 PolarHBondContact N-O 3.46Å; L49-T90 PolarHBondContact O-N 2.8Å; L49-L92 HydrophobicContact CB-CD1 4.08Å; L49-L92 HydrophobicContact CB-CD2 4.45Å; L49-L92 HydrophobicContact CB-CG 4.36Å; L49-L115 HydrophobicContact CD1-CD1 4.2Å; L49-L115 HydrophobicContact CD1-CD2 4.06Å; L49-L115 HydrophobicContact CD2-CD2 4.06Å; L49-A167 HydrophobicContact CD1-CB 4.42Å; L49-I169 HydrophobicContact CD1-CD1 4.44Å
50	V	93.4	Very high	89.1	Confident	25 Å²	25	57.4 Å²	57.4	15%	0.152	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	116	171.3	-169.7	0	0	0	0	108.3	K48 L52 V88 E89 A167 E168	K48-V50 HydrophobicContact CD-CG2 4.4Å; K48-V50 HydrophobicContact CG-CG2 4.36Å; V50-L52 HydrophobicContact CG1-CD2 3.76Å; V50-V88 CarbonylContact C-O 3.55Å; V50-V88 WeakPolarHBondContact CA-O 3.49Å; V50-E89 HydrophobicContact CG2-CG 4.43Å; V50-A167 CarbonylContact O-C 3.51Å; V50-A167 WeakPolarHBondContact O-CA 3.4Å; V50-A167 WeakPolarHBondContact O-CB 3.44Å; V50-E168 PolarHBondContact N-O 3.02Å; V50-E168 PolarHBondContact O-N 3.22Å
51	V	91.8	Very high	89	Confident	3 Å²	3	56.7 Å²	56.7	2%	0.018	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	115.8	173.1	178.4	0	0	0	0	108.2	L49 K53 L55 G86 S87 V88 L115 A167	L49-V51 HydrophobicContact CD1-CG2 4.3Å; L49-V51 HydrophobicContact CD2-CG2 4.26Å; L49-V51 HydrophobicContact CG-CG2 4.18Å; V51-K53 WeakPolarHBondContact CG1-O 3.47Å; V51-L55 HydrophobicContact CG1-CD1 3.8Å; V51-L55 HydrophobicContact CG1-CD2 4.33Å; V51-L55 HydrophobicContact CG1-CG 3.81Å; V51-L55 HydrophobicContact CG2-CD1 4.09Å; V51-G86 WeakPolarHBondContact CG1-O 3.37Å; V51-S87 WeakPolarHBondContact O-CA 3.25Å; V51-S87 WeakPolarHBondContact O-CB 3.37Å; V51-V88 HydrophobicContact CB-CG1 4.09Å; V51-V88 HydrophobicContact CG2-CG1 3.87Å; V51-V88 PolarHBondContact N-O 3.01Å; V51-V88 PolarHBondContact O-N 2.93Å; V51-L115 HydrophobicContact CG2-CD1 4.35Å; V51-A167 HydrophobicContact CG2-CB 4.16Å
52	L	88.7	Confident	89	Confident	75 Å²	75	54.1 Å²	54.1	39%	0.393	26%	0.263	S	S	.	.			trans	-92.7	-24.2	-171	-59.5	173.5	0	0	0	112.9	V50 K165 V166 E168	V50-L52 HydrophobicContact CG1-CD2 3.76Å; L52-K165 HydrophobicContact CD1-CD 4.26Å; L52-K165 HydrophobicContact CD1-CG 4.42Å; L52-V166 WeakPolarHBondContact CB-O 3.2Å; L52-V166 PolarHBondContact N-O 3.4Å; L52-E168 HydrophobicContact CD1-CG 4.04Å
53	K	86.3	Confident	89.1	Confident	107 Å²	107	54.4 Å²	54.4	47%	0.465	27%	0.265	S	S	.	.	S	Bend	trans	-141.8	153.1	-177.1	-64.9	172.4	-175.9	157.7	0	109.7	V51 L55 K165 V166	V51-K53 WeakPolarHBondContact CG1-O 3.47Å; K53-L55 PolarHBondContact O-N 3.13Å; K53-K165 WeakPolarHBondContact CE-O 3.4Å; K53-K165 PolarHBondContact NZ-O 3.5Å; K53-V166 HydrophobicContact CB-CB 4.34Å; K53-V166 HydrophobicContact CB-CG1 4.25Å; K53-V166 HydrophobicContact CD-CG1 4.09Å; K53-V166 PolarHBondContact N-O 2.95Å
54	E	83.3	Confident	89.2	Confident	127 Å²	127	52.9 Å²	52.9	59%	0.593	25%	0.254	S	S	*	.			trans	-57.7	129.2	172.7	-170.1	-176.6	173.3	0	0	110.5
55	L	85.3	Confident	89.2	Confident	24 Å²	24	52.9 Å²	52.9	13%	0.126	25%	0.254	C	S	.	.			trans	-95.2	-28.8	-170.3	-63.7	170.9	0	0	0	113.9	V51 K53 L59 V62 L115 L132 A133 V166	V51-L55 HydrophobicContact CG1-CD1 3.8Å; V51-L55 HydrophobicContact CG1-CD2 4.33Å; V51-L55 HydrophobicContact CG1-CG 3.81Å; V51-L55 HydrophobicContact CG2-CD1 4.09Å; K53-L55 PolarHBondContact O-N 3.13Å; L55-L59 HydrophobicContact CB-CD2 3.63Å; L55-L59 HydrophobicContact CD1-CD2 4.22Å; L55-L59 HydrophobicContact CG-CD2 4.47Å; L55-V62 HydrophobicContact CD1-CG1 4.27Å; L55-L115 HydrophobicContact CD1-CD1 3.68Å; L55-L132 HydrophobicContact CB-CB 4.22Å; L55-L132 HydrophobicContact CB-CD1 3.89Å; L55-A133 HydrophobicContact CD2-CB 4.32Å; L55-V166 HydrophobicContact CD2-CB 3.68Å; L55-V166 HydrophobicContact CD2-CG2 3.47Å; L55-V166 VanDerWaalsContact CD2-CG2 3.47Å
56	D	84.1	Confident	89.3	Confident	31 Å²	31	51.1 Å²	51.1	17%	0.166	24%	0.243	C	C	.	.	S	Bend	trans	-165.6	153.1	176.4	-152.9	-52.3	0	0	0	107.2	L59 R117 K130 L132	D56-L59 HydrophobicContact CB-CB 4.4Å; D56-L59 HydrophobicContact CB-CD2 4.38Å; D56-L59 VanDerWaalsContact O-CB 3.23Å; D56-L59 WeakPolarHBondContact O-CB 3.46Å; D56-R117 IonicContact OD1-CZ 3.91Å; D56-R117 VanDerWaalsContact OD1-CZ 3.29Å; D56-R117 IonicContact OD1-NH1 2.93Å; D56-R117 PolarHBondContact OD1-NH1 2.82Å; D56-R117 IonicContact OD1-NH2 3.29Å; D56-R117 PolarHBondContact OD1-NH2 3.27Å; D56-R117 IonicContact OD2-CZ 3.29Å; D56-R117 VanDerWaalsContact OD2-CZ 3.28Å; D56-R117 IonicContact OD2-NE 3.14Å; D56-R117 IonicContact OD2-NH1 2.93Å; D56-R117 IonicContact OD2-NH2 2.93Å; D56-R117 PolarHBondContact OD2-NH2 2.87Å; D56-K130 IonicContact OD2-NZ 2.8Å; D56-K130 PolarHBondContact OD2-NZ 3.22Å; D56-L132 HydrophobicContact CB-CD1 4.18Å; D56-L132 HydrophobicContact CB-CD2 4Å; D56-L132 WeakPolarHBondContact OD2-CD2 3.29Å
57	K	79.5	Confident	89.3	Confident	166 Å²	166	53.4 Å²	53.4	72%	0.722	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	145.8	-180	-65.3	-175.2	179.8	-177.9	0	110.6	L59 R117	K57-L59 PolarHBondContact O-N 2.72Å; K57-R117 PolarHBondContact O-NH1 3.39Å; K57-R117 VanDerWaalsContact O-NH1 3.08Å
58	E	77.4	Confident	89.3	Confident	183 Å²	183	48.3 Å²	48.3	86%	0.855	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.3	27.9	177.9	-56.5	-179.9	174.8	0	0	114.2	I60	E58-I60 PolarHBondContact O-N 3.49Å
59	L	84.2	Confident	89	Confident	19 Å²	19	50.1 Å²	50.1	10%	0.099	24%	0.24	C	C	.	.			trans	-78	92	-174.3	-176.6	69.5	0	0	0	113	L55 D56 K57 S61 V62 L82 R117 L132	L55-L59 HydrophobicContact CB-CD2 3.63Å; L55-L59 HydrophobicContact CD1-CD2 4.22Å; L55-L59 HydrophobicContact CG-CD2 4.47Å; D56-L59 HydrophobicContact CB-CB 4.4Å; D56-L59 HydrophobicContact CB-CD2 4.38Å; D56-L59 VanDerWaalsContact O-CB 3.23Å; D56-L59 WeakPolarHBondContact O-CB 3.46Å; K57-L59 PolarHBondContact O-N 2.72Å; L59-S61 VanDerWaalsContact CD1-O 3.27Å; L59-S61 WeakPolarHBondContact CD1-O 3.47Å; L59-V62 HydrophobicContact CD1-CG1 4.13Å; L59-V62 HydrophobicContact CD2-CG1 3.7Å; L59-V62 HydrophobicContact CG-CG1 4.09Å; L59-L82 HydrophobicContact CD2-CD1 3.62Å; L59-L82 HydrophobicContact CG-CD1 3.86Å; L59-R117 HydrophobicContact CD1-CB 3.92Å; L59-R117 HydrophobicContact CD1-CG 3.95Å; L59-L132 HydrophobicContact CD1-CD1 3.76Å; L59-L132 HydrophobicContact CD2-CD1 3.46Å; L59-L132 VanDerWaalsContact CD2-CD1 3.46Å; L59-L132 HydrophobicContact CG-CD1 4.29Å
60	I	85.4	Confident	88.3	Confident	130 Å²	130	53.8 Å²	53.8	67%	0.667	28%	0.279	S	S	*	.			trans	-76.9	-21.6	178	63	172.3	0	0	0	115	E58 V81 L82	E58-I60 PolarHBondContact O-N 3.49Å; I60-V81 WeakPolarHBondContact O-CA 3.43Å; I60-L82 PolarHBondContact O-N 2.98Å
61	S	89.6	Confident	87.8	Confident	16 Å²	16	53.9 Å²	53.9	11%	0.112	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	152.1	-179.5	66.8	0	0	0	0	113.8	L59 E79 I80	L59-S61 VanDerWaalsContact CD1-O 3.27Å; L59-S61 WeakPolarHBondContact CD1-O 3.47Å; S61-E79 PolarHBondContact OG-OE2 3.17Å; S61-I80 CarbonylContact C-O 3.5Å; S61-I80 WeakPolarHBondContact CA-O 3.49Å; S61-I80 WeakPolarHBondContact CB-O 3.17Å
62	V	92.3	Very high	87.3	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.006	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	152.6	174	-68.3	0	0	0	0	111.7	L55 L59 I80 L82 L132	L55-V62 HydrophobicContact CD1-CG1 4.27Å; L59-V62 HydrophobicContact CD1-CG1 4.13Å; L59-V62 HydrophobicContact CD2-CG1 3.7Å; L59-V62 HydrophobicContact CG-CG1 4.09Å; V62-I80 HydrophobicContact CG2-CB 4.24Å; V62-I80 PolarHBondContact N-O 3.26Å; V62-I80 PolarHBondContact O-N 3.06Å; V62-L82 HydrophobicContact CG1-CD1 3.93Å; V62-L82 HydrophobicContact CG1-CG 4.43Å; V62-L82 HydrophobicContact CG2-CD1 4.48Å; V62-L82 HydrophobicContact CG2-CD2 3.93Å; V62-L82 HydrophobicContact CG2-CG 4.26Å; V62-L132 HydrophobicContact CG1-CD1 4.2Å
63	V	93.4	Very high	87.1	Confident	5 Å²	5	64.5 Å²	64.5	3%	0.03	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130	173.3	173.7	0	0	0	0	108.8	R76 S77 E79 Q116 Y129	V63-R76 HydrophobicContact CG1-CB 3.77Å; V63-R76 HydrophobicContact CG1-CG 4.14Å; V63-S77 WeakPolarHBondContact CG1-O 3.21Å; V63-E79 HydrophobicContact CG2-CB 4.45Å; V63-E79 HydrophobicContact CG2-CG 3.65Å; V63-Q116 PolarHBondContact N-O 3.09Å; V63-Q116 PolarHBondContact O-N 3.47Å; V63-Y129 HydrophobicContact CG2-CE1 4.48Å
64	I	95.9	Very high	87.3	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	124.1	168.3	-64.8	161.7	0	0	0	107.6	L46 L49 V66 R76 S77 I80 L92 L94 F96 I113 M114 L115 I169	L46-I64 HydrophobicContact CD1-CG2 4.01Å; L49-I64 HydrophobicContact CD2-CD1 4.36Å; I64-V66 HydrophobicContact CG2-CG2 4.42Å; I64-R76 WeakPolarHBondContact O-CA 3.08Å; I64-S77 PolarHBondContact N-OG 3Å; I64-S77 PolarHBondContact O-N 2.88Å; I64-S77 PolarHBondContact O-OG 3.01Å; I64-I80 HydrophobicContact CD1-CD1 3.64Å; I64-I80 HydrophobicContact CG1-CD1 4.16Å; I64-L92 HydrophobicContact CD1-CD1 3.61Å; I64-L92 HydrophobicContact CD1-CD2 4.01Å; I64-L92 HydrophobicContact CD1-CG 4.48Å; I64-L94 HydrophobicContact CB-CD1 4.29Å; I64-L94 HydrophobicContact CD1-CD1 3.63Å; I64-F96 HydrophobicContact CG2-CZ 3.99Å; I64-I113 HydrophobicContact CG2-CG2 4.24Å; I64-M114 CarbonylContact C-O 3.59Å; I64-M114 WeakPolarHBondContact CA-O 3.45Å; I64-L115 HydrophobicContact CG1-CD2 3.75Å; I64-I169 HydrophobicContact CD1-CD1 3.83Å; I64-I169 HydrophobicContact CG1-CD1 4.2Å; I64-I169 HydrophobicContact CG2-CD1 4.19Å
65	A	95.7	Very high	87.8	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	138.3	-179.8	0	0	0	0	0	110.8	I74 L75 R76 M114 Q116	A65-I74 HydrophobicContact CB-CG2 4.05Å; A65-L75 CarbonylContact C-O 3.54Å; A65-L75 WeakPolarHBondContact CA-O 3.38Å; A65-R76 HydrophobicContact CB-CG 3.86Å; A65-M114 HydrophobicContact CB-CB 4.33Å; A65-M114 HydrophobicContact CB-CE 4.09Å; A65-M114 PolarHBondContact N-O 3.06Å; A65-M114 PolarHBondContact O-N 3.09Å; A65-Q116 HydrophobicContact CB-CG 3.86Å
66	V	96.3	Very high	88.2	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.006	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	132.5	-174.7	-179	0	0	0	0	110.1	L44 I64 L75 F96 L98 L111 Q112 I113	L44-V66 HydrophobicContact CD2-CG1 4.05Å; L44-V66 HydrophobicContact CD2-CG2 4.12Å; I64-V66 HydrophobicContact CG2-CG2 4.42Å; V66-L75 PolarHBondContact N-O 3.35Å; V66-L75 PolarHBondContact O-N 3.16Å; V66-F96 HydrophobicContact CB-CD1 3.71Å; V66-F96 HydrophobicContact CB-CE1 3.89Å; V66-F96 HydrophobicContact CB-CG 4.25Å; V66-F96 HydrophobicContact CG1-CD1 4.43Å; V66-F96 HydrophobicContact CG2-CD1 3.62Å; V66-F96 HydrophobicContact CG2-CD2 4.14Å; V66-F96 HydrophobicContact CG2-CE1 3.46Å; V66-F96 VanDerWaalsContact CG2-CE1 3.46Å; V66-F96 HydrophobicContact CG2-CE2 4.02Å; V66-F96 HydrophobicContact CG2-CG 3.96Å; V66-F96 HydrophobicContact CG2-CZ 3.68Å; V66-L98 HydrophobicContact CG1-CD2 3.86Å; V66-L111 HydrophobicContact CG1-CD1 3.67Å; V66-L111 HydrophobicContact CG1-CG 4.46Å; V66-Q112 WeakPolarHBondContact CA-O 3.34Å; V66-I113 HydrophobicContact CG2-CG1 4.33Å; V66-I113 HydrophobicContact CG2-CG2 4.37Å
67	K	93.2	Very high	88.7	Confident	49 Å²	49	58.4 Å²	58.4	21%	0.213	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	161.6	174	71.7	177.3	-172.5	171.1	0	111.4	R73 I74 Q112 M114	K67-R73 WeakPolarHBondContact CB-O 3.14Å; K67-I74 HydrophobicContact CB-CB 4.38Å; K67-I74 HydrophobicContact CB-CG1 4.02Å; K67-I74 HydrophobicContact CB-CG2 4.33Å; K67-I74 HydrophobicContact CD-CD1 3.93Å; K67-I74 HydrophobicContact CD-CG1 3.87Å; K67-I74 HydrophobicContact CG-CG1 4.49Å; K67-Q112 HydrophobicContact CG-CB 4.2Å; K67-Q112 PolarHBondContact N-O 3.4Å; K67-Q112 VanDerWaalsContact N-O 3.08Å; K67-Q112 PolarHBondContact O-N 2.83Å; K67-M114 HydrophobicContact CB-CE 4.49Å; K67-M114 HydrophobicContact CD-CE 3.99Å; K67-M114 HydrophobicContact CG-CE 3.77Å
68	I	92.1	Very high	89.1	Confident	11 Å²	11	53.9 Å²	53.9	6%	0.056	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	143.6	161.3	-68.4	-76.6	0	0	0	108.9	S71 L98 Y100 L111 M139	I68-S71 VanDerWaalsContact O-CB 3.27Å; I68-S71 WeakPolarHBondContact O-CB 3.38Å; I68-S71 PolarHBondContact O-N 3.46Å; I68-L98 HydrophobicContact CD1-CD1 4.14Å; I68-L98 HydrophobicContact CG1-CD1 3.43Å; I68-L98 VanDerWaalsContact CG1-CD1 3.43Å; I68-Y100 HydrophobicContact CD1-CD2 3.79Å; I68-Y100 HydrophobicContact CD1-CE2 3.98Å; I68-Y100 HydrophobicContact CD1-CG 4.07Å; I68-Y100 HydrophobicContact CG1-CD1 4.48Å; I68-Y100 HydrophobicContact CG1-CD2 3.91Å; I68-Y100 HydrophobicContact CG1-CG 3.84Å; I68-Y100 HydrophobicContact CG2-CD2 4.11Å; I68-L111 HydrophobicContact CD1-CB 4.03Å; I68-L111 HydrophobicContact CD1-CD1 3.95Å; I68-L111 HydrophobicContact CG1-CD1 4.36Å; I68-M139 HydrophobicContact CD1-CG 3.93Å
69	Q	87.4	Confident	89.6	Confident	79 Å²	79	48.7 Å²	48.7	37%	0.369	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	139.4	175.2	-178.7	168.4	-17.1	0	0	110.7	S71 K110	Q69-S71 PolarHBondContact O-N 3.34Å; Q69-K110 HydrophobicContact CB-CB 4.37Å; Q69-K110 WeakPolarHBondContact CB-O 3.34Å; Q69-K110 PolarHBondContact N-O 2.83Å
70	G	80.2	Confident	89.8	Confident	78 Å²	78	48.3 Å²	48.3	80%	0.804	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.5	-17.2	-171	0	0	0	0	0	115.7
71	S	82.4	Confident	89.9	Confident	27 Å²	27	47.4 Å²	47.4	19%	0.189	25%	0.248	C	C	.	.			trans	-75	135	178.1	-171.6	0	0	0	0	112.9	I68 Q69 R73	I68-S71 VanDerWaalsContact O-CB 3.27Å; I68-S71 WeakPolarHBondContact O-CB 3.38Å; I68-S71 PolarHBondContact O-N 3.46Å; Q69-S71 PolarHBondContact O-N 3.34Å; S71-R73 VanDerWaalsContact C-N 3.3Å; S71-R73 PolarHBondContact OG-N 2.79Å; S71-R73 VanDerWaalsContact OG-N 3.17Å
72	K	81.4	Confident	89.6	Confident	209 Å²	209	47.2 Å²	47.2	91%	0.909	25%	0.245	S	C	*	.	S	Bend	trans	-73.5	-19.6	169.3	-63.9	-177.2	-179.9	179.8	0	112.5
73	R	83.6	Confident	89.1	Confident	92 Å²	92	49.4 Å²	49.4	35%	0.347	26%	0.259	S	S	.	.			trans	-88.7	130.2	-178.8	-63.3	-175.7	179.6	-156.1	-11.2	110.4	T27 E29 K67 S71	T27-R73 WeakPolarHBondContact O-CD 3.3Å; T27-R73 PolarHBondContact O-NH1 3.39Å; E29-R73 IonicContact OE1-CZ 3.19Å; E29-R73 IonicContact OE1-NH1 3.3Å; E29-R73 PolarHBondContact OE1-NH1 3.27Å; E29-R73 IonicContact OE1-NH2 2.73Å; E29-R73 PolarHBondContact OE1-NH2 3.35Å; E29-R73 IonicContact OE2-CZ 3.72Å; E29-R73 IonicContact OE2-NH2 2.71Å; E29-R73 PolarHBondContact OE2-NH2 3.24Å; K67-R73 WeakPolarHBondContact CB-O 3.14Å; S71-R73 VanDerWaalsContact C-N 3.3Å; S71-R73 PolarHBondContact OG-N 2.79Å; S71-R73 VanDerWaalsContact OG-N 3.17Å
74	I	91	Very high	88	Confident	53 Å²	53	56.2 Å²	56.2	27%	0.272	30%	0.304	S	S	.	.			trans	-134.7	115.3	-178	-50.3	-178.6	0	0	0	109.4	A65 K67 R76 M114	A65-I74 HydrophobicContact CB-CG2 4.05Å; K67-I74 HydrophobicContact CB-CB 4.38Å; K67-I74 HydrophobicContact CB-CG1 4.02Å; K67-I74 HydrophobicContact CB-CG2 4.33Å; K67-I74 HydrophobicContact CD-CD1 3.93Å; K67-I74 HydrophobicContact CD-CG1 3.87Å; K67-I74 HydrophobicContact CG-CG1 4.49Å; I74-R76 HydrophobicContact CG2-CG 4.45Å; I74-M114 HydrophobicContact CG2-CE 4.18Å
75	L	93.8	Very high	86.9	Confident	22 Å²	22	60.2 Å²	60.2	12%	0.115	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	148.1	172.3	-66.6	178.4	0	0	0	110.6	L24 F25 A26 A65 V66 F96 L98	L24-L75 HydrophobicContact CB-CB 4.42Å; L24-L75 HydrophobicContact CB-CD1 4.18Å; L24-L75 HydrophobicContact CB-CD2 4.35Å; F25-L75 WeakPolarHBondContact O-CD2 3.25Å; A26-L75 HydrophobicContact CB-CD1 4.16Å; A26-L75 HydrophobicContact CB-CD2 3.77Å; A26-L75 HydrophobicContact CB-CG 3.98Å; A65-L75 CarbonylContact C-O 3.54Å; A65-L75 WeakPolarHBondContact CA-O 3.38Å; V66-L75 PolarHBondContact N-O 3.35Å; V66-L75 PolarHBondContact O-N 3.16Å; L75-F96 HydrophobicContact CB-CD1 3.81Å; L75-F96 HydrophobicContact CB-CE1 4.19Å; L75-F96 HydrophobicContact CD1-CB 4.27Å; L75-F96 HydrophobicContact CD1-CD1 4.06Å; L75-L98 HydrophobicContact CD1-CB 4.29Å
76	R	93.7	Very high	85.5	Confident	72 Å²	72	60.8 Å²	60.8	27%	0.272	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	137.1	-175.7	-72.4	-170.5	176.8	85.8	-2.7	111.9	L24 V63 I64 A65 I74	L24-R76 WeakPolarHBondContact CD1-O 3.15Å; L24-R76 WeakPolarHBondContact CD2-O 3.14Å; V63-R76 HydrophobicContact CG1-CB 3.77Å; V63-R76 HydrophobicContact CG1-CG 4.14Å; I64-R76 WeakPolarHBondContact O-CA 3.08Å; A65-R76 HydrophobicContact CB-CG 3.86Å; I74-R76 HydrophobicContact CG2-CG 4.45Å
77	S	93.8	Very high	84.5	Confident	13 Å²	13	63.6 Å²	63.6	9%	0.091	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	179.4	173.8	71.7	0	0	0	0	113	V63 I64	V63-S77 WeakPolarHBondContact CG1-O 3.21Å; I64-S77 PolarHBondContact N-OG 3Å; I64-S77 PolarHBondContact O-N 2.88Å; I64-S77 PolarHBondContact O-OG 3.01Å
78	H	87.8	Confident	84	Confident	72 Å²	72	62.3 Å²	62.3	33%	0.333	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	163.7	158.4	55.6	-90.9	0	0	0	111.4	M22 I80	M22-H78 HydrophobicContact CE-CB 4.01Å; M22-H78 HydrophobicContact SD-CB 4.39Å; M22-H78 PolarHBondContact SD-N 3.02Å; M22-H78 VanDerWaalsContact SD-N 3.42Å; M22-H78 PolarHBondContact SD-ND1 3.24Å; M22-H78 VanDerWaalsContact SD-ND1 3.37Å; H78-I80 PolarHBondContact O-N 3.32Å
79	E	88.3	Confident	83.9	Confident	74 Å²	74	68.1 Å²	68.1	35%	0.346	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	117.5	169.9	-74.3	-177.2	-138.3	0	0	110	S61 V63 R118	S61-E79 PolarHBondContact OG-OE2 3.17Å; V63-E79 HydrophobicContact CG2-CB 4.45Å; V63-E79 HydrophobicContact CG2-CG 3.65Å; E79-R118 WeakPolarHBondContact OE1-CD 3.44Å; E79-R118 IonicContact OE1-CZ 2.89Å; E79-R118 IonicContact OE1-NE 3.28Å; E79-R118 IonicContact OE1-NH1 3.6Å; E79-R118 PolarHBondContact OE1-NH1 2.71Å
80	I	89.5	Confident	83.9	Confident	11 Å²	11	66.1 Å²	66.1	6%	0.056	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	119.4	170	-59.4	171.3	0	0	0	106.8	L49 S61 V62 I64 H78 T90 L92	L49-I80 HydrophobicContact CD2-CD1 4.23Å; S61-I80 CarbonylContact C-O 3.5Å; S61-I80 WeakPolarHBondContact CA-O 3.49Å; S61-I80 WeakPolarHBondContact CB-O 3.17Å; V62-I80 HydrophobicContact CG2-CB 4.24Å; V62-I80 PolarHBondContact N-O 3.26Å; V62-I80 PolarHBondContact O-N 3.06Å; I64-I80 HydrophobicContact CD1-CD1 3.64Å; I64-I80 HydrophobicContact CG1-CD1 4.16Å; H78-I80 PolarHBondContact O-N 3.32Å; I80-T90 HydrophobicContact CG2-CG2 4.21Å; I80-L92 HydrophobicContact CD1-CD2 3.81Å
81	V	86.2	Confident	84.4	Confident	111 Å²	111	66.9 Å²	66.9	67%	0.673	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	132.1	178.7	-179.5	0	0	0	0	109.4	I60	I60-V81 WeakPolarHBondContact O-CA 3.43Å
82	L	84.8	Confident	84.8	Confident	11 Å²	11	66.2 Å²	66.2	6%	0.058	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-96.5	144.6	173.6	-61	-170.3	0	0	0	110.7	L59 I60 V62 V88	L59-L82 HydrophobicContact CD2-CD1 3.62Å; L59-L82 HydrophobicContact CG-CD1 3.86Å; I60-L82 PolarHBondContact O-N 2.98Å; V62-L82 HydrophobicContact CG1-CD1 3.93Å; V62-L82 HydrophobicContact CG1-CG 4.43Å; V62-L82 HydrophobicContact CG2-CD1 4.48Å; V62-L82 HydrophobicContact CG2-CD2 3.93Å; V62-L82 HydrophobicContact CG2-CG 4.26Å; L82-V88 HydrophobicContact CD2-CB 4.01Å; L82-V88 HydrophobicContact CD2-CG1 3.54Å
83	P	80.4	Confident	85.2	Confident	47 Å²	47	57.6 Å²	57.6	31%	0.305	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-72.1	158.2	170.1	33.1	-35.8	0	0	0	110.7	S85 G86 S87 V88	P83-S85 PolarHBondContact O-N 3.38Å; P83-G86 PolarHBondContact O-N 3.01Å; P83-S87 WeakPolarHBondContact CG-O 3.42Å; P83-V88 HydrophobicContact CG-CB 4.35Å; P83-V88 HydrophobicContact CG-CG2 4.16Å
84	P	71.4	Confident	85.7	Confident	148 Å²	148	53.3 Å²	53.3	96%	0.961	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-10.3	180	-25.4	35.3	0	0	0	115.9	G86	P84-G86 VanDerWaalsContact C-N 3.32Å
85	S	71.7	Confident	85.8	Confident	85 Å²	85	52.6 Å²	52.6	59%	0.594	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-6.5	174.4	51.4	0	0	0	0	114.4	P83 S87	P83-S85 PolarHBondContact O-N 3.38Å; S85-S87 PolarHBondContact O-N 3.05Å
86	G	67.3	Low	85.9	Confident	11 Å²	11	51.6 Å²	51.6	11%	0.113	30%	0.298	C	S	.	.	S	Bend	trans	73.9	-35.8	179.9	0	0	0	0	0	114.9	V51 P83 P84	V51-G86 WeakPolarHBondContact CG1-O 3.37Å; P83-G86 PolarHBondContact O-N 3.01Å; P84-G86 VanDerWaalsContact C-N 3.32Å
87	S	74.1	Confident	85.9	Confident	60 Å²	60	50 Å²	50	42%	0.42	30%	0.298	S	S	.	.			trans	-74.4	138.2	169.4	54.7	0	0	0	0	111.6	V51 P83 S85	V51-S87 WeakPolarHBondContact O-CA 3.25Å; V51-S87 WeakPolarHBondContact O-CB 3.37Å; P83-S87 WeakPolarHBondContact CG-O 3.42Å; S85-S87 PolarHBondContact O-N 3.05Å
88	V	83.1	Confident	85.8	Confident	22 Å²	22	49.9 Å²	49.9	13%	0.133	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	146.9	174.4	85.1	0	0	0	0	111	V50 V51 L82 P83 T90	V50-V88 CarbonylContact C-O 3.55Å; V50-V88 WeakPolarHBondContact CA-O 3.49Å; V51-V88 HydrophobicContact CB-CG1 4.09Å; V51-V88 HydrophobicContact CG2-CG1 3.87Å; V51-V88 PolarHBondContact N-O 3.01Å; V51-V88 PolarHBondContact O-N 2.93Å; L82-V88 HydrophobicContact CD2-CB 4.01Å; L82-V88 HydrophobicContact CD2-CG1 3.54Å; P83-V88 HydrophobicContact CG-CB 4.35Å; P83-V88 HydrophobicContact CG-CG2 4.16Å; V88-T90 WeakPolarHBondContact CG2-OG1 3.36Å
89	E	89.4	Confident	85.9	Confident	133 Å²	133	49.3 Å²	49.3	62%	0.621	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	120.9	167.2	-173.1	173.2	164.1	0	0	106.8	K48 V50	K48-E89 VanDerWaalsContact CE-CG 3.43Å; K48-E89 WeakPolarHBondContact CE-OE1 3.32Å; K48-E89 IonicContact NZ-OE1 2.76Å; K48-E89 PolarHBondContact NZ-OE1 2.78Å; V50-E89 HydrophobicContact CG2-CG 4.43Å
90	T	88.3	Confident	86	Confident	37 Å²	37	46 Å²	46	23%	0.227	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	116.9	-171.2	-62.9	0	0	0	0	110.1	K48 L49 I80 V88 L92	K48-T90 CarbonylContact C-O 3.45Å; K48-T90 WeakPolarHBondContact CA-O 3.3Å; L49-T90 PolarHBondContact N-O 3.46Å; L49-T90 PolarHBondContact O-N 2.8Å; I80-T90 HydrophobicContact CG2-CG2 4.21Å; V88-T90 WeakPolarHBondContact CG2-OG1 3.36Å; T90-L92 HydrophobicContact CG2-CD2 4.36Å
91	D	90.7	Very high	85.9	Confident	94 Å²	94	46.5 Å²	46.5	50%	0.503	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	141.4	168.6	-72.1	-28.7	0	0	0	110	P19	P19-D91 WeakPolarHBondContact CB-O 3.04Å; P19-D91 HydrophobicContact CG-CB 4.25Å; P19-D91 WeakPolarHBondContact CG-O 3.46Å
92	L	91.6	Very high	86.1	Confident	13 Å²	13	41.8 Å²	41.8	7%	0.068	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	153.3	-178.7	-60.1	178.2	0	0	0	110.4	L46 K47 L49 I64 I80 T90 L94 I169	L46-L92 HydrophobicContact CB-CD1 3.93Å; L46-L92 CarbonylContact O-C 3.53Å; L46-L92 VanDerWaalsContact O-CB 3.26Å; L46-L92 WeakPolarHBondContact O-CB 3.23Å; K47-L92 WeakPolarHBondContact CA-O 3.44Å; K47-L92 PolarHBondContact O-N 3.42Å; L49-L92 HydrophobicContact CB-CD1 4.08Å; L49-L92 HydrophobicContact CB-CD2 4.45Å; L49-L92 HydrophobicContact CB-CG 4.36Å; I64-L92 HydrophobicContact CD1-CD1 3.61Å; I64-L92 HydrophobicContact CD1-CD2 4.01Å; I64-L92 HydrophobicContact CD1-CG 4.48Å; I80-L92 HydrophobicContact CD1-CD2 3.81Å; T90-L92 HydrophobicContact CG2-CD2 4.36Å; L92-L94 HydrophobicContact CB-CG 4.28Å; L92-L94 HydrophobicContact CD1-CD1 4.31Å; L92-L94 HydrophobicContact CD2-CD1 4.19Å; L92-L94 HydrophobicContact CD2-CG 4.41Å; L92-I169 HydrophobicContact CD1-CD1 4.19Å; L92-I169 HydrophobicContact CD1-CG1 4.28Å
93	A	89.6	Confident	86.2	Confident	29 Å²	29	43.8 Å²	43.8	24%	0.24	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	54	166.5	0	0	0	0	0	108.6	P19 P21 M22	P19-A93 HydrophobicContact CB-CB 4.28Å; P19-A93 HydrophobicContact CG-CB 4Å; P21-A93 WeakPolarHBondContact CA-O 3.44Å; P21-A93 HydrophobicContact CB-CB 4.2Å; P21-A93 HydrophobicContact CG-CB 4.2Å; M22-A93 PolarHBondContact N-O 3.11Å
94	L	93.7	Very high	86.3	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	124.9	-175.6	-55.7	-176.7	0	0	0	110.5	M22 L46 I64 L92 F96	M22-L94 HydrophobicContact CB-CD2 3.77Å; M22-L94 HydrophobicContact CG-CD2 4.18Å; M22-L94 WeakPolarHBondContact O-CA 3.45Å; M22-L94 HydrophobicContact SD-CD2 4.24Å; L46-L94 HydrophobicContact CB-CB 4.38Å; L46-L94 PolarHBondContact N-O 3.26Å; L46-L94 PolarHBondContact O-N 2.8Å; I64-L94 HydrophobicContact CB-CD1 4.29Å; I64-L94 HydrophobicContact CD1-CD1 3.63Å; L92-L94 HydrophobicContact CB-CG 4.28Å; L92-L94 HydrophobicContact CD1-CD1 4.31Å; L92-L94 HydrophobicContact CD2-CD1 4.19Å; L92-L94 HydrophobicContact CD2-CG 4.41Å; L94-F96 HydrophobicContact CB-CD2 4.45Å; L94-F96 HydrophobicContact CB-CE2 3.68Å; L94-F96 HydrophobicContact CB-CZ 4.35Å; L94-F96 HydrophobicContact CD1-CE2 4.24Å; L94-F96 HydrophobicContact CD1-CZ 4.25Å
95	T	93.8	Very high	86.6	Confident	39 Å²	39	48.2 Å²	48.2	24%	0.239	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131.6	173	-34.3	0	0	0	0	109.2	M22 N23 L24 L44	M22-T95 PolarHBondContact O-N 3.28Å; N23-T95 CarbonylContact C-O 3.59Å; N23-T95 WeakPolarHBondContact CA-O 3.4Å; N23-T95 WeakPolarHBondContact OD1-CB 3.36Å; N23-T95 PolarHBondContact OD1-OG1 3.19Å; L24-T95 PolarHBondContact N-O 3.36Å; L44-T95 CarbonylContact O-C 3.5Å; L44-T95 WeakPolarHBondContact O-CA 3.36Å
96	F	94.9	Very high	86.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	127.4	176.1	-58.8	-104.3	0	0	0	109	L24 S43 L44 L46 I64 V66 L75 L94	L24-F96 HydrophobicContact CB-CD1 4.04Å; L24-F96 HydrophobicContact CB-CE1 4.45Å; L24-F96 HydrophobicContact CD1-CD1 3.79Å; L24-F96 HydrophobicContact CD1-CE1 3.34Å; L24-F96 HydrophobicContact CD1-CZ 3.82Å; L24-F96 CarbonylContact O-C 3.55Å; L24-F96 WeakPolarHBondContact O-CA 3.3Å; S43-F96 WeakPolarHBondContact CA-O 3.43Å; L44-F96 HydrophobicContact CB-CB 4.29Å; L44-F96 HydrophobicContact CD2-CB 4.4Å; L44-F96 HydrophobicContact CD2-CD2 4.08Å; L44-F96 HydrophobicContact CD2-CG 4.43Å; L44-F96 PolarHBondContact N-O 3.08Å; L44-F96 PolarHBondContact O-N 3.35Å; L46-F96 HydrophobicContact CD1-CD2 4.22Å; L46-F96 HydrophobicContact CD1-CE2 3.61Å; L46-F96 HydrophobicContact CD1-CZ 4.41Å; L46-F96 HydrophobicContact CG-CD2 4.44Å; L46-F96 HydrophobicContact CG-CE2 4.17Å; I64-F96 HydrophobicContact CG2-CZ 3.99Å; V66-F96 HydrophobicContact CB-CD1 3.71Å; V66-F96 HydrophobicContact CB-CE1 3.89Å; V66-F96 HydrophobicContact CB-CG 4.25Å; V66-F96 HydrophobicContact CG1-CD1 4.43Å; V66-F96 HydrophobicContact CG2-CD1 3.62Å; V66-F96 HydrophobicContact CG2-CD2 4.14Å; V66-F96 HydrophobicContact CG2-CE1 3.46Å; V66-F96 VanDerWaalsContact CG2-CE1 3.46Å; V66-F96 HydrophobicContact CG2-CE2 4.02Å; V66-F96 HydrophobicContact CG2-CG 3.96Å; V66-F96 HydrophobicContact CG2-CZ 3.68Å; L75-F96 HydrophobicContact CB-CD1 3.81Å; L75-F96 HydrophobicContact CB-CE1 4.19Å; L75-F96 HydrophobicContact CD1-CB 4.27Å; L75-F96 HydrophobicContact CD1-CD1 4.06Å; L94-F96 HydrophobicContact CB-CD2 4.45Å; L94-F96 HydrophobicContact CB-CE2 3.68Å; L94-F96 HydrophobicContact CB-CZ 4.35Å; L94-F96 HydrophobicContact CD1-CE2 4.24Å; L94-F96 HydrophobicContact CD1-CZ 4.25Å
97	S	92.6	Very high	86.5	Confident	40 Å²	40	60.1 Å²	60.1	28%	0.28	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	112.5	175.6	-67.1	0	0	0	0	109.2	L24 F25 A26 C42	L24-S97 PolarHBondContact O-N 2.87Å; F25-S97 CarbonylContact C-O 3.59Å; F25-S97 VanDerWaalsContact CA-O 3.23Å; F25-S97 WeakPolarHBondContact CA-O 3.35Å; A26-S97 PolarHBondContact N-O 3.26Å; C42-S97 CarbonylContact O-C 3.33Å; C42-S97 WeakPolarHBondContact O-CA 3.48Å
98	L	92.1	Very high	86.5	Confident	10 Å²	10	58.1 Å²	58.1	5%	0.052	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	127.3	-174.5	61.9	98	0	0	0	111.3	A26 C42 V66 I68 L75 Y100 L111	A26-L98 HydrophobicContact CB-CB 4.39Å; A26-L98 WeakPolarHBondContact O-CA 3.46Å; C42-L98 HydrophobicContact CB-CD1 3.74Å; C42-L98 HydrophobicContact CB-CG 3.87Å; C42-L98 PolarHBondContact N-O 2.87Å; C42-L98 PolarHBondContact O-N 3.02Å; V66-L98 HydrophobicContact CG1-CD2 3.86Å; I68-L98 HydrophobicContact CD1-CD1 4.14Å; I68-L98 HydrophobicContact CG1-CD1 3.43Å; I68-L98 VanDerWaalsContact CG1-CD1 3.43Å; L75-L98 HydrophobicContact CD1-CB 4.29Å; L98-Y100 HydrophobicContact CD1-CD1 4.07Å; L98-Y100 HydrophobicContact CD1-CG 4.35Å; L98-L111 HydrophobicContact CD2-CD1 3.85Å
99	Q	90.8	Very high	86.8	Confident	59 Å²	59	57.7 Å²	57.7	28%	0.276	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	139.1	169.1	-62.3	-179.1	-32.9	0	0	109.2	A26 T27 W28 R40 L41 I179	A26-Q99 PolarHBondContact O-N 3.43Å; T27-Q99 VanDerWaalsContact CB-OE1 3.3Å; W28-Q99 HydrophobicContact CB-CB 3.92Å; R40-Q99 CarbonylContact O-C 3.49Å; R40-Q99 VanDerWaalsContact O-CA 3.32Å; R40-Q99 WeakPolarHBondContact O-CA 3.49Å; L41-Q99 HydrophobicContact CD1-CG 4.07Å; Q99-I179 HydrophobicContact CB-CD1 4.07Å; Q99-I179 HydrophobicContact CG-CD1 3.76Å
100	Y	89.6	Confident	86.9	Confident	6 Å²	6	54.1 Å²	54.1	2%	0.024	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	150.3	178.9	74.6	-68.8	0	0	0	112.1	R40 C42 I68 L98 H102 M139 S176	R40-Y100 HydrophobicContact CB-CD1 4.18Å; R40-Y100 HydrophobicContact CB-CE1 3.66Å; R40-Y100 PolarHBondContact N-O 2.75Å; R40-Y100 WeakPolarHBondContact O-CD1 3.43Å; R40-Y100 PolarHBondContact O-N 3.38Å; C42-Y100 HydrophobicContact CB-CD1 3.96Å; C42-Y100 HydrophobicContact CB-CE1 3.65Å; I68-Y100 HydrophobicContact CD1-CD2 3.79Å; I68-Y100 HydrophobicContact CD1-CE2 3.98Å; I68-Y100 HydrophobicContact CD1-CG 4.07Å; I68-Y100 HydrophobicContact CG1-CD1 4.48Å; I68-Y100 HydrophobicContact CG1-CD2 3.91Å; I68-Y100 HydrophobicContact CG1-CG 3.84Å; I68-Y100 HydrophobicContact CG2-CD2 4.11Å; L98-Y100 HydrophobicContact CD1-CD1 4.07Å; L98-Y100 HydrophobicContact CD1-CG 4.35Å; Y100-H102 HydrophobicContact CE2-CB 3.95Å; Y100-H102 AromaticContact CE2-ND1 3.93Å; Y100-H102 PolarHBondContact OH-ND1 2.78Å; Y100-M139 HydrophobicContact CE2-CB 4.31Å; Y100-M139 HydrophobicContact CE2-CG 4.4Å; Y100-M139 WeakPolarHBondContact OH-CB 3.47Å; Y100-S176 PolarHBondContact OH-OG 2.74Å
101	P	88.5	Confident	87.2	Confident	20 Å²	20	52.4 Å²	52.4	13%	0.13	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	123.8	165.4	29.3	-31.8	0	0	0	110	W28 C37 F103	W28-P101 HydrophobicContact CZ2-CG 4.42Å; C37-P101 HydrophobicContact CB-CB 3.87Å; C37-P101 VanDerWaalsContact SG-CB 3.6Å; P101-F103 HydrophobicContact CB-CE2 4.14Å; P101-F103 HydrophobicContact CB-CZ 4.16Å; P101-F103 HydrophobicContact CG-CE2 3.95Å; P101-F103 HydrophobicContact CG-CZ 4.09Å
102	H	89.4	Confident	87.4	Confident	12 Å²	12	48.6 Å²	48.6	6%	0.056	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	110.5	170.1	-168.9	122.5	0	0	0	109.1	C37 I38 R40 Y100 N109 M143	C37-H102 CarbonylContact C-O 3.52Å; C37-H102 WeakPolarHBondContact CA-O 3.44Å; C37-H102 WeakPolarHBondContact CB-O 3.3Å; I38-H102 PolarHBondContact N-O 3.22Å; I38-H102 PolarHBondContact O-N 3.1Å; R40-H102 HydrophobicContact CG-CB 3.98Å; Y100-H102 HydrophobicContact CE2-CB 3.95Å; Y100-H102 AromaticContact CE2-ND1 3.93Å; Y100-H102 PolarHBondContact OH-ND1 2.78Å; H102-N109 PolarHBondContact CD2-ND2 3.14Å; H102-N109 VanDerWaalsContact CD2-ND2 3.31Å; H102-N109 PolarHBondContact NE2-ND2 2.97Å; H102-M143 PolarHBondContact CE1-SD 3.15Å; H102-M143 PolarHBondContact ND1-SD 3.18Å
103	F	87.8	Confident	87.6	Confident	53 Å²	53	48 Å²	48	23%	0.232	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	130.4	-177.3	-64.6	-86.4	0	0	0	111.7	N36 C37 P101 R106 N109	N36-F103 WeakPolarHBondContact O-CA 3.47Å; C37-F103 HydrophobicContact CB-CD1 3.63Å; C37-F103 HydrophobicContact CB-CE1 3.85Å; C37-F103 HydrophobicContact CB-CG 4.03Å; C37-F103 HydrophobicContact CB-CZ 4.44Å; P101-F103 HydrophobicContact CB-CE2 4.14Å; P101-F103 HydrophobicContact CB-CZ 4.16Å; P101-F103 HydrophobicContact CG-CE2 3.95Å; P101-F103 HydrophobicContact CG-CZ 4.09Å; F103-R106 HydrophobicContact CB-CB 3.95Å; F103-R106 HydrophobicContact CG-CB 4.38Å; F103-N109 PolarHBondContact N-OD1 3.39Å; F103-N109 PolarHBondContact O-ND2 2.87Å
104	L	83.1	Confident	87.9	Confident	117 Å²	117	46.8 Å²	46.8	61%	0.613	22%	0.224	S	C	*	.	S	Bend	trans	-80.7	-19.6	-177.5	-63.3	178	0	0	0	114.1	N36 I38	N36-L104 PolarHBondContact O-N 2.98Å; I38-L104 HydrophobicContact CD1-CD1 4.23Å; I38-L104 HydrophobicContact CD1-CD2 3.97Å; I38-L104 HydrophobicContact CD1-CG 4.43Å; I38-L104 HydrophobicContact CG1-CD1 4.35Å; I38-L104 HydrophobicContact CG1-CD2 4.4Å; I38-L104 HydrophobicContact CG1-CG 4.45Å
105	K	77.3	Confident	88	Confident	172 Å²	172	46.8 Å²	46.8	75%	0.748	22%	0.224	S	C	*	.	S	Bend	trans	-129.3	7.1	-172.1	-63.9	-177.1	178.5	176.1	0	114.7
106	R	69.6	Low	88	Confident	169 Å²	169	45.4 Å²	45.4	64%	0.638	22%	0.215	S	C	*	.	S	Bend	trans	-126.5	134.8	-177.5	-68.2	-176.7	173.3	-176	-4	110.5	F103 G108	F103-R106 HydrophobicContact CB-CB 3.95Å; F103-R106 HydrophobicContact CG-CB 4.38Å; R106-G108 PolarHBondContact O-N 3.39Å
107	E	67.6	Low	87.8	Confident	177 Å²	177	48.9 Å²	48.9	83%	0.827	23%	0.228	S	C	*	.	S	Bend	trans	-62.9	133.3	162.7	-71.1	-159.7	-143	0	0	110.2	K110	E107-K110 IonicContact OE2-NZ 3.96Å
108	G	72.8	Confident	87.5	Confident	17 Å²	17	51.7 Å²	51.7	18%	0.175	23%	0.233	C	C	.	.			trans	152.3	-12.2	-177.1	0	0	0	0	0	115.4	R106 K110	R106-G108 PolarHBondContact O-N 3.39Å; G108-K110 PolarHBondContact O-N 3.32Å
109	N	89.1	Confident	87.1	Confident	14 Å²	14	55.3 Å²	55.3	8%	0.075	25%	0.248	C	C	.	.			trans	-72.4	35.5	179.8	-55.4	-40.4	0	0	0	113.8	H102 F103 M139	H102-N109 PolarHBondContact CD2-ND2 3.14Å; H102-N109 VanDerWaalsContact CD2-ND2 3.31Å; H102-N109 PolarHBondContact NE2-ND2 2.97Å; F103-N109 PolarHBondContact N-OD1 3.39Å; F103-N109 PolarHBondContact O-ND2 2.87Å; N109-M139 HydrophobicContact CB-CB 4.48Å; N109-M139 WeakPolarHBondContact O-CB 3.39Å; N109-M139 WeakPolarHBondContact O-CG 3.2Å; N109-M139 PolarHBondContact O-N 3.02Å
110	K	93.3	Very high	85.9	Confident	58 Å²	58	62.3 Å²	62.3	25%	0.252	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	123.8	-173	-68	172.6	-179.6	166.5	0	110.6	Q69 E107 G108 I137 D138	Q69-K110 HydrophobicContact CB-CB 4.37Å; Q69-K110 WeakPolarHBondContact CB-O 3.34Å; Q69-K110 PolarHBondContact N-O 2.83Å; E107-K110 IonicContact OE2-NZ 3.96Å; G108-K110 PolarHBondContact O-N 3.32Å; K110-I137 CarbonylContact C-O 3.58Å; K110-I137 VanDerWaalsContact CA-O 3.29Å; K110-I137 WeakPolarHBondContact CA-O 3.5Å; K110-D138 WeakPolarHBondContact CE-OD2 3.29Å; K110-D138 HydrophobicContact CG-CB 4.48Å; K110-D138 IonicContact NZ-OD2 2.68Å
111	L	94.8	Very high	84.7	Confident	0 Å²	0	68 Å²	68	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	117.4	176.5	179.1	67.2	0	0	0	109.4	L44 V66 I68 L98 S136 I137 M139 L174	L44-L111 HydrophobicContact CD2-CD2 4.37Å; V66-L111 HydrophobicContact CG1-CD1 3.67Å; V66-L111 HydrophobicContact CG1-CG 4.46Å; I68-L111 HydrophobicContact CD1-CB 4.03Å; I68-L111 HydrophobicContact CD1-CD1 3.95Å; I68-L111 HydrophobicContact CG1-CD1 4.36Å; L98-L111 HydrophobicContact CD2-CD1 3.85Å; L111-S136 CarbonylContact O-C 3.55Å; L111-S136 VanDerWaalsContact O-CA 3.3Å; L111-S136 WeakPolarHBondContact O-CA 3.45Å; L111-I137 HydrophobicContact CB-CB 4.5Å; L111-I137 HydrophobicContact CD2-CD1 4.49Å; L111-I137 PolarHBondContact N-O 2.9Å; L111-I137 PolarHBondContact O-N 2.95Å; L111-M139 HydrophobicContact CB-CG 3.95Å; L111-M139 HydrophobicContact CB-SD 3.54Å; L111-M139 VanDerWaalsContact CB-SD 3.54Å; L111-M139 HydrophobicContact CD2-SD 3.83Å; L111-M139 HydrophobicContact CG-SD 4.28Å; L111-L174 HydrophobicContact CD2-CD1 3.87Å; L111-L174 HydrophobicContact CD2-CD2 4.16Å
112	Q	94.6	Very high	83.3	Confident	14 Å²	14	77.2 Å²	77.2	7%	0.065	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	120.6	-178	-66	-177.1	-12.8	0	0	110.4	V66 K67 M134 G135	V66-Q112 WeakPolarHBondContact CA-O 3.34Å; K67-Q112 HydrophobicContact CG-CB 4.2Å; K67-Q112 PolarHBondContact N-O 3.4Å; K67-Q112 VanDerWaalsContact N-O 3.08Å; K67-Q112 PolarHBondContact O-N 2.83Å; Q112-M134 HydrophobicContact CB-CG 4.49Å; Q112-M134 HydrophobicContact CB-SD 4.08Å; Q112-M134 HydrophobicContact CG-SD 4.1Å; Q112-G135 WeakPolarHBondContact CA-O 3.31Å
113	I	95.9	Very high	81.6	Confident	0 Å²	0	84.3 Å²	84.3	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	125.9	173.2	-54.5	-177.8	0	0	0	107.7	L44 L46 I64 V66 M134 G135 I137 L153 I169 I171	L44-I113 HydrophobicContact CD1-CD1 4.21Å; L44-I113 HydrophobicContact CD2-CD1 3.72Å; L44-I113 HydrophobicContact CD2-CG1 4.28Å; L46-I113 HydrophobicContact CD2-CD1 4.28Å; I64-I113 HydrophobicContact CG2-CG2 4.24Å; V66-I113 HydrophobicContact CG2-CG1 4.33Å; V66-I113 HydrophobicContact CG2-CG2 4.37Å; I113-M134 CarbonylContact O-C 3.56Å; I113-M134 WeakPolarHBondContact O-CA 3.08Å; I113-G135 PolarHBondContact N-O 3.37Å; I113-G135 PolarHBondContact O-N 3.11Å; I113-I137 HydrophobicContact CD1-CD1 4.26Å; I113-L153 HydrophobicContact CB-CD2 4.08Å; I113-L153 HydrophobicContact CD1-CD2 3.83Å; I113-L153 HydrophobicContact CG1-CD2 4.19Å; I113-I169 HydrophobicContact CG2-CD1 4.19Å; I113-I169 HydrophobicContact CG2-CG2 4.31Å; I113-I171 HydrophobicContact CD1-CD1 4.49Å
114	M	95.8	Very high	80.3	Confident	5 Å²	5	90.1 Å²	90.1	3%	0.025	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	145.5	-170.4	-63.8	162.7	-75.2	0	0	111.5	I64 A65 K67 I74 Q116 T131 A133 M134	I64-M114 CarbonylContact C-O 3.59Å; I64-M114 WeakPolarHBondContact CA-O 3.45Å; A65-M114 HydrophobicContact CB-CB 4.33Å; A65-M114 HydrophobicContact CB-CE 4.09Å; A65-M114 PolarHBondContact N-O 3.06Å; A65-M114 PolarHBondContact O-N 3.09Å; K67-M114 HydrophobicContact CB-CE 4.49Å; K67-M114 HydrophobicContact CD-CE 3.99Å; K67-M114 HydrophobicContact CG-CE 3.77Å; I74-M114 HydrophobicContact CG2-CE 4.18Å; M114-Q116 HydrophobicContact CB-CG 4.19Å; M114-T131 HydrophobicContact CB-CG2 4.07Å; M114-T131 HydrophobicContact CG-CG2 4.07Å; M114-A133 CarbonylContact C-O 3.52Å; M114-A133 VanDerWaalsContact CA-O 3.3Å; M114-A133 WeakPolarHBondContact CA-O 3.31Å; M114-M134 HydrophobicContact CG-CB 4.1Å; M114-M134 HydrophobicContact CG-CG 3.71Å; M114-M134 HydrophobicContact CG-SD 3.92Å; M114-M134 HydrophobicContact SD-SD 4.37Å
115	L	95	Very high	78.9	Confident	0 Å²	0	91.2 Å²	91.2	0%	0	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	129.7	160	-59.6	-178.9	0	0	0	108.9	L49 V51 L55 I64 T131 L132 A133 L155 A167	L49-L115 HydrophobicContact CD1-CD1 4.2Å; L49-L115 HydrophobicContact CD1-CD2 4.06Å; L49-L115 HydrophobicContact CD2-CD2 4.06Å; V51-L115 HydrophobicContact CG2-CD1 4.35Å; L55-L115 HydrophobicContact CD1-CD1 3.68Å; I64-L115 HydrophobicContact CG1-CD2 3.75Å; L115-T131 WeakPolarHBondContact O-CA 3.43Å; L115-L132 PolarHBondContact O-N 3.26Å; L115-A133 HydrophobicContact CB-CB 4.41Å; L115-A133 HydrophobicContact CD1-CB 4.36Å; L115-A133 PolarHBondContact N-O 3.08Å; L115-L155 HydrophobicContact CD1-CD1 4.11Å; L115-L155 HydrophobicContact CD2-CD1 4.29Å; L115-L155 HydrophobicContact CG-CD1 3.87Å; L115-A167 HydrophobicContact CD1-CB 3.78Å
116	Q	93.9	Very high	77.9	Confident	10 Å²	10	88.1 Å²	88.1	5%	0.047	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	134.6	-177.4	-55.7	-158.9	-42.5	0	0	113.1	V63 A65 M114 Y129 K130 T131	V63-Q116 PolarHBondContact N-O 3.09Å; V63-Q116 PolarHBondContact O-N 3.47Å; A65-Q116 HydrophobicContact CB-CG 3.86Å; M114-Q116 HydrophobicContact CB-CG 4.19Å; Q116-Y129 HydrophobicContact CB-CD1 4.17Å; Q116-K130 CarbonylContact C-O 3.49Å; Q116-K130 WeakPolarHBondContact CA-O 3.22Å; Q116-T131 PolarHBondContact NE2-OG1 3.16Å
117	R	90.4	Very high	77.4	Confident	74 Å²	74	83 Å²	83	28%	0.279	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	136.4	162.9	179.2	165.8	70.2	-162.3	-3.2	109.8	D56 K57 L59 Y129 K130 L132	D56-R117 IonicContact OD1-CZ 3.91Å; D56-R117 VanDerWaalsContact OD1-CZ 3.29Å; D56-R117 IonicContact OD1-NH1 2.93Å; D56-R117 PolarHBondContact OD1-NH1 2.82Å; D56-R117 IonicContact OD1-NH2 3.29Å; D56-R117 PolarHBondContact OD1-NH2 3.27Å; D56-R117 IonicContact OD2-CZ 3.29Å; D56-R117 VanDerWaalsContact OD2-CZ 3.28Å; D56-R117 IonicContact OD2-NE 3.14Å; D56-R117 IonicContact OD2-NH1 2.93Å; D56-R117 IonicContact OD2-NH2 2.93Å; D56-R117 PolarHBondContact OD2-NH2 2.87Å; K57-R117 PolarHBondContact O-NH1 3.39Å; K57-R117 VanDerWaalsContact O-NH1 3.08Å; L59-R117 HydrophobicContact CD1-CB 3.92Å; L59-R117 HydrophobicContact CD1-CG 3.95Å; R117-Y129 CarbonylContact O-C 3.53Å; R117-Y129 WeakPolarHBondContact O-CA 3.27Å; R117-K130 PolarHBondContact N-O 2.91Å; R117-K130 PolarHBondContact O-N 3.25Å; R117-L132 HydrophobicContact CB-CD1 4.11Å; R117-L132 HydrophobicContact CB-CD2 4.23Å; R117-L132 HydrophobicContact CB-CG 4.31Å
118	R	86.3	Confident	78	Confident	98 Å²	98	75.6 Å²	75.6	37%	0.37	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	122.5	173.7	-167.8	174.3	-176.7	-174	2.4	110.3	E79 L127 Y129	E79-R118 WeakPolarHBondContact OE1-CD 3.44Å; E79-R118 IonicContact OE1-CZ 2.89Å; E79-R118 IonicContact OE1-NE 3.28Å; E79-R118 IonicContact OE1-NH1 3.6Å; E79-R118 PolarHBondContact OE1-NH1 2.71Å; R118-L127 HydrophobicContact CG-CD2 4.22Å; R118-L127 VanDerWaalsContact NE-CD2 3.32Å; R118-Y129 HydrophobicContact CB-CD1 4.34Å; R118-Y129 HydrophobicContact CB-CE1 4.07Å; R118-Y129 HydrophobicContact CG-CE1 4.03Å
119	K	83.4	Confident	78.8	Confident	86 Å²	86	78.6 Å²	78.6	37%	0.374	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-86.2	133.6	173.2	-66.2	-172.2	-179.2	-176.3	0	109.9	Y121 G128	K119-Y121 HydrophobicContact CB-CE2 3.99Å; K119-Y121 HydrophobicContact CD-CE2 4.28Å; K119-Y121 WeakPolarHBondContact CD-OH 3.42Å; K119-G128 PolarHBondContact N-O 3.14Å
120	R	65.1	Low	78.9	Confident	207 Å²	207	82.1 Å²	82.1	78%	0.781	37%	0.371	S	S	*	.			trans	-108.3	121.2	166.4	-69.5	-177.4	-179.9	-119.5	5.4	109	L127	R120-L127 HydrophobicContact CG-CD2 4.25Å
121	Y	65.4	Low	78.9	Confident	125 Å²	125	82.1 Å²	82.1	49%	0.49	38%	0.376	S	S	.	.			trans	-95.9	137.4	170.2	-64.4	-85.4	0	0	0	108.4	K119 N123	K119-Y121 HydrophobicContact CB-CE2 3.99Å; K119-Y121 HydrophobicContact CD-CE2 4.28Å; K119-Y121 WeakPolarHBondContact CD-OH 3.42Å; Y121-N123 VanDerWaalsContact C-N 3.29Å; Y121-N123 PolarHBondContact O-N 3.21Å
122	K	58.1	Low	78.8	Confident	213 Å²	213	82.5 Å²	82.5	93%	0.926	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-37.1	-175.9	-72.4	-175.1	177.1	178.9	0	112.7
123	N	55.2	Low	78.8	Confident	162 Å²	162	81.9 Å²	81.9	87%	0.866	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.8	19.9	-167.4	-62.2	-0.6	0	0	0	115	Y121	Y121-N123 VanDerWaalsContact C-N 3.29Å; Y121-N123 PolarHBondContact O-N 3.21Å
124	R	59	Low	78.7	Confident	174 Å²	174	83.7 Å²	83.7	66%	0.657	38%	0.384	S	S	*	.			trans	-135.8	133.8	177	-157.4	174.8	-173	176.3	2.6	111.4	I126	R124-I126 HydrophobicContact CG-CB 4.42Å; R124-I126 PolarHBondContact O-N 3.46Å
125	T	54.4	Low	78.6	Confident	141 Å²	141	83.9 Å²	83.9	87%	0.865	39%	0.387	S	S	*	.	S	Bend	trans	-72.2	-8.9	179.3	44.3	0	0	0	0	114.2
126	I	55.5	Low	78.5	Confident	106 Å²	106	86.8 Å²	86.8	54%	0.544	41%	0.407	S	S	.	.			trans	-91.6	116.4	177.4	-52.8	178.2	0	0	0	109	R124	R124-I126 HydrophobicContact CG-CB 4.42Å; R124-I126 PolarHBondContact O-N 3.46Å
127	L	59.9	Low	78.5	Confident	61 Å²	61	86.7 Å²	86.7	32%	0.319	41%	0.407	S	S	.	.			trans	-91.7	114.8	176.8	-76.7	76.6	0	0	0	110.2	R118 R120	R118-L127 HydrophobicContact CG-CD2 4.22Å; R118-L127 VanDerWaalsContact NE-CD2 3.32Å; R120-L127 HydrophobicContact CG-CD2 4.25Å
128	G	80.5	Confident	78.5	Confident	23 Å²	23	85.6 Å²	85.6	24%	0.237	41%	0.407	C	S	.	.			trans	-78.3	176.3	174.1	0	0	0	0	0	113	K119	K119-G128 PolarHBondContact N-O 3.14Å
129	Y	90.2	Very high	78.8	Confident	80 Å²	80	80.9 Å²	80.9	31%	0.314	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	148.7	175.7	-67.8	-93.4	0	0	0	110.2	V63 Q116 R117 R118	V63-Y129 HydrophobicContact CG2-CE1 4.48Å; Q116-Y129 HydrophobicContact CB-CD1 4.17Å; R117-Y129 CarbonylContact O-C 3.53Å; R117-Y129 WeakPolarHBondContact O-CA 3.27Å; R118-Y129 HydrophobicContact CB-CD1 4.34Å; R118-Y129 HydrophobicContact CB-CE1 4.07Å; R118-Y129 HydrophobicContact CG-CE1 4.03Å
130	K	91.3	Very high	79.1	Confident	87 Å²	87	78.4 Å²	78.4	38%	0.378	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	121.4	169.2	-177.8	-169.7	170.4	-169.7	0	107.7	D56 Q116 R117 L132	D56-K130 IonicContact OD2-NZ 2.8Å; D56-K130 PolarHBondContact OD2-NZ 3.22Å; Q116-K130 CarbonylContact C-O 3.49Å; Q116-K130 WeakPolarHBondContact CA-O 3.22Å; R117-K130 PolarHBondContact N-O 2.91Å; R117-K130 PolarHBondContact O-N 3.25Å; K130-L132 HydrophobicContact CD-CD2 3.8Å; K130-L132 HydrophobicContact CG-CD2 4.1Å
131	T	92.8	Very high	80.2	Confident	58 Å²	58	74 Å²	74	36%	0.356	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	134.4	166.9	-61.8	0	0	0	0	109.3	M114 L115 Q116 A133 M134	M114-T131 HydrophobicContact CB-CG2 4.07Å; M114-T131 HydrophobicContact CG-CG2 4.07Å; L115-T131 WeakPolarHBondContact O-CA 3.43Å; Q116-T131 PolarHBondContact NE2-OG1 3.16Å; T131-A133 WeakPolarHBondContact CG2-O 3.34Å; T131-M134 HydrophobicContact CG2-CB 4.35Å
132	L	92.4	Very high	81.4	Confident	8 Å²	8	68.1 Å²	68.1	4%	0.042	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	-32.8	178.3	-54.3	-175.6	0	0	0	112.4	L55 D56 L59 V62 L115 R117 K130 S157	L55-L132 HydrophobicContact CB-CB 4.22Å; L55-L132 HydrophobicContact CB-CD1 3.89Å; D56-L132 HydrophobicContact CB-CD1 4.18Å; D56-L132 HydrophobicContact CB-CD2 4Å; D56-L132 WeakPolarHBondContact OD2-CD2 3.29Å; L59-L132 HydrophobicContact CD1-CD1 3.76Å; L59-L132 HydrophobicContact CD2-CD1 3.46Å; L59-L132 VanDerWaalsContact CD2-CD1 3.46Å; L59-L132 HydrophobicContact CG-CD1 4.29Å; V62-L132 HydrophobicContact CG1-CD1 4.2Å; L115-L132 PolarHBondContact O-N 3.26Å; R117-L132 HydrophobicContact CB-CD1 4.11Å; R117-L132 HydrophobicContact CB-CD2 4.23Å; R117-L132 HydrophobicContact CB-CG 4.31Å; K130-L132 HydrophobicContact CD-CD2 3.8Å; K130-L132 HydrophobicContact CG-CD2 4.1Å; L132-S157 WeakPolarHBondContact O-CA 3.32Å
133	A	93.4	Very high	82.7	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.008	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	151.8	174.9	0	0	0	0	0	110	L55 M114 L115 T131 L155 C156 V166	L55-A133 HydrophobicContact CD2-CB 4.32Å; M114-A133 CarbonylContact C-O 3.52Å; M114-A133 VanDerWaalsContact CA-O 3.3Å; M114-A133 WeakPolarHBondContact CA-O 3.31Å; L115-A133 HydrophobicContact CB-CB 4.41Å; L115-A133 HydrophobicContact CD1-CB 4.36Å; L115-A133 PolarHBondContact N-O 3.08Å; T131-A133 WeakPolarHBondContact CG2-O 3.34Å; A133-L155 HydrophobicContact CB-CB 3.95Å; A133-C156 CarbonylContact C-O 3.54Å; A133-C156 VanDerWaalsContact CA-O 3.22Å; A133-C156 WeakPolarHBondContact CA-O 3.24Å; A133-V166 HydrophobicContact CB-CG2 3.57Å
134	M	94.1	Very high	84	Confident	39 Å²	39	60.4 Å²	60.4	19%	0.192	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	146.7	178.1	-174.3	171.2	69.7	0	0	111.3	Q112 I113 M114 T131 L155 C156 Q159	Q112-M134 HydrophobicContact CB-CG 4.49Å; Q112-M134 HydrophobicContact CB-SD 4.08Å; Q112-M134 HydrophobicContact CG-SD 4.1Å; I113-M134 CarbonylContact O-C 3.56Å; I113-M134 WeakPolarHBondContact O-CA 3.08Å; M114-M134 HydrophobicContact CG-CB 4.1Å; M114-M134 HydrophobicContact CG-CG 3.71Å; M114-M134 HydrophobicContact CG-SD 3.92Å; M114-M134 HydrophobicContact SD-SD 4.37Å; T131-M134 HydrophobicContact CG2-CB 4.35Å; M134-L155 WeakPolarHBondContact O-CA 3.48Å; M134-C156 PolarHBondContact N-O 3.27Å; M134-C156 PolarHBondContact O-N 3.47Å; M134-Q159 HydrophobicContact CE-CG 4.38Å
135	G	94.3	Very high	84.9	Confident	8 Å²	8	58.3 Å²	58.3	8%	0.082	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	156.4	163.1	0	0	0	0	0	109.7	Q112 I113	Q112-G135 WeakPolarHBondContact CA-O 3.31Å; I113-G135 PolarHBondContact N-O 3.37Å; I113-G135 PolarHBondContact O-N 3.11Å
136	S	93.2	Very high	85.6	Confident	61 Å²	61	55.5 Å²	55.5	43%	0.427	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	136.8	-178.3	56.5	0	0	0	0	111.7	L111	L111-S136 CarbonylContact O-C 3.55Å; L111-S136 VanDerWaalsContact O-CA 3.3Å; L111-S136 WeakPolarHBondContact O-CA 3.45Å
137	I	92.9	Very high	86.2	Confident	9 Å²	9	52 Å²	52	5%	0.046	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	138.1	176.7	-50.6	169.8	0	0	0	107.9	K110 L111 I113 V142 L153 I171 L174	K110-I137 CarbonylContact C-O 3.58Å; K110-I137 VanDerWaalsContact CA-O 3.29Å; K110-I137 WeakPolarHBondContact CA-O 3.5Å; L111-I137 HydrophobicContact CB-CB 4.5Å; L111-I137 HydrophobicContact CD2-CD1 4.49Å; L111-I137 PolarHBondContact N-O 2.9Å; L111-I137 PolarHBondContact O-N 2.95Å; I113-I137 HydrophobicContact CD1-CD1 4.26Å; I137-V142 HydrophobicContact CG2-CG2 3.69Å; I137-L153 HydrophobicContact CD1-CD2 4.19Å; I137-L153 HydrophobicContact CG1-CD1 3.97Å; I137-L153 HydrophobicContact CG1-CD2 4.06Å; I137-I171 HydrophobicContact CD1-CD1 3.46Å; I137-I171 VanDerWaalsContact CD1-CD1 3.46Å; I137-L174 HydrophobicContact CB-CD2 4.45Å; I137-L174 HydrophobicContact CD1-CD2 3.43Å; I137-L174 VanDerWaalsContact CD1-CD2 3.43Å; I137-L174 HydrophobicContact CG2-CD2 3.95Å
138	D	92.1	Very high	86.1	Confident	50 Å²	50	58.1 Å²	58.1	27%	0.267	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	122.5	173.1	-154.1	-58.1	0	0	0	110.9	K110 A140 E141 V142	K110-D138 WeakPolarHBondContact CE-OD2 3.29Å; K110-D138 HydrophobicContact CG-CB 4.48Å; K110-D138 IonicContact NZ-OD2 2.68Å; D138-A140 PolarHBondContact O-N 3.5Å; D138-A140 VanDerWaalsContact OD1-CB 3.31Å; D138-A140 WeakPolarHBondContact OD1-CB 3.32Å; D138-A140 PolarHBondContact OD1-N 2.92Å; D138-E141 HydrophobicContact CB-CB 4.41Å; D138-E141 PolarHBondContact O-N 2.68Å; D138-V142 WeakPolarHBondContact O-CG2 3.45Å; D138-V142 PolarHBondContact O-N 2.66Å
139	M	92.1	Very high	85.2	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-77.5	-9.2	-178.9	-58.9	-60.3	-60.7	0	0	113.2	C42 I68 Y100 N109 L111 V142 M143 L174	C42-M139 HydrophobicContact CB-CE 3.98Å; I68-M139 HydrophobicContact CD1-CG 3.93Å; Y100-M139 HydrophobicContact CE2-CB 4.31Å; Y100-M139 HydrophobicContact CE2-CG 4.4Å; Y100-M139 WeakPolarHBondContact OH-CB 3.47Å; N109-M139 HydrophobicContact CB-CB 4.48Å; N109-M139 WeakPolarHBondContact O-CB 3.39Å; N109-M139 WeakPolarHBondContact O-CG 3.2Å; N109-M139 PolarHBondContact O-N 3.02Å; L111-M139 HydrophobicContact CB-CG 3.95Å; L111-M139 HydrophobicContact CB-SD 3.54Å; L111-M139 VanDerWaalsContact CB-SD 3.54Å; L111-M139 HydrophobicContact CD2-SD 3.83Å; L111-M139 HydrophobicContact CG-SD 4.28Å; M139-V142 HydrophobicContact CE-CB 4.27Å; M139-V142 HydrophobicContact CE-CG1 3.89Å; M139-V142 HydrophobicContact SD-CB 4.45Å; M139-V142 HydrophobicContact SD-CG2 4.23Å; M139-M143 WeakPolarHBondContact O-CG 3.49Å; M139-M143 PolarHBondContact O-N 3.14Å; M139-L174 HydrophobicContact CE-CD1 4.17Å; M139-L174 HydrophobicContact SD-CD1 4.49Å
140	A	88.9	Confident	84.1	Confident	33 Å²	33	57.6 Å²	57.6	27%	0.273	32%	0.323	S	S	.	.	H	α-helix	trans	-72.7	-42.1	168.2	0	0	0	0	0	111	D138 M143 Q144	D138-A140 PolarHBondContact O-N 3.5Å; D138-A140 VanDerWaalsContact OD1-CB 3.31Å; D138-A140 WeakPolarHBondContact OD1-CB 3.32Å; D138-A140 PolarHBondContact OD1-N 2.92Å; A140-M143 PolarHBondContact O-N 3.09Å; A140-Q144 PolarHBondContact O-N 2.95Å
141	E	88.2	Confident	83.8	Confident	114 Å²	114	56.3 Å²	56.3	53%	0.533	32%	0.319	S	S	.	.	H	α-helix	trans	-61.3	-48.9	174.2	-173.3	-175.3	-179.5	0	0	110.7	D138 M143 Q144 H145	D138-E141 HydrophobicContact CB-CB 4.41Å; D138-E141 PolarHBondContact O-N 2.68Å; E141-M143 PolarHBondContact O-N 2.97Å; E141-M143 VanDerWaalsContact O-N 3.12Å; E141-Q144 PolarHBondContact O-N 2.8Å; E141-H145 PolarHBondContact O-N 3.46Å
142	V	90.1	Very high	83.8	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.018	32%	0.318	C	S	.	.	H	α-helix	trans	-56.4	-28.6	176.1	170.5	0	0	0	0	113.3	I137 D138 M139 H145 P146 L174	I137-V142 HydrophobicContact CG2-CG2 3.69Å; D138-V142 WeakPolarHBondContact O-CG2 3.45Å; D138-V142 PolarHBondContact O-N 2.66Å; M139-V142 HydrophobicContact CE-CB 4.27Å; M139-V142 HydrophobicContact CE-CG1 3.89Å; M139-V142 HydrophobicContact SD-CB 4.45Å; M139-V142 HydrophobicContact SD-CG2 4.23Å; V142-H145 CarbonylContact O-C 3.56Å; V142-P146 WeakPolarHBondContact O-CA 3.16Å; V142-L174 HydrophobicContact CG1-CD2 4.5Å; V142-L174 HydrophobicContact CG1-CG 3.9Å; V142-L174 HydrophobicContact CG2-CD2 3.72Å; V142-L174 HydrophobicContact CG2-CG 4.03Å
143	M	85.4	Confident	83.9	Confident	67 Å²	67	56.6 Å²	56.6	33%	0.33	32%	0.32	S	S	.	.	H	α-helix	trans	-80	-26.7	176.9	-81.7	175.7	47.9	0	0	113.6	R40 H102 M139 A140 E141	R40-M143 WeakPolarHBondContact CD-SD 3.26Å; R40-M143 VanDerWaalsContact CZ-SD 3.54Å; R40-M143 PolarHBondContact NE-SD 3.38Å; H102-M143 PolarHBondContact CE1-SD 3.15Å; H102-M143 PolarHBondContact ND1-SD 3.18Å; M139-M143 WeakPolarHBondContact O-CG 3.49Å; M139-M143 PolarHBondContact O-N 3.14Å; A140-M143 PolarHBondContact O-N 3.09Å; E141-M143 PolarHBondContact O-N 2.97Å; E141-M143 VanDerWaalsContact O-N 3.12Å
144	Q	82.4	Confident	83.9	Confident	145 Å²	145	59.4 Å²	59.4	68%	0.678	34%	0.338	S	S	*	.	H	α-helix	trans	-85.6	-36.5	175.2	-63.5	177.5	14.7	0	0	111	A140 E141	A140-Q144 PolarHBondContact O-N 2.95Å; E141-Q144 PolarHBondContact O-N 2.8Å
145	H	78.1	Confident	83.9	Confident	131 Å²	131	57.6 Å²	57.6	61%	0.606	33%	0.329	S	S	*	.	S	Bend	trans	-132.1	80.9	-177	-58.2	-33.4	0	0	0	110.8	E141 V142 T147	E141-H145 PolarHBondContact O-N 3.46Å; V142-H145 CarbonylContact O-C 3.56Å; H145-T147 PolarHBondContact O-N 2.96Å; H145-T147 PolarHBondContact O-OG1 3.47Å
146	P	69.9	Low	83.7	Confident	81 Å²	81	57.9 Å²	57.9	53%	0.526	33%	0.33	S	S	.	.			trans	-55.5	123.6	176.7	-25.7	35.4	0	0	0	111.3	V142 E148	V142-P146 WeakPolarHBondContact O-CA 3.16Å; P146-E148 VanDerWaalsContact C-N 3.35Å; P146-E148 PolarHBondContact O-N 2.93Å
147	T	67.4	Low	83.3	Confident	34 Å²	34	58.8 Å²	58.8	21%	0.209	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	74.6	-165.9	-35.9	0	0	0	0	111.4	H145 G149 Q151 L174	H145-T147 PolarHBondContact O-N 2.96Å; H145-T147 PolarHBondContact O-OG1 3.47Å; T147-G149 PolarHBondContact O-N 3.48Å; T147-G149 VanDerWaalsContact O-N 3.14Å; T147-Q151 HydrophobicContact CG2-CB 3.79Å; T147-Q151 HydrophobicContact CG2-CG 4.34Å; T147-L174 PolarHBondContact N-O 2.82Å
148	E	59	Low	82.4	Confident	189 Å²	189	62 Å²	62	88%	0.883	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	83	173.8	-65.5	-158.5	159.7	0	0	111.5	P146	P146-E148 VanDerWaalsContact C-N 3.35Å; P146-E148 PolarHBondContact O-N 2.93Å
149	G	59.9	Low	80.8	Confident	52 Å²	52	66.8 Å²	66.8	54%	0.536	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	134.3	101.7	165	0	0	0	0	0	115.6	T147 Q151	T147-G149 PolarHBondContact O-N 3.48Å; T147-G149 VanDerWaalsContact O-N 3.14Å; G149-Q151 VanDerWaalsContact C-N 3.35Å; G149-Q151 PolarHBondContact O-N 2.95Å; G149-Q151 VanDerWaalsContact O-N 3.13Å
150	G	68.2	Low	79.2	Confident	39 Å²	39	75.8 Å²	75.8	40%	0.402	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	67.2	20.2	147.9	0	0	0	0	0	117.9	V152 I171	G150-V152 PolarHBondContact O-N 2.92Å; G150-I171 CarbonylContact C-O 3.57Å; G150-I171 WeakPolarHBondContact CA-O 3.41Å; G150-I171 PolarHBondContact N-O 2.78Å; G150-I171 VanDerWaalsContact N-O 3.15Å
151	Q	85.6	Confident	77.6	Confident	61 Å²	61	78.4 Å²	78.4	29%	0.285	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	131.1	177.1	-175.5	-172.6	43.7	0	0	111	T147 G149 I171	T147-Q151 HydrophobicContact CG2-CB 3.79Å; T147-Q151 HydrophobicContact CG2-CG 4.34Å; G149-Q151 VanDerWaalsContact C-N 3.35Å; G149-Q151 PolarHBondContact O-N 2.95Å; G149-Q151 VanDerWaalsContact O-N 3.13Å; Q151-I171 HydrophobicContact CB-CB 4.34Å; Q151-I171 PolarHBondContact N-O 2.82Å; Q151-I171 VanDerWaalsContact N-O 3.13Å; Q151-I171 WeakPolarHBondContact O-CB 3.46Å; Q151-I171 PolarHBondContact O-N 2.85Å
152	V	91.9	Very high	76	Confident	56 Å²	56	80.8 Å²	80.8	34%	0.339	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	112.1	175	-176.1	0	0	0	0	109.1	G150 P154 E168 W170	G150-V152 PolarHBondContact O-N 2.92Å; V152-P154 WeakPolarHBondContact O-CD 3.41Å; V152-E168 HydrophobicContact CG1-CB 3.83Å; V152-E168 HydrophobicContact CG1-CG 4.12Å; V152-W170 HydrophobicContact CG2-CD2 3.74Å; V152-W170 HydrophobicContact CG2-CE3 4.15Å; V152-W170 HydrophobicContact CG2-CG 4.07Å; V152-W170 HydrophobicContact CG2-CH2 4.44Å; V152-W170 HydrophobicContact CG2-CZ2 4.04Å; V152-W170 HydrophobicContact CG2-CZ3 4.48Å
153	L	93.7	Very high	74.3	Confident	16 Å²	16	88.9 Å²	88.9	8%	0.084	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	118.6	175.3	178.6	71.9	0	0	0	109.7	I113 I137 L155 E168 I169 I171	I113-L153 HydrophobicContact CB-CD2 4.08Å; I113-L153 HydrophobicContact CD1-CD2 3.83Å; I113-L153 HydrophobicContact CG1-CD2 4.19Å; I137-L153 HydrophobicContact CD1-CD2 4.19Å; I137-L153 HydrophobicContact CG1-CD1 3.97Å; I137-L153 HydrophobicContact CG1-CD2 4.06Å; L153-L155 HydrophobicContact CD2-CD2 4.03Å; L153-L155 HydrophobicContact CG-CD2 4.23Å; L153-E168 WeakPolarHBondContact O-CA 3.34Å; L153-I169 HydrophobicContact CB-CG2 3.92Å; L153-I169 HydrophobicContact CD2-CG2 4.17Å; L153-I169 HydrophobicContact CG-CG2 4.43Å; L153-I169 PolarHBondContact N-O 3.33Å; L153-I169 PolarHBondContact O-N 2.98Å; L153-I171 HydrophobicContact CB-CD1 3.95Å
154	P	93.6	Very high	73.5	Confident	60 Å²	60	86.7 Å²	86.7	39%	0.39	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	143.5	169.9	29.7	-34.6	0	0	0	111	V152 K165	V152-P154 WeakPolarHBondContact O-CD 3.41Å; P154-K165 HydrophobicContact CB-CB 4.39Å
155	L	94	Very high	73.7	Confident	0 Å²	0	84.1 Å²	84.1	0%	0	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	120.9	175.7	-50	179.4	0	0	0	108.7	L115 A133 M134 L153 V166 A167 I169	L115-L155 HydrophobicContact CD1-CD1 4.11Å; L115-L155 HydrophobicContact CD2-CD1 4.29Å; L115-L155 HydrophobicContact CG-CD1 3.87Å; A133-L155 HydrophobicContact CB-CB 3.95Å; M134-L155 WeakPolarHBondContact O-CA 3.48Å; L153-L155 HydrophobicContact CD2-CD2 4.03Å; L153-L155 HydrophobicContact CG-CD2 4.23Å; L155-V166 VanDerWaalsContact O-CG2 3.32Å; L155-V166 WeakPolarHBondContact O-CG2 3.43Å; L155-V166 PolarHBondContact O-N 3.36Å; L155-A167 HydrophobicContact CB-CB 4.24Å; L155-A167 HydrophobicContact CD1-CB 4.25Å; L155-A167 PolarHBondContact N-O 3.27Å; L155-A167 PolarHBondContact O-N 3.14Å; L155-I169 HydrophobicContact CD1-CB 4.19Å; L155-I169 HydrophobicContact CD1-CG2 4.15Å; L155-I169 HydrophobicContact CD2-CG2 3.97Å; L155-I169 HydrophobicContact CG-CG2 4.22Å
156	C	91.4	Very high	74.3	Confident	15 Å²	15	78.5 Å²	78.5	10%	0.101	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	147.3	-178.7	-63.8	0	0	0	0	110.9	A133 M134 N158	A133-C156 CarbonylContact C-O 3.54Å; A133-C156 VanDerWaalsContact CA-O 3.22Å; A133-C156 WeakPolarHBondContact CA-O 3.24Å; M134-C156 PolarHBondContact N-O 3.27Å; M134-C156 PolarHBondContact O-N 3.47Å; C156-N158 WeakPolarHBondContact CB-O 3.49Å
157	S	84.8	Confident	75.4	Confident	79 Å²	79	74.6 Å²	74.6	55%	0.552	41%	0.409	S	S	*	.	S	Bend	trans	-78.8	-26.3	178.7	51.7	0	0	0	0	113.6	L132	L132-S157 WeakPolarHBondContact O-CA 3.32Å
158	N	73.1	Confident	76.7	Confident	77 Å²	77	74.8 Å²	74.8	41%	0.412	41%	0.408	S	S	.	.	S	Bend	trans	-117.1	142.8	171.7	-171.9	10.4	0	0	0	109.7	C156 K160 D161	C156-N158 WeakPolarHBondContact CB-O 3.49Å; N158-K160 VanDerWaalsContact C-N 3.29Å; N158-K160 PolarHBondContact O-N 2.76Å; N158-K160 PolarHBondContact OD1-N 3.12Å; N158-D161 HydrophobicContact CB-CB 4.5Å; N158-D161 PolarHBondContact ND2-OD2 2.88Å
159	Q	59.2	Low	78.4	Confident	151 Å²	151	65.8 Å²	65.8	71%	0.706	37%	0.365	S	S	*	.	S	Bend	trans	-75.8	-18.3	178	-168.3	171.3	3.1	0	0	112.7	M134	M134-Q159 HydrophobicContact CE-CG 4.38Å
160	K	57.4	Low	80.1	Confident	189 Å²	189	68.1 Å²	68.1	82%	0.822	36%	0.358	S	S	*	.	S	Bend	trans	-87.7	-17.1	-178.2	-153.5	170.6	-177.4	178.8	0	114.2	N158	N158-K160 VanDerWaalsContact C-N 3.29Å; N158-K160 PolarHBondContact O-N 2.76Å; N158-K160 PolarHBondContact OD1-N 3.12Å
161	D	56.3	Low	81.3	Confident	87 Å²	87	66.3 Å²	66.3	47%	0.465	34%	0.339	S	S	.	.			trans	-118.9	92.7	-170.4	-62.2	-60	0	0	0	113	N158 L163 G164	N158-D161 HydrophobicContact CB-CB 4.5Å; N158-D161 PolarHBondContact ND2-OD2 2.88Å; D161-L163 PolarHBondContact O-N 3.34Å; D161-G164 WeakPolarHBondContact O-CA 3.18Å; D161-G164 PolarHBondContact O-N 2.87Å
162	M	53.7	Low	81.6	Confident	165 Å²	165	68.8 Å²	68.8	81%	0.813	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-24.5	175.5	-73.2	-66.1	-175.8	0	0	113.6	G164	M162-G164 PolarHBondContact O-N 2.9Å
163	L	55	Low	81.6	Confident	173 Å²	173	67.9 Å²	67.9	91%	0.906	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-14.7	172.4	-64.9	169.6	0	0	0	112.5	D161 K165	D161-L163 PolarHBondContact O-N 3.34Å; L163-K165 VanDerWaalsContact C-N 3.28Å; L163-K165 PolarHBondContact O-N 3.01Å; L163-K165 VanDerWaalsContact O-N 3.17Å
164	G	69.6	Low	81.6	Confident	21 Å²	21	67.3 Å²	67.3	22%	0.216	34%	0.342	C	S	.	.			trans	-81.8	29.4	-176.5	0	0	0	0	0	115.6	D161 M162 V166	D161-G164 WeakPolarHBondContact O-CA 3.18Å; D161-G164 PolarHBondContact O-N 2.87Å; M162-G164 PolarHBondContact O-N 2.9Å; G164-V166 PolarHBondContact O-N 2.81Å
165	K	86.3	Confident	81.5	Confident	91 Å²	91	66.3 Å²	66.3	40%	0.396	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	132	179.1	77.6	172.9	-177.7	174.6	0	111.4	L52 K53 P154 L163 E168	L52-K165 HydrophobicContact CD1-CD 4.26Å; L52-K165 HydrophobicContact CD1-CG 4.42Å; K53-K165 WeakPolarHBondContact CE-O 3.4Å; K53-K165 PolarHBondContact NZ-O 3.5Å; P154-K165 HydrophobicContact CB-CB 4.39Å; L163-K165 VanDerWaalsContact C-N 3.28Å; L163-K165 PolarHBondContact O-N 3.01Å; L163-K165 VanDerWaalsContact O-N 3.17Å; K165-E168 WeakPolarHBondContact CE-OE1 3.33Å; K165-E168 IonicContact NZ-OE1 3.57Å; K165-E168 PolarHBondContact NZ-OE1 3.35Å
166	V	90.6	Very high	81.5	Confident	12 Å²	12	66.9 Å²	66.9	7%	0.073	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	-23.2	-178.4	-69.2	0	0	0	0	112.8	L52 K53 L55 A133 L155 G164	L52-V166 WeakPolarHBondContact CB-O 3.2Å; L52-V166 PolarHBondContact N-O 3.4Å; K53-V166 HydrophobicContact CB-CB 4.34Å; K53-V166 HydrophobicContact CB-CG1 4.25Å; K53-V166 HydrophobicContact CD-CG1 4.09Å; K53-V166 PolarHBondContact N-O 2.95Å; L55-V166 HydrophobicContact CD2-CB 3.68Å; L55-V166 HydrophobicContact CD2-CG2 3.47Å; L55-V166 VanDerWaalsContact CD2-CG2 3.47Å; A133-V166 HydrophobicContact CB-CG2 3.57Å; L155-V166 VanDerWaalsContact O-CG2 3.32Å; L155-V166 WeakPolarHBondContact O-CG2 3.43Å; L155-V166 PolarHBondContact O-N 3.36Å; G164-V166 PolarHBondContact O-N 2.81Å
167	A	93.1	Very high	81.4	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	167.8	172.3	0	0	0	0	0	110.7	L49 V50 V51 L115 L155	L49-A167 HydrophobicContact CD1-CB 4.42Å; V50-A167 CarbonylContact O-C 3.51Å; V50-A167 WeakPolarHBondContact O-CA 3.4Å; V50-A167 WeakPolarHBondContact O-CB 3.44Å; V51-A167 HydrophobicContact CG2-CB 4.16Å; L115-A167 HydrophobicContact CD1-CB 3.78Å; L155-A167 HydrophobicContact CB-CB 4.24Å; L155-A167 HydrophobicContact CD1-CB 4.25Å; L155-A167 PolarHBondContact N-O 3.27Å; L155-A167 PolarHBondContact O-N 3.14Å
168	E	94.9	Very high	81.6	Confident	38 Å²	38	71.2 Å²	71.2	18%	0.178	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	140.8	176.8	-74.6	174.5	-173.8	0	0	109.2	V50 L52 V152 L153 K165	V50-E168 PolarHBondContact N-O 3.02Å; V50-E168 PolarHBondContact O-N 3.22Å; L52-E168 HydrophobicContact CD1-CG 4.04Å; V152-E168 HydrophobicContact CG1-CB 3.83Å; V152-E168 HydrophobicContact CG1-CG 4.12Å; L153-E168 WeakPolarHBondContact O-CA 3.34Å; K165-E168 WeakPolarHBondContact CE-OE1 3.33Å; K165-E168 IonicContact NZ-OE1 3.57Å; K165-E168 PolarHBondContact NZ-OE1 3.35Å
169	I	94.9	Very high	82.3	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	128.7	-179.9	-161.1	158.8	0	0	0	111	L46 K48 L49 I64 L92 I113 L153 L155	L46-I169 HydrophobicContact CD1-CD1 3.7Å; L46-I169 HydrophobicContact CD1-CG1 4.28Å; L46-I169 HydrophobicContact CD2-CG1 4.47Å; K48-I169 WeakPolarHBondContact O-CA 3.5Å; K48-I169 WeakPolarHBondContact O-CG1 3.16Å; L49-I169 HydrophobicContact CD1-CD1 4.44Å; I64-I169 HydrophobicContact CD1-CD1 3.83Å; I64-I169 HydrophobicContact CG1-CD1 4.2Å; I64-I169 HydrophobicContact CG2-CD1 4.19Å; L92-I169 HydrophobicContact CD1-CD1 4.19Å; L92-I169 HydrophobicContact CD1-CG1 4.28Å; I113-I169 HydrophobicContact CG2-CD1 4.19Å; I113-I169 HydrophobicContact CG2-CG2 4.31Å; L153-I169 HydrophobicContact CB-CG2 3.92Å; L153-I169 HydrophobicContact CD2-CG2 4.17Å; L153-I169 HydrophobicContact CG-CG2 4.43Å; L153-I169 PolarHBondContact N-O 3.33Å; L153-I169 PolarHBondContact O-N 2.98Å; L155-I169 HydrophobicContact CD1-CB 4.19Å; L155-I169 HydrophobicContact CD1-CG2 4.15Å; L155-I169 HydrophobicContact CD2-CG2 3.97Å; L155-I169 HydrophobicContact CG-CG2 4.22Å
170	W	94	Very high	82.9	Confident	101 Å²	101	69.1 Å²	69.1	38%	0.383	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	113.4	-172.7	-68.4	50.9	0	0	0	109.7	K47 K48 V152	K47-W170 PolarHBondContact N-O 2.96Å; K48-W170 HydrophobicContact CB-CB 3.8Å; K48-W170 HydrophobicContact CB-CG 3.83Å; K48-W170 HydrophobicContact CD-CD2 4.45Å; K48-W170 HydrophobicContact CD-CG 4.48Å; K48-W170 PolarHBondContact O-N 3.17Å; V152-W170 HydrophobicContact CG2-CD2 3.74Å; V152-W170 HydrophobicContact CG2-CE3 4.15Å; V152-W170 HydrophobicContact CG2-CG 4.07Å; V152-W170 HydrophobicContact CG2-CH2 4.44Å; V152-W170 HydrophobicContact CG2-CZ2 4.04Å; V152-W170 HydrophobicContact CG2-CZ3 4.48Å
171	I	93.9	Very high	82.9	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.005	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	120.2	177	-59	166.4	0	0	0	107.2	L44 L46 I113 I137 G150 Q151 L153 L174	L44-I171 HydrophobicContact CD1-CD1 4.47Å; L44-I171 HydrophobicContact CD1-CG1 4.24Å; L44-I171 HydrophobicContact CD1-CG2 3.87Å; L46-I171 HydrophobicContact CD2-CB 4.4Å; L46-I171 HydrophobicContact CD2-CG1 3.72Å; I113-I171 HydrophobicContact CD1-CD1 4.49Å; I137-I171 HydrophobicContact CD1-CD1 3.46Å; I137-I171 VanDerWaalsContact CD1-CD1 3.46Å; G150-I171 CarbonylContact C-O 3.57Å; G150-I171 WeakPolarHBondContact CA-O 3.41Å; G150-I171 PolarHBondContact N-O 2.78Å; G150-I171 VanDerWaalsContact N-O 3.15Å; Q151-I171 HydrophobicContact CB-CB 4.34Å; Q151-I171 PolarHBondContact N-O 2.82Å; Q151-I171 VanDerWaalsContact N-O 3.13Å; Q151-I171 WeakPolarHBondContact O-CB 3.46Å; Q151-I171 PolarHBondContact O-N 2.85Å; L153-I171 HydrophobicContact CB-CD1 3.95Å; I171-L174 HydrophobicContact CG2-CB 3.88Å
172	F	91.3	Very high	82.3	Confident	112 Å²	112	69.8 Å²	69.8	49%	0.491	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-40.8	176.1	179.4	-108.9	0	0	0	111.5	T45 K47	T45-F172 HydrophobicContact CG2-CB 4.18Å; T45-F172 HydrophobicContact CG2-CD1 4.19Å; T45-F172 PolarHBondContact O-N 2.83Å; K47-F172 HydrophobicContact CB-CB 4.03Å; K47-F172 HydrophobicContact CD-CB 4.47Å; K47-F172 HydrophobicContact CD-CD2 3.94Å; K47-F172 HydrophobicContact CD-CG 4.48Å
173	S	92.4	Very high	81.5	Confident	38 Å²	38	68.8 Å²	68.8	27%	0.266	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	138.9	178.3	63.9	0	0	0	0	109.8	T45	T45-S173 VanDerWaalsContact CB-OG 3.27Å; T45-S173 WeakPolarHBondContact CB-OG 3.36Å; T45-S173 PolarHBondContact N-O 3.13Å; T45-S173 PolarHBondContact OG1-OG 2.9Å
174	L	93.5	Very high	80.6	Confident	3 Å²	3	65.2 Å²	65.2	2%	0.016	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	128.1	168.8	174.6	55.6	0	0	0	109.9	S43 L44 L111 I137 M139 V142 T147 I171	S43-L174 WeakPolarHBondContact O-CA 3.26Å; L44-L174 HydrophobicContact CB-CD1 4.04Å; L44-L174 HydrophobicContact CD1-CB 4.17Å; L44-L174 HydrophobicContact CD1-CD1 3.9Å; L44-L174 HydrophobicContact CD1-CD2 4.25Å; L44-L174 HydrophobicContact CD1-CG 4.33Å; L111-L174 HydrophobicContact CD2-CD1 3.87Å; L111-L174 HydrophobicContact CD2-CD2 4.16Å; I137-L174 HydrophobicContact CB-CD2 4.45Å; I137-L174 HydrophobicContact CD1-CD2 3.43Å; I137-L174 VanDerWaalsContact CD1-CD2 3.43Å; I137-L174 HydrophobicContact CG2-CD2 3.95Å; M139-L174 HydrophobicContact CE-CD1 4.17Å; M139-L174 HydrophobicContact SD-CD1 4.49Å; V142-L174 HydrophobicContact CG1-CD2 4.5Å; V142-L174 HydrophobicContact CG1-CG 3.9Å; V142-L174 HydrophobicContact CG2-CD2 3.72Å; V142-L174 HydrophobicContact CG2-CG 4.03Å; T147-L174 PolarHBondContact N-O 2.82Å; I171-L174 HydrophobicContact CG2-CB 3.88Å
175	S	92.5	Very high	78.8	Confident	40 Å²	40	68 Å²	68	28%	0.28	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	159	178.6	62.9	0	0	0	0	111.8	C42 S43	C42-S175 WeakPolarHBondContact CA-O 3.37Å; S43-S175 PolarHBondContact N-O 2.83Å; S43-S175 PolarHBondContact O-N 3.36Å
176	S	92.8	Very high	76.7	Confident	11 Å²	11	71.9 Å²	71.9	8%	0.077	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	111.2	172.4	176.8	0	0	0	0	110.1	R40 L41 Y100	R40-S176 WeakPolarHBondContact CD-OG 3.43Å; R40-S176 PolarHBondContact NE-O 3.26Å; R40-S176 PolarHBondContact NE-OG 2.83Å; R40-S176 PolarHBondContact NH2-O 3.37Å; L41-S176 WeakPolarHBondContact O-CA 3.36Å; Y100-S176 PolarHBondContact OH-OG 2.74Å
177	Q	91	Very high	74.1	Confident	119 Å²	119	80.4 Å²	80.4	56%	0.556	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	149	-179.5	-68.5	177.7	-15.5	0	0	110.4	R40 L41	R40-Q177 CarbonylContact C-O 3.58Å; R40-Q177 WeakPolarHBondContact CA-O 3.39Å; R40-Q177 VanDerWaalsContact CB-O 3.27Å; R40-Q177 WeakPolarHBondContact CB-O 3.16Å; L41-Q177 PolarHBondContact N-O 3.08Å; L41-Q177 PolarHBondContact O-N 3.28Å
178	P	88.8	Confident	71.2	Confident	66 Å²	66	84.4 Å²	84.4	43%	0.429	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	153.1	168.7	31.2	-34.1	0	0	0	109.8
179	I	86.1	Confident	68.2	Low	43 Å²	43	86.2 Å²	86.2	22%	0.221	50%	0.501	C	S	.	.			trans	-100.1	108.1	165.8	-60.1	167.2	0	0	0	106.3	P39 L41 Q99 H181	P39-I179 HydrophobicContact CB-CB 4.21Å; P39-I179 HydrophobicContact CB-CD1 4.32Å; P39-I179 PolarHBondContact O-N 2.81Å; L41-I179 HydrophobicContact CB-CD1 4.4Å; L41-I179 HydrophobicContact CB-CG1 4.1Å; Q99-I179 HydrophobicContact CB-CD1 4.07Å; Q99-I179 HydrophobicContact CG-CD1 3.76Å; I179-H181 PolarHBondContact O-N 3.37Å; I179-H181 VanDerWaalsContact O-N 3.15Å
180	D	71.9	Confident	65.1	Low	142 Å²	142	94.8 Å²	94.8	76%	0.759	54%	0.541	S	S	*	.			trans	-68.7	111.1	173.7	-61.5	-45.1	0	0	0	108.8	E182	D180-E182 PolarHBondContact O-N 2.98Å
181	H	58.2	Low	62.4	Low	97 Å²	97	100.3 Å²	100.3	45%	0.449	57%	0.567	S	S	.	*			trans	-78.5	103.5	165.6	-75.1	-65.6	0	0	0	107.9	I179 D183	I179-H181 PolarHBondContact O-N 3.37Å; I179-H181 VanDerWaalsContact O-N 3.15Å; H181-D183 PolarHBondContact O-N 3.5Å
182	E	43.6	Very low	59.6	Low	192 Å²	192	107.5 Å²	107.5	90%	0.897	60%	0.604	S	S	*	*			trans	-62.3	106.2	162.6	-71.1	-151.8	138.5	0	0	108.1	D180 A184	D180-E182 PolarHBondContact O-N 2.98Å; E182-A184 PolarHBondContact O-N 2.84Å
183	D	37.6	Very low	56.7	Low	144 Å²	144	111.3 Å²	111.3	77%	0.77	62%	0.621	S	S	*	*			trans	-56.4	136.7	-178.1	-100.2	-45.3	0	0	0	111.4	H181 A185	H181-D183 PolarHBondContact O-N 3.5Å; D183-A185 HydrophobicContact CB-CB 3.93Å; D183-A185 PolarHBondContact O-N 2.84Å
184	A	35.2	Very low	53.6	Low	99 Å²	99	115.2 Å²	115.2	82%	0.818	65%	0.646	S	S	*	*			trans	-72	28.9	171.1	0	0	0	0	0	112.9	E182 L186	E182-A184 PolarHBondContact O-N 2.84Å; A184-L186 PolarHBondContact O-N 3.27Å
185	A	33.2	Very low	50.4	Low	79 Å²	79	120.2 Å²	120.2	65%	0.653	68%	0.682	S	S	*	*			trans	-76.1	35.1	-172.2	0	0	0	0	0	114.4	D183	D183-A185 HydrophobicContact CB-CB 3.93Å; D183-A185 PolarHBondContact O-N 2.84Å
186	L	42.3	Very low	47.5	Very low	173 Å²	173	125.7 Å²	125.7	91%	0.906	71%	0.708	S	S	*	*			trans	-125.8	38.3	169.7	-75.4	179.7	0	0	0	113.2	A184	A184-L186 PolarHBondContact O-N 3.27Å
187	Q	34.6	Very low	44.3	Very low	190 Å²	190	132.3 Å²	132.3	89%	0.888	74%	0.743	S	S	*	*	S	Bend	trans	-122	102.6	146.9	-68.6	-162.5	12.2	0	0	109.8
188	G	32	Very low	41.5	Very low	84 Å²	84	137.3 Å²	137.3	87%	0.866	76%	0.758	S	S	*	*			trans	-82.8	134	-177.4	0	0	0	0	0	113.2
189	G	31.6	Very low	38.7	Very low	76 Å²	76	138.8 Å²	138.8	78%	0.784	77%	0.77	S	S	*	*			trans	98.9	69.6	144.7	0	0	0	0	0	118.3
190	Q	31.5	Very low	36.4	Very low	180 Å²	180	145.8 Å²	145.8	84%	0.841	80%	0.802	S	S	*	*			trans	-124.6	123	137.3	-70.6	-162.6	-0.8	0	0	110	I192	Q190-I192 PolarHBondContact O-N 3.39Å
191	K	37.5	Very low	34.4	Very low	217 Å²	217	147.2 Å²	147.2	94%	0.943	80%	0.804	S	S	*	*			trans	-80.4	106.5	172.4	-72.8	-174.9	177	-176.2	0	108.8
192	I	35.1	Very low	33.3	Very low	152 Å²	152	151.3 Å²	151.3	78%	0.779	82%	0.823	S	S	*	*			trans	-107.6	134.5	159.9	-59	-178.8	0	0	0	106.6	Q190	Q190-I192 PolarHBondContact O-N 3.39Å
193	K	29	Very low	32.8	Very low	193 Å²	193	152.7 Å²	152.7	84%	0.839	82%	0.821	S	S	*	*			trans	-73.8	142.1	-177.5	-62.7	177.7	178.4	179.4	0	109.5	S195	K193-S195 PolarHBondContact O-N 3.36Å
194	C	28.8	Very low	32.4	Very low	119 Å²	119	152 Å²	152	80%	0.804	81%	0.813	S	S	*	*			trans	-59.3	132.3	151.5	-69.3	0	0	0	0	108.2
195	S	25.3	Very low	32.3	Very low	109 Å²	109	152.3 Å²	152.3	76%	0.762	81%	0.81	S	S	*	*			trans	-122.7	93.3	163.8	-176.1	0	0	0	0	104.9	K193 N197	K193-S195 PolarHBondContact O-N 3.36Å; S195-N197 PolarHBondContact O-N 2.97Å; S195-N197 VanDerWaalsContact O-N 3.17Å
196	D	32.3	Very low	31.9	Very low	154 Å²	154	157.2 Å²	157.2	82%	0.824	82%	0.817	S	S	*	*			trans	-61.5	118.5	169.4	-61	-60.2	0	0	0	107.6
197	N	25.8	Very low	31.5	Very low	151 Å²	151	153.8 Å²	153.8	81%	0.807	81%	0.807	S	S	*	*			trans	-149.4	109.1	165.2	-135.7	37.1	0	0	0	107.2	S195	S195-N197 PolarHBondContact O-N 2.97Å; S195-N197 VanDerWaalsContact O-N 3.17Å
198	Y	30.6	Very low	31.3	Very low	224 Å²	224	149.1 Å²	149.1	88%	0.878	80%	0.795	S	S	*	*			trans	-66.4	138	167.7	-96.5	-110.7	0	0	0	109
199	S	30.2	Very low	31.6	Very low	96 Å²	96	154.4 Å²	154.4	67%	0.671	80%	0.798	S	S	*	*			trans	-147.7	112.4	150.5	-148.4	0	0	0	0	107	E201	S199-E201 PolarHBondContact O-N 3.47Å
200	E	37.4	Very low	31.6	Very low	191 Å²	191	159.6 Å²	159.6	89%	0.893	80%	0.801	S	S	*	*			trans	-75	104.1	156	-71.8	-175.2	132.4	0	0	106.3
201	E	31.1	Very low	31.8	Very low	172 Å²	172	160 Å²	160	80%	0.804	80%	0.803	S	S	*	*			trans	-132.2	133.2	156.8	-70.2	-168.8	163.5	0	0	107.7	S199	S199-E201 PolarHBondContact O-N 3.47Å
202	E	35	Very low	31.5	Very low	182 Å²	182	154.8 Å²	154.8	85%	0.85	80%	0.801	S	S	*	*			trans	-67.7	148.3	178.4	-57.5	162.9	118.2	0	0	109.7
203	Y	32.8	Very low	31.3	Very low	221 Å²	221	152.8 Å²	152.8	87%	0.867	80%	0.801	S	S	*	*			trans	-155.2	105.3	144.6	-116.3	-71.3	0	0	0	112.7
204	E	29.4	Very low	31.7	Very low	129 Å²	129	150.5 Å²	150.5	60%	0.603	80%	0.798	S	S	*	*			trans	50.6	101.9	145.2	-64.6	-70.2	88	0	0	119.7	F206	E204-F206 HydrophobicContact CB-CD2 4.17Å; E204-F206 HydrophobicContact CB-CE2 4.17Å; E204-F206 PolarHBondContact O-N 2.84Å
205	S	33.7	Very low	31.9	Very low	106 Å²	106	151.8 Å²	151.8	74%	0.741	80%	0.797	S	S	*	*			trans	-60.6	108.4	149.4	160.7	0	0	0	0	111.2
206	F	25	Very low	32.2	Very low	182 Å²	182	150.1 Å²	150.1	80%	0.798	79%	0.789	S	S	*	*			trans	-92.6	100.7	158.6	-92.9	-89	0	0	0	111	E204	E204-F206 HydrophobicContact CB-CD2 4.17Å; E204-F206 HydrophobicContact CB-CE2 4.17Å; E204-F206 PolarHBondContact O-N 2.84Å
207	S	32.8	Very low	32	Very low	101 Å²	101	148.2 Å²	148.2	71%	0.706	78%	0.783	S	S	*	*			trans	-137.7	95.6	178.3	177.9	0	0	0	0	111.6
208	S	31.3	Very low	32.1	Very low	92 Å²	92	150.1 Å²	150.1	64%	0.643	79%	0.787	S	S	*	*			trans	-157.3	136.7	166.9	42.6	0	0	0	0	106.8
209	E	38.3	Very low	32.1	Very low	196 Å²	196	142.6 Å²	142.6	92%	0.916	78%	0.777	S	S	*	*			cis	51.6	75.8	19.5	-62.3	-150.3	136	0	0	112.5
210	Q	30.4	Very low	31.9	Very low	184 Å²	184	146.3 Å²	146.3	86%	0.86	78%	0.784	S	S	*	*			trans	-115.2	99.5	162.7	-162.4	159.7	24.4	0	0	108.4
211	E	35.9	Very low	31.6	Very low	188 Å²	188	143 Å²	143	88%	0.879	77%	0.772	S	S	*	*			trans	-67.6	162.2	156.1	-61.5	-171.3	125.7	0	0	108.8
212	A	30.6	Very low	32.1	Very low	109 Å²	109	141.3 Å²	141.3	90%	0.901	77%	0.768	S	S	*	*			trans	-111.4	108.9	-170	0	0	0	0	0	112.9
213	S	31.4	Very low	31.9	Very low	110 Å²	110	141.2 Å²	141.2	77%	0.769	77%	0.768	S	S	*	*			trans	-155.9	121.2	148.5	-155.7	0	0	0	0	104.3
214	D	37.2	Very low	31.9	Very low	145 Å²	145	138.6 Å²	138.6	78%	0.775	77%	0.769	S	S	*	*			cis	71	104.7	44.8	-149.4	51.2	0	0	0	109.7
215	D	32.9	Very low	32.4	Very low	146 Å²	146	139.4 Å²	139.4	78%	0.781	78%	0.777	S	S	*	*			cis	-131.8	-129.4	-8	-164.7	25.7	0	0	0	110.4
216	A	31.9	Very low	32.5	Very low	74 Å²	74	141.7 Å²	141.7	61%	0.612	78%	0.776	S	S	*	*			cis	-160.1	153.7	-2.4	0	0	0	0	0	115.2
217	V	29.3	Very low	33	Very low	114 Å²	114	141.3 Å²	141.3	69%	0.691	78%	0.775	S	S	*	*			trans	65.1	105.5	146.3	175.4	0	0	0	0	121.8
218	Q	27.5	Very low	33	Very low	191 Å²	191	141.7 Å²	141.7	89%	0.893	77%	0.769	S	S	*	*			trans	68.3	149.1	136.2	-64.6	178	6.8	0	0	124.1
219	G	29.4	Very low	33.2	Very low	65 Å²	65	142.3 Å²	142.3	67%	0.67	77%	0.768	S	S	*	*			trans	113.7	102.5	174.4	0	0	0	0	0	111.9
220	Q	27.4	Very low	32.8	Very low	175 Å²	175	143.1 Å²	143.1	82%	0.818	76%	0.763	S	S	*	*				61.2	134.8	64.6	-59.8	-162.7	-81.8	0	0	114.3
221	D	30.4	Very low	33.1	Very low	120 Å²	120	144.2 Å²	144.2	64%	0.642	77%	0.765	S	S	*	*			cis	-166.6	-178.4	-13	-101.1	-23.7	0	0	0	108.3
222	L	41.8	Very low	33.1	Very low	138 Å²	138	141.1 Å²	141.1	72%	0.723	76%	0.761	S	S	*	*			trans	76.1	124.1	166.8	-47.4	-174.9	0	0	0	116
223	E	31.4	Very low	33	Very low	179 Å²	179	144.9 Å²	144.9	84%	0.836	76%	0.757	S	S	*	*			cis	90.9	123.9	41.3	-71.8	172.1	-160.5	0	0	113.7
224	D	33.1	Very low	33	Very low	167 Å²	167	148.4 Å²	148.4	89%	0.893	76%	0.759	S	S	*	*				-153.4	156.9	121.3	-140.3	-21.6	0	0	0	110.9
225	D	39.4	Very low	32.6	Very low	146 Å²	146	149.6 Å²	149.6	78%	0.781	76%	0.759	S	S	*	*			trans	-97.7	-157.5	-177.3	-130.2	-41.7	0	0	0	109.9
226	E	35.7	Very low	32.3	Very low	154 Å²	154	152.6 Å²	152.6	72%	0.72	76%	0.76	S	S	*	*			cis	-166.6	131.3	37.7	163.5	160.8	-139.8	0	0	112.4
227	F	35.6	Very low	32.3	Very low	173 Å²	173	160 Å²	160	76%	0.759	77%	0.772	S	S	*	*			trans	58.6	165.4	148.4	-79.7	-140.5	0	0	0	121.8
228	D	32.7	Very low	32.2	Very low	109 Å²	109	158.8 Å²	158.8	58%	0.583	77%	0.769	S	S	*	*			cis	-165.5	173.1	-35.4	174.8	38.9	0	0	0	107.1
229	V	35.1	Very low	32.4	Very low	105 Å²	105	157 Å²	157	64%	0.636	76%	0.764	S	S	*	*			trans	145.9	88.4	134.1	175.5	0	0	0	0	112.3
230	R	30.5	Very low	32.4	Very low	213 Å²	213	159.1 Å²	159.1	80%	0.804	76%	0.764	S	S	*	*			trans	62.2	119.6	136.7	-58.9	176	-172.7	137.6	8.6	120.9
231	K	36.1	Very low	32.6	Very low	208 Å²	208	162.2 Å²	162.2	90%	0.904	77%	0.768	S	S	*	*			trans	-101.2	148	162.3	-62.5	172.6	-177.6	168.5	0	112
232	P	35	Very low	32.6	Very low	122 Å²	122	162.5 Å²	162.5	79%	0.792	77%	0.774	S	S	*	*			trans	-144	164.4	133	32.4	-15.5	0	0	0	114.3
233	K	28.9	Very low	32.4	Very low	188 Å²	188	161.4 Å²	161.4	82%	0.817	78%	0.775	S	S	*	*			cis	-172.1	109.9	-21.8	174.5	175.4	174.7	-178.9	0	112
234	K	31.1	Very low	32.3	Very low	184 Å²	184	157.8 Å²	157.8	80%	0.8	77%	0.769	S	S	*	*			trans	44.1	124.8	147.4	-60.5	178.4	178.8	176.3	0	122.8
235	Q	29	Very low	32.3	Very low	170 Å²	170	158 Å²	158	79%	0.794	77%	0.769	S	S	*	*				-150.8	142.8	116.7	-79.2	-160.9	84	0	0	107.9
236	R	27.4	Very low	31.9	Very low	210 Å²	210	156.7 Å²	156.7	79%	0.792	77%	0.766	S	S	*	*			cis	93.3	57.2	-3.7	-147	-141.5	-179.2	-156.2	0.8	121.2
237	R	31.9	Very low	32.1	Very low	228 Å²	228	159.3 Å²	159.3	86%	0.86	77%	0.769	S	S	*	*			trans	-134.5	123.9	138.4	-61.4	-173.8	-166.5	-170.9	3.8	108.2
238	S	27.1	Very low	32.7	Very low	89 Å²	89	160.7 Å²	160.7	62%	0.622	78%	0.778	S	S	*	*			cis	94.3	142.3	15	-161.4	0	0	0	0	115.7
239	I	31.8	Very low	33.4	Very low	154 Å²	154	163.1 Å²	163.1	79%	0.79	79%	0.786	S	S	*	*			trans	90.6	135	177.7	-59	171.1	0	0	0	114.8
240	V	28	Very low	34.1	Very low	110 Å²	110	161.1 Å²	161.1	67%	0.667	77%	0.772	S	S	*	*			cis	164.3	133.8	-40.5	148.9	0	0	0	0	108.2
241	R	31.6	Very low	35.1	Very low	239 Å²	239	159.1 Å²	159.1	90%	0.902	77%	0.769	S	S	*	*			trans	-167	151.7	134.9	-106.7	172.3	-171.1	110.7	-1.9	111.9
242	T	31.6	Very low	35.9	Very low	127 Å²	127	157.9 Å²	157.9	78%	0.779	76%	0.764	S	S	*	*			trans	-123.1	-175.2	-177	49.1	0	0	0	0	108.3
243	P	38.4	Very low	36.7	Very low	114 Å²	114	158.5 Å²	158.5	74%	0.74	76%	0.756	S	S	*	*			cis	-130.2	-179.9	-3.3	24	1.3	0	0	0	116
244	S	27.4	Very low	38	Very low	103 Å²	103	158.1 Å²	158.1	72%	0.72	75%	0.75	S	S	*	*			trans	-31.4	151.1	169.5	56.3	0	0	0	0	120.6
245	I	33.9	Very low	39.3	Very low	173 Å²	173	152.6 Å²	152.6	89%	0.887	73%	0.731	S	S	*	*				-142.6	155.6	124.1	-120.4	169.9	0	0	0	112.6
246	T	31.4	Very low	40.8	Very low	117 Å²	117	148.2 Å²	148.2	72%	0.718	72%	0.716	S	S	*	*			trans	-101.9	147.1	-160.1	44	0	0	0	0	114.4
247	R	38.9	Very low	42.2	Very low	209 Å²	209	140.9 Å²	140.9	79%	0.789	70%	0.7	S	S	*	*				177.8	77.5	122.9	-101.1	-176.1	163.1	-167.8	-3.9	114.8
248	Q	47.9	Very low	43.1	Very low	203 Å²	203	135.4 Å²	135.4	95%	0.949	69%	0.688	S	S	*	*			trans	-93	90.3	142.5	-86.4	-164.5	-5.3	0	0	108.8
249	Q	47.5	Very low	44.5	Very low	159 Å²	159	136.9 Å²	136.9	74%	0.743	69%	0.688	S	S	*	*			trans	-169.7	103.1	167.8	-106.9	-179.4	13.6	0	0	107.2
250	N	50	Low	45.2	Very low	63 Å²	63	137.8 Å²	137.8	34%	0.337	69%	0.686	S	S	.	*			trans	-174.6	-11.6	162.2	-119.5	-94.7	0	0	0	115.7	Q253 R254	N250-Q253 PolarHBondContact O-N 3.29Å; N250-R254 WeakPolarHBondContact O-CG 3.47Å; N250-R254 PolarHBondContact O-N 2.74Å
251	F	52.6	Low	46.1	Very low	171 Å²	171	142.7 Å²	142.7	75%	0.75	69%	0.693	S	S	*	*	H	α-helix	trans	-61.8	-52.2	-172.4	-167.7	-103.9	0	0	0	113.3	Q253 R254 V255	F251-Q253 VanDerWaalsContact C-N 3.3Å; F251-Q253 PolarHBondContact O-N 3.12Å; F251-R254 PolarHBondContact O-N 2.76Å; F251-R254 VanDerWaalsContact O-N 3.13Å; F251-V255 HydrophobicContact CD1-CG2 4.44Å; F251-V255 HydrophobicContact CE1-CG2 4.15Å; F251-V255 HydrophobicContact CZ-CG2 4.41Å; F251-V255 PolarHBondContact O-N 3.48Å
252	K	51.8	Low	46.5	Very low	183 Å²	183	140 Å²	140	80%	0.796	69%	0.687	S	S	*	*	H	α-helix	trans	-58.9	-38.7	175.5	-69.8	-170.3	176.3	-174.8	0	112.5	V255 V256	K252-V255 PolarHBondContact O-N 2.92Å; K252-V256 WeakPolarHBondContact O-CG2 3.37Å; K252-V256 PolarHBondContact O-N 2.84Å
253	Q	52.6	Low	46.9	Very low	134 Å²	134	144.8 Å²	144.8	63%	0.626	69%	0.691	S	S	*	*	H	α-helix	trans	-66.7	-37.2	175.5	-77.6	-178.9	-20.1	0	0	112.9	N250 F251 V256 A257	N250-Q253 PolarHBondContact O-N 3.29Å; F251-Q253 VanDerWaalsContact C-N 3.3Å; F251-Q253 PolarHBondContact O-N 3.12Å; Q253-V256 PolarHBondContact O-N 3.35Å; Q253-A257 VanDerWaalsContact O-CB 3.28Å; Q253-A257 WeakPolarHBondContact O-CB 3.38Å; Q253-A257 PolarHBondContact O-N 3.08Å
254	R	56.1	Low	46.6	Very low	180 Å²	180	145.9 Å²	145.9	68%	0.679	70%	0.696	S	S	*	*	H	α-helix	trans	-67	-37.1	174	-75.2	-179.8	175.3	-167	-3.6	112.6	N250 F251 A257 L258	N250-R254 WeakPolarHBondContact O-CG 3.47Å; N250-R254 PolarHBondContact O-N 2.74Å; F251-R254 PolarHBondContact O-N 2.76Å; F251-R254 VanDerWaalsContact O-N 3.13Å; R254-A257 PolarHBondContact O-N 2.92Å; R254-L258 PolarHBondContact O-N 3.16Å
255	V	58.4	Low	46.8	Very low	69 Å²	69	145.7 Å²	145.7	42%	0.418	69%	0.694	S	S	.	*	H	α-helix	trans	-65.2	-46.4	173.3	174.4	0	0	0	0	111	F251 K252 A257 L258 L259	F251-V255 HydrophobicContact CD1-CG2 4.44Å; F251-V255 HydrophobicContact CE1-CG2 4.15Å; F251-V255 HydrophobicContact CZ-CG2 4.41Å; F251-V255 PolarHBondContact O-N 3.48Å; K252-V255 PolarHBondContact O-N 2.92Å; V255-A257 VanDerWaalsContact C-N 3.33Å; V255-A257 PolarHBondContact O-N 3.08Å; V255-L258 WeakPolarHBondContact O-CB 3.36Å; V255-L258 PolarHBondContact O-N 3.48Å; V255-L258 VanDerWaalsContact O-N 3.11Å; V255-L259 HydrophobicContact CG1-CD1 4.16Å; V255-L259 WeakPolarHBondContact O-CG 3.32Å; V255-L259 PolarHBondContact O-N 2.89Å
256	V	59.3	Low	46.6	Very low	78 Å²	78	145.1 Å²	145.1	47%	0.473	69%	0.693	S	S	.	*	H	α-helix	trans	-63.6	-37.2	176	173	0	0	0	0	112	K252 Q253 L258 L259 K260	K252-V256 WeakPolarHBondContact O-CG2 3.37Å; K252-V256 PolarHBondContact O-N 2.84Å; Q253-V256 PolarHBondContact O-N 3.35Å; V256-L258 VanDerWaalsContact C-N 3.3Å; V256-L258 PolarHBondContact O-N 3.4Å; V256-L259 PolarHBondContact O-N 3.04Å; V256-K260 WeakPolarHBondContact O-CB 3.15Å; V256-K260 PolarHBondContact O-N 3.08Å
257	A	57.3	Low	46.7	Very low	56 Å²	56	147.9 Å²	147.9	46%	0.463	70%	0.698	S	S	.	*	H	α-helix	trans	-68.4	-26.7	174.2	0	0	0	0	0	113.3	Q253 R254 V255	Q253-A257 VanDerWaalsContact O-CB 3.28Å; Q253-A257 WeakPolarHBondContact O-CB 3.38Å; Q253-A257 PolarHBondContact O-N 3.08Å; R254-A257 PolarHBondContact O-N 2.92Å; V255-A257 VanDerWaalsContact C-N 3.33Å; V255-A257 PolarHBondContact O-N 3.08Å
258	L	50.7	Low	46.3	Very low	113 Å²	113	144 Å²	144	59%	0.592	70%	0.697	S	S	*	*	H	α-helix	trans	-74.7	-43.6	172.5	-146	79.4	0	0	0	111.1	R254 V255 V256 K260 R261	R254-L258 PolarHBondContact O-N 3.16Å; V255-L258 WeakPolarHBondContact O-CB 3.36Å; V255-L258 PolarHBondContact O-N 3.48Å; V255-L258 VanDerWaalsContact O-N 3.11Å; V256-L258 VanDerWaalsContact C-N 3.3Å; V256-L258 PolarHBondContact O-N 3.4Å; L258-K260 PolarHBondContact O-N 2.85Å; L258-R261 WeakPolarHBondContact O-CA 3.45Å; L258-R261 WeakPolarHBondContact O-CB 3.48Å; L258-R261 PolarHBondContact O-N 3.13Å
259	L	56.7	Low	45.5	Very low	120 Å²	120	141.4 Å²	141.4	63%	0.628	69%	0.689	S	S	*	*	H	α-helix	trans	-61.2	-41.7	175.2	-70.6	165.7	0	0	0	111.7	V255 V256 R261 F262	V255-L259 HydrophobicContact CG1-CD1 4.16Å; V255-L259 WeakPolarHBondContact O-CG 3.32Å; V255-L259 PolarHBondContact O-N 2.89Å; V256-L259 PolarHBondContact O-N 3.04Å; L259-R261 PolarHBondContact O-N 3.41Å; L259-R261 VanDerWaalsContact O-N 3.16Å; L259-F262 PolarHBondContact O-N 3.31Å
260	K	46.2	Very low	44.6	Very low	172 Å²	172	140.6 Å²	140.6	75%	0.748	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-3.3	172.2	-73.6	-165	174.9	-165.7	0	114.7	V256 L258	V256-K260 WeakPolarHBondContact O-CB 3.15Å; V256-K260 PolarHBondContact O-N 3.08Å; L258-K260 PolarHBondContact O-N 2.85Å
261	R	48.6	Very low	43.7	Very low	214 Å²	214	141.6 Å²	141.6	81%	0.808	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	-3.1	175.7	-105.2	-179.4	174.5	169.7	-0.9	114.7	L258 L259	L258-R261 WeakPolarHBondContact O-CA 3.45Å; L258-R261 WeakPolarHBondContact O-CB 3.48Å; L258-R261 PolarHBondContact O-N 3.13Å; L259-R261 PolarHBondContact O-N 3.41Å; L259-R261 VanDerWaalsContact O-N 3.16Å
262	F	39.8	Very low	42.6	Very low	181 Å²	181	141.5 Å²	141.5	79%	0.794	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119	-1.1	178.9	-88.6	-80.5	0	0	0	114.6	L259 V264	L259-F262 PolarHBondContact O-N 3.31Å; F262-V264 PolarHBondContact O-N 2.95Å
263	R	39.8	Very low	41.5	Very low	228 Å²	228	140.8 Å²	140.8	86%	0.86	70%	0.703	S	S	*	*			trans	-75.8	113.4	157.9	-93.3	-174	169.4	177.2	-3.9	108.8
264	V	32.1	Very low	40.2	Very low	138 Å²	138	141.2 Å²	141.2	84%	0.836	71%	0.709	S	S	*	*			trans	-74.1	135.1	155.4	177.2	0	0	0	0	106.6	F262	F262-V264 PolarHBondContact O-N 2.95Å
265	S	31	Very low	39.7	Very low	98 Å²	98	137.7 Å²	137.7	69%	0.685	71%	0.71	S	S	*	*			trans	-76.2	137.2	171.7	-60.7	0	0	0	0	109.9
266	D	30.6	Very low	38.3	Very low	161 Å²	161	138.2 Å²	138.2	86%	0.861	72%	0.722	S	S	*	*			trans	-123.9	102.8	163.5	-150.8	-3.5	0	0	0	106.1
267	E	33.2	Very low	36.9	Very low	176 Å²	176	143.1 Å²	143.1	82%	0.822	74%	0.739	S	S	*	*			trans	-137.1	82.2	-176.8	-84.7	-174.3	-132.6	0	0	109.3
268	V	30.3	Very low	35.8	Very low	127 Å²	127	145.4 Å²	145.4	77%	0.77	75%	0.75	S	S	*	*			trans	-137.5	97.8	155.7	-175.6	0	0	0	0	108.7
269	L	31.5	Very low	35.6	Very low	148 Å²	148	145.1 Å²	145.1	78%	0.775	75%	0.754	S	S	*	*			trans	44.6	120.2	146.8	-59.9	169.4	0	0	0	120.4
270	D	28.5	Very low	34.9	Very low	143 Å²	143	144.4 Å²	144.4	77%	0.765	76%	0.757	S	S	*	*				44.6	135.8	106.7	-104.9	-42.1	0	0	0	119.5
271	S	31.1	Very low	34.5	Very low	83 Å²	83	144.9 Å²	144.9	58%	0.58	76%	0.762	S	S	*	*			cis	-156	168.8	14	-56.8	0	0	0	0	112.6
272	E	30	Very low	33.7	Very low	169 Å²	169	140.6 Å²	140.6	79%	0.79	76%	0.759	S	S	*	*			trans	65.9	149.5	157.1	-69.2	177.6	158.1	0	0	118.3
273	Q	27.8	Very low	33.3	Very low	168 Å²	168	140 Å²	140	79%	0.785	76%	0.759	S	S	*	*			cis	-149.5	157.3	4.2	-138.3	162.7	25.6	0	0	112.5
274	D	25.6	Very low	33.2	Very low	143 Å²	143	137.6 Å²	137.6	77%	0.765	76%	0.757	S	S	*	*			trans	-88.1	174.5	168.7	-156.3	41.8	0	0	0	109.7
275	P	46.4	Very low	33.1	Very low	107 Å²	107	139.9 Å²	139.9	70%	0.695	76%	0.759	S	S	*	*			cis	-124.1	-163.1	-0.4	40.3	-19.4	0	0	0	112.1
276	A	27.9	Very low	33.2	Very low	80 Å²	80	141.9 Å²	141.9	66%	0.661	76%	0.762	S	S	*	*			cis	-154.6	140.4	13.8	0	0	0	0	0	113.6
277	E	29.7	Very low	33.4	Very low	181 Å²	181	141 Å²	141	85%	0.846	76%	0.756	S	S	*	*				24.9	155.4	99.8	-87.4	-148.6	156.6	0	0	122
278	P	35	Very low	33.4	Very low	104 Å²	104	139.2 Å²	139.2	68%	0.675	75%	0.753	S	S	*	*				-132.6	-101.5	-51.3	27.4	-3.4	0	0	0	117.3
279	P	45.2	Very low	33.7	Very low	106 Å²	106	141.1 Å²	141.1	69%	0.688	76%	0.757	S	S	*	*				-133.6	-139.2	-125.2	45.9	-22.3	0	0	0	111.2
280	P	43	Very low	33.9	Very low	105 Å²	105	140.7 Å²	140.7	68%	0.682	76%	0.756	S	S	*	*			cis	-130	-174.8	-22.1	36.2	-16.7	0	0	0	114.9
281	E	37.2	Very low	34.1	Very low	182 Å²	182	138.2 Å²	138.2	85%	0.85	75%	0.75	S	S	*	*			trans	-67.6	158.4	154.3	-62.7	143.6	140	0	0	111.3
282	V	31.3	Very low	34.6	Very low	125 Å²	125	139.8 Å²	139.8	76%	0.758	76%	0.756	S	S	*	*			trans	-139.4	113.3	155.5	-179	0	0	0	0	108.7
283	E	33.1	Very low	34.9	Very low	168 Å²	168	139.5 Å²	139.5	79%	0.785	75%	0.754	S	S	*	*			trans	17.6	138.9	140.3	-63	161.4	145.1	0	0	121.5
284	E	36.5	Very low	35.2	Very low	178 Å²	178	140.3 Å²	140.3	83%	0.832	76%	0.756	S	S	*	*				14.3	126.4	128.7	-46.8	-71.4	123.5	0	0	118.6
285	E	31.4	Very low	35.8	Very low	186 Å²	186	141.3 Å²	141.3	87%	0.869	76%	0.756	S	S	*	*				179.8	116.6	120.3	-100.8	-177.9	175.9	0	0	112.9
286	D	31.4	Very low	35.2	Very low	140 Å²	140	143.7 Å²	143.7	75%	0.749	76%	0.763	S	S	*	*				67.4	160.6	122.1	-142	14.8	0	0	0	124.2
287	L	34.6	Very low	36.3	Very low	141 Å²	141	144.5 Å²	144.5	74%	0.738	76%	0.761	S	S	*	*			trans	83	129.2	160.9	-58.3	177.9	0	0	0	123.7
288	D	32.9	Very low	36.7	Very low	140 Å²	140	140.8 Å²	140.8	75%	0.749	76%	0.755	S	S	*	*			trans	-52	149.2	171.7	-49.9	-70.5	0	0	0	117.7
289	L	37.8	Very low	36.9	Very low	166 Å²	166	142.3 Å²	142.3	87%	0.869	76%	0.758	S	S	*	*				-175.7	121	114.5	-126	65.5	0	0	0	115.9
290	D	35.6	Very low	36.6	Very low	140 Å²	140	142.1 Å²	142.1	75%	0.749	76%	0.759	S	S	*	*				33.6	150	129.5	-142.4	-25.6	0	0	0	124.5
291	S	33.1	Very low	36.1	Very low	91 Å²	91	143 Å²	143	64%	0.636	77%	0.766	S	S	*	*			trans	78.9	136.4	148.9	-71	0	0	0	0	120.1
292	V	41.8	Very low	37.1	Very low	116 Å²	116	139.9 Å²	139.9	70%	0.703	76%	0.762	S	S	*	*			cis	-156.7	157.9	-1.7	-105.9	0	0	0	0	112.6
293	E	35.8	Very low	37.4	Very low	162 Å²	162	141.6 Å²	141.6	76%	0.757	76%	0.761	S	S	*	*			trans	55.7	128.7	148	-66.6	174.1	170.2	0	0	120.4
294	F	34.9	Very low	38.5	Very low	185 Å²	185	140 Å²	140	81%	0.811	76%	0.758	S	S	*	*				-155.1	145.5	63.4	-125	-88.8	0	0	0	114.2
295	E	37.5	Very low	38.9	Very low	165 Å²	165	137.9 Å²	137.9	77%	0.771	75%	0.752	S	S	*	*			trans	-96.2	161.9	175.2	-66.4	-173.4	105.7	0	0	114.1
296	N	34.2	Very low	39.8	Very low	157 Å²	157	137.1 Å²	137.1	84%	0.84	75%	0.754	S	S	*	*				-160.3	142.1	126.4	-104.2	-71.8	0	0	0	110.6
297	P	50.6	Low	40.6	Very low	96 Å²	96	137.8 Å²	137.8	62%	0.623	76%	0.757	S	S	*	*			trans	-114.6	-177.7	-163.9	42.9	-36.7	0	0	0	116.8
298	S	37.7	Very low	40.8	Very low	104 Å²	104	137.7 Å²	137.7	73%	0.727	76%	0.758	S	S	*	*			trans	72.7	153	155.6	-77.4	0	0	0	0	118.7
299	D	39.8	Very low	41	Very low	135 Å²	135	135.4 Å²	135.4	72%	0.722	75%	0.753	S	S	*	*			cis	-171.1	173.4	-9.8	-121.5	-79.2	0	0	0	109.2
300	S	38.3	Very low	41.1	Very low	102 Å²	102	133.2 Å²	133.2	71%	0.713	75%	0.746	S	S	*	*			cis	-151.1	-163.4	-0.9	-61.1	0	0	0	0	110.4
301	C	32.2	Very low	41	Very low	124 Å²	124	133.8 Å²	133.8	84%	0.838	75%	0.748	S	S	*	*			trans	-143.4	-171.7	173.2	-121.8	0	0	0	0	110.8
302	P	59.2	Low	41	Very low	117 Å²	117	134.9 Å²	134.9	76%	0.76	76%	0.756	S	S	*	*			cis	-135.6	-87.9	12.9	36.3	-11.6	0	0	0	118.8
303	E	36.8	Very low	41.3	Very low	160 Å²	160	135.5 Å²	135.5	75%	0.748	76%	0.76	S	S	*	*			trans	-138.4	161.5	-152.1	-78.2	175.4	97.1	0	0	116.4
304	L	57.3	Low	41.4	Very low	135 Å²	135	133.8 Å²	133.8	71%	0.707	76%	0.763	S	S	*	*			trans	27.4	161.6	132.4	-51	-179.4	0	0	0	122
305	D	43.7	Very low	42.1	Very low	134 Å²	134	134.3 Å²	134.3	72%	0.717	77%	0.765	S	S	*	*			cis	-164.5	174.9	-9.5	-111.8	-26.3	0	0	0	108.3
306	D	49.6	Very low	41.9	Very low	170 Å²	170	132.4 Å²	132.4	91%	0.909	77%	0.767	S	S	*	*			trans	175.8	164.3	141.1	-101.5	-23.7	0	0	0	116.4
307	D	48.9	Very low	41.9	Very low	153 Å²	153	135 Å²	135	82%	0.818	77%	0.771	S	S	*	*			trans	-81.6	178.8	-167.8	-111.8	-51.1	0	0	0	116.3
308	D	39.7	Very low	41.4	Very low	139 Å²	139	138.5 Å²	138.5	74%	0.743	78%	0.783	S	S	*	*			cis	-166.8	158.1	48	-165	-40.2	0	0	0	113.3
309	S	36.2	Very low	41.4	Very low	93 Å²	93	142.9 Å²	142.9	65%	0.65	79%	0.789	S	S	*	*			trans	107.3	-159	141.9	-97.9	0	0	0	0	123.5
310	V	40.7	Very low	42	Very low	120 Å²	120	140.7 Å²	140.7	73%	0.727	78%	0.782	S	S	*	*			trans	-146.3	163.8	-131.5	-67.9	0	0	0	0	114.2
311	L	34.1	Very low	41.8	Very low	152 Å²	152	146.3 Å²	146.3	80%	0.796	79%	0.789	S	S	*	*			cis	-164.7	-177.1	-4.9	-119.5	172.1	0	0	0	111.8
312	S	32.5	Very low	42.9	Very low	114 Å²	114	149.4 Å²	149.4	80%	0.797	79%	0.789	S	S	*	*			trans	97.2	144.4	162.7	-52.5	0	0	0	0	118.3
313	T	48.1	Very low	41.6	Very low	128 Å²	128	152.8 Å²	152.8	79%	0.785	80%	0.795	S	S	*	*			trans	-122.8	160.7	-162.4	71.3	0	0	0	0	114.1
314	P	37.3	Very low	41.2	Very low	126 Å²	126	148 Å²	148	82%	0.818	79%	0.788	S	S	*	*				-139.5	167.6	94.6	37.8	-24.6	0	0	0	115.7
315	K	48.8	Very low	40	Very low	196 Å²	196	149.6 Å²	149.6	85%	0.852	80%	0.797	S	S	*	*			trans	-91.8	138.8	-173.3	-65.7	176.8	176.8	176	0	115
316	P	35.3	Very low	39.5	Very low	126 Å²	126	148.2 Å²	148.2	82%	0.818	80%	0.797	S	S	*	*			trans	-89.4	175.9	146.6	34	-29.1	0	0	0	112
317	K	32.5	Very low	38.7	Very low	210 Å²	210	148.5 Å²	148.5	91%	0.913	80%	0.798	S	S	*	*			trans	-120.4	163.2	-167.8	-61	176	-176.2	173.6	0	113.2
318	L	41.7	Very low	37.7	Very low	170 Å²	170	146.3 Å²	146.3	89%	0.89	80%	0.795	S	S	*	*			trans	-124.9	172.3	175.5	-108.1	174.7	0	0	0	111.8
319	K	36.4	Very low	37.3	Very low	197 Å²	197	144.1 Å²	144.1	86%	0.857	79%	0.79	S	S	*	*			trans	73	157.9	175.5	-87.1	-168.8	175.9	-170.9	0	117.6
320	P	53.6	Low	37	Very low	88 Å²	88	144 Å²	144	57%	0.571	79%	0.79	S	S	*	*			cis	-124.2	-172.1	-16.1	39.6	-23.8	0	0	0	112
321	Y	32.6	Very low	36.5	Very low	220 Å²	220	146.8 Å²	146.8	86%	0.863	80%	0.795	S	S	*	*				-172	130.8	108.9	-94.3	-67.1	0	0	0	109.7
322	F	55	Low	36.3	Very low	189 Å²	189	144.9 Å²	144.9	83%	0.829	79%	0.79	S	S	*	*			trans	-139.4	161.3	176.2	-131.6	-78.2	0	0	0	106.4
323	E	33.1	Very low	36.2	Very low	188 Å²	188	147 Å²	147	88%	0.879	79%	0.787	S	S	*	*			trans	67.6	144.7	173.1	-58.4	157.1	166.1	0	0	114.6
324	G	28.8	Very low	35.3	Very low	60 Å²	60	148.2 Å²	148.2	62%	0.619	79%	0.787	S	S	*	*			cis	172.5	-172	-4	0	0	0	0	0	110.7
325	L	31.3	Very low	34.8	Very low	169 Å²	169	145.6 Å²	145.6	89%	0.885	78%	0.783	S	S	*	*			trans	69.7	123.9	175.8	-46.1	177.5	0	0	0	113.3
326	S	33.8	Very low	33.8	Very low	104 Å²	104	141.4 Å²	141.4	73%	0.727	78%	0.778	S	S	*	*				86.4	126.9	51.2	-65.2	0	0	0	0	114.1
327	L	31.9	Very low	33.7	Very low	176 Å²	176	142.1 Å²	142.1	92%	0.921	77%	0.774	S	S	*	*			trans	84.3	150.8	167.1	-52.6	177.7	0	0	0	120
328	S	28.1	Very low	33.5	Very low	107 Å²	107	140.9 Å²	140.9	75%	0.748	77%	0.771	S	S	*	*			trans	82.4	97.1	156.5	-120.8	0	0	0	0	122.9
329	S	30.6	Very low	33	Very low	93 Å²	93	138.4 Å²	138.4	65%	0.65	77%	0.768	S	S	*	*				61	121.6	116.5	66.4	0	0	0	0	123.4
330	S	31.8	Very low	32.7	Very low	92 Å²	92	134 Å²	134	64%	0.643	76%	0.762	S	S	*	*				74.2	125.7	128	63	0	0	0	0	123
331	Q	28.6	Very low	31.6	Very low	177 Å²	177	141.1 Å²	141.1	83%	0.827	78%	0.778	S	S	*	*			trans	70.6	144.4	142.2	-67.6	175	-26.9	0	0	117.6
332	T	30.2	Very low	31.6	Very low	112 Å²	112	135 Å²	135	69%	0.687	77%	0.767	S	S	*	*			cis	-154.7	152.4	-0.9	1.3	0	0	0	0	111.9
333	E	29.7	Very low	30.5	Very low	159 Å²	159	134.2 Å²	134.2	74%	0.743	77%	0.766	S	S	*	*			trans	51.5	123.2	142.2	-71.2	-178.7	162.7	0	0	125.6
334	I	31	Very low	30.4	Very low	153 Å²	153	136.5 Å²	136.5	79%	0.785	77%	0.766	S	S	*	*				72	119.9	125.7	-58.3	168.7	0	0	0	121.3
335	G	26.3	Very low	30.5	Very low	72 Å²	72	142.7 Å²	142.7	74%	0.742	78%	0.779	S	S	*	*			trans	86.9	167.5	145.3	0	0	0	0	0	117.8
336	S	27.3	Very low	31.5	Very low	107 Å²	107	139.9 Å²	139.9	75%	0.748	77%	0.771	S	S	*	*			cis	-160.8	144.9	-17.9	-165.2	0	0	0	0	111.6
337	I	32.7	Very low	32	Very low	142 Å²	142	140.8 Å²	140.8	73%	0.728	77%	0.774	S	S	*	*			trans	25.2	120	152.8	-56.7	168.6	0	0	0	119.9
338	H	30	Very low	32.1	Very low	183 Å²	183	137.5 Å²	137.5	85%	0.847	77%	0.766	S	S	*	*			trans	24.4	146.1	145.8	-64.7	110.7	0	0	0	123.9
339	S	31.1	Very low	33	Very low	118 Å²	118	137.5 Å²	137.5	83%	0.825	76%	0.763	S	S	*	*			trans	100.8	131.1	141.2	-159.4	0	0	0	0	118.6
340	S	29.6	Very low	32.9	Very low	106 Å²	106	140.4 Å²	140.4	74%	0.741	77%	0.771	S	S	*	*			trans	-71.4	157.7	179.3	48.2	0	0	0	0	114.2
341	R	30.2	Very low	32.8	Very low	237 Å²	237	142.1 Å²	142.1	89%	0.894	77%	0.773	S	S	*	*				172.3	100.9	107.9	-168.3	175.2	-161.9	175.4	4.2	115.2
342	S	33.3	Very low	33.1	Very low	90 Å²	90	140.5 Å²	140.5	63%	0.629	77%	0.769	S	S	*	*			trans	35.8	136.6	146.5	-139.5	0	0	0	0	125.1
343	H	31.5	Very low	33.1	Very low	174 Å²	174	140.2 Å²	140.2	81%	0.806	76%	0.763	S	S	*	*			trans	108.2	135	141.1	-69.5	-55	0	0	0	123.2
344	R	31	Very low	33.2	Very low	236 Å²	236	140.5 Å²	140.5	89%	0.891	76%	0.762	S	S	*	*			trans	79.3	85.8	156.2	-76	-177.6	173.9	172.5	-1.4	120.6
345	E	30.2	Very low	33.2	Very low	189 Å²	189	139 Å²	139	88%	0.883	76%	0.76	S	S	*	*				12.4	153.1	128.1	-71.1	-179.4	119.1	0	0	123.2
346	P	52.3	Low	33.3	Very low	110 Å²	110	144.8 Å²	144.8	71%	0.714	77%	0.765	S	S	*	*			trans	-108.7	-159.1	-163.8	38.4	-20.5	0	0	0	113.3
347	P	45.4	Very low	33.3	Very low	123 Å²	123	146 Å²	146	80%	0.799	77%	0.772	S	S	*	*				-143.9	173.7	102.1	41.1	-28.1	0	0	0	115.9
348	S	33.1	Very low	33	Very low	107 Å²	107	142.5 Å²	142.5	75%	0.748	77%	0.77	S	S	*	*			trans	-82.3	-160.5	163.2	-29.7	0	0	0	0	110
349	P	47.5	Very low	32.8	Very low	107 Å²	107	141.4 Å²	141.4	70%	0.695	77%	0.771	S	S	*	*			cis	-153.5	-170.8	24.3	47.6	-25.8	0	0	0	118.9
350	L	29	Very low	32.7	Very low	155 Å²	155	140.8 Å²	140.8	81%	0.812	77%	0.767	S	S	*	*			trans	66.4	163.4	156.2	-60.7	178.6	0	0	0	120.6
351	D	29.8	Very low	32.8	Very low	127 Å²	127	142.3 Å²	142.3	68%	0.679	77%	0.772	S	S	*	*				-172.9	153.6	-52.2	-133.1	-20.1	0	0	0	111.5
352	L	33.1	Very low	32.9	Very low	144 Å²	144	140.7 Å²	140.7	75%	0.754	77%	0.772	S	S	*	*			trans	58.1	155.6	158.1	-97.8	74.3	0	0	0	119.8
353	D	31.8	Very low	32.7	Very low	105 Å²	105	141.3 Å²	141.3	56%	0.561	78%	0.782	S	S	*	*			cis	-167.2	168.1	-7.1	-164.3	3.2	0	0	0	111.2
354	K	32	Very low	32.7	Very low	166 Å²	166	140.2 Å²	140.2	72%	0.722	78%	0.782	S	S	*	*			trans	68.1	152.6	160.8	-69.3	158.9	-178.6	104.2	0	118.5
355	T	29.4	Very low	32.8	Very low	120 Å²	120	136.6 Å²	136.6	74%	0.736	78%	0.781	S	S	*	*			cis	-156	145	1.1	-3.1	0	0	0	0	114.7
356	K	29.7	Very low	32.8	Very low	194 Å²	194	130.6 Å²	130.6	84%	0.843	77%	0.769	S	S	*	*			trans	42.2	118.8	141.4	-78.9	-177.2	176.6	-173.9	0	124.6
357	C	26.7	Very low	31.6	Very low	133 Å²	133	129.4 Å²	129.4	90%	0.899	78%	0.777	S	S	*	*				78.1	144.8	111.7	-152.4	0	0	0	0	122.8
358	G	25.7	Very low	30.9	Very low	68 Å²	68	134.6 Å²	134.6	70%	0.701	78%	0.78	S	S	*	*			trans	120.4	82.5	177.9	0	0	0	0	0	111.5
359	D	26.5	Very low	30.8	Very low	161 Å²	161	136.7 Å²	136.7	86%	0.861	78%	0.783	S	S	*	*				75.8	135.5	70	-160.2	20.9	0	0	0	113.8
360	S	29.9	Very low	29.9	Very low	105 Å²	105	139.2 Å²	139.2	73%	0.734	79%	0.791	S	S	*	*			trans	-152.4	143.9	-165.7	59.3	0	0	0	0	114.5
361	T	29.9	Very low	29.9	Very low	138 Å²	138	136.2 Å²	136.2	85%	0.847	79%	0.789	S	S	*	*			trans	-134.6	148.4	-175.8	-44	0	0	0	0	111.6
362	F	34.1	Very low	29.6	Very low	203 Å²	203	135.9 Å²	135.9	89%	0.89	79%	0.791	S	S	*	*			trans	-91.9	150.1	-171.3	-61.7	-101.2	0	0	0	114.5
363	A	27.8	Very low	29.4	Very low	103 Å²	103	138.7 Å²	138.7	85%	0.851	80%	0.798	S	S	*	*			trans	176	166.4	142.7	0	0	0	0	0	110.3
364	D	32.3	Very low	29	Very low	151 Å²	151	142.5 Å²	142.5	81%	0.807	81%	0.812	S	S	*	*			cis	-172.4	153	-42.6	-170.5	23.9	0	0	0	108.5
365	D	33	Very low	28.8	Very low	160 Å²	160	143.4 Å²	143.4	86%	0.856	82%	0.819	S	S	*	*			trans	53.2	167.8	169.4	-142.3	30.5	0	0	0	117.3
366	G	29.6	Very low	29.6	Very low	62 Å²	62	142.2 Å²	142.2	64%	0.639	81%	0.813	S	S	*	*			cis	171.5	158.5	-6.6	0	0	0	0	0	110.8
367	G	27.7	Very low	29.4	Very low	85 Å²	85	141.3 Å²	141.3	88%	0.876	81%	0.812	S	S	*	*			trans	144.9	147.4	166.2	0	0	0	0	0	118.2
368	R	31.3	Very low	29.5	Very low	232 Å²	232	139.3 Å²	139.3	88%	0.875	81%	0.805	S	S	*	*			trans	-104.9	166.2	174.7	-68.4	167.4	149.1	163.6	-8	111
369	D	30.3	Very low	29.7	Very low	152 Å²	152	142.1 Å²	142.1	81%	0.813	81%	0.809	S	S	*	*				-177.1	174.8	106.7	-97.1	-15.4	0	0	0	115
370	N	29	Very low	29.6	Very low	159 Å²	159	140.2 Å²	140.2	85%	0.85	80%	0.803	S	S	*	*			trans	-111.9	136.8	-169	-66.2	-51.3	0	0	0	114.2
371	A	28	Very low	30.7	Very low	93 Å²	93	140 Å²	140	77%	0.769	80%	0.799	S	S	*	*			trans	-165.1	141.4	146.5	0	0	0	0	0	108.2
372	T	24	Very low	30.6	Very low	119 Å²	119	139.4 Å²	139.4	73%	0.73	80%	0.795	S	S	*	*			cis	97.9	92.7	25.1	-56.3	0	0	0	0	114
373	F	28.3	Very low	30.4	Very low	203 Å²	203	134.8 Å²	134.8	89%	0.89	78%	0.784	S	S	*	*			trans	59.9	151.1	160.3	-77.8	-107.1	0	0	0	116.9
374	E	23.8	Very low	30.4	Very low	186 Å²	186	138 Å²	138	87%	0.869	78%	0.781	S	S	*	*			cis	-140.8	-168.6	26.7	-74	-169.5	116.7	0	0	114.4
375	Q	28.5	Very low	30.4	Very low	185 Å²	185	139.3 Å²	139.3	86%	0.864	79%	0.787	S	S	*	*			trans	-87.5	-163.2	167.2	-117.5	-177.3	-1.2	0	0	110.3
376	P	45.3	Very low	30.3	Very low	94 Å²	94	140.2 Å²	140.2	61%	0.61	79%	0.786	S	S	*	*			cis	-139.4	-164	3.8	39.9	-16.9	0	0	0	116.6
377	E	25.8	Very low	30.2	Very low	175 Å²	175	145.3 Å²	145.3	82%	0.818	80%	0.796	S	S	*	*			trans	66.4	101.7	143.3	-80.5	169.9	153.9	0	0	125.4
378	A	28.7	Very low	30.2	Very low	91 Å²	91	148 Å²	148	75%	0.752	79%	0.79	S	S	*	*				49.2	163.5	101.6	0	0	0	0	0	125.3
379	V	29.3	Very low	30.2	Very low	128 Å²	128	143.9 Å²	143.9	78%	0.776	79%	0.785	S	S	*	*			trans	97.5	88.2	157.8	-166.4	0	0	0	0	120.4
380	T	25.3	Very low	30.4	Very low	120 Å²	120	143.7 Å²	143.7	74%	0.736	78%	0.781	S	S	*	*				10.8	168.5	125.2	61.6	0	0	0	0	123.2
381	P	51.9	Low	30.4	Very low	102 Å²	102	141.5 Å²	141.5	66%	0.662	77%	0.77	S	S	*	*			cis	-144.6	-150.1	-38.9	40.9	-18.9	0	0	0	113.6
382	T	27.9	Very low	30.8	Very low	125 Å²	125	141.2 Å²	141.2	77%	0.767	76%	0.759	S	S	*	*			trans	80.7	151	169.1	74.4	0	0	0	0	117.5
383	T	29.6	Very low	30.9	Very low	106 Å²	106	144.7 Å²	144.7	65%	0.65	76%	0.764	S	S	*	*			cis	-148.9	149.8	6.8	-24.6	0	0	0	0	113.6
384	E	28.6	Very low	31.3	Very low	169 Å²	169	140 Å²	140	79%	0.79	75%	0.748	S	S	*	*			trans	20.4	138.1	152.6	-71.2	150.5	-139	0	0	124.8
385	L	31.6	Very low	31.6	Very low	180 Å²	180	137.2 Å²	137.2	94%	0.942	74%	0.735	S	S	*	*				-160.9	153.1	112.5	-103	172.7	0	0	0	111
386	E	30.8	Very low	31.7	Very low	178 Å²	178	137.6 Å²	137.6	83%	0.832	73%	0.728	S	S	*	*			trans	-111	161.6	-170	-56	-178.8	124.2	0	0	114
387	M	29.3	Very low	30.8	Very low	170 Å²	170	140.5 Å²	140.5	84%	0.837	74%	0.737	S	S	*	*			trans	-167.2	137.8	140.8	-110.1	173.8	73.6	0	0	114.9
388	D	27.3	Very low	32.1	Very low	142 Å²	142	137.2 Å²	137.2	76%	0.759	73%	0.731	S	S	*	*			trans	65.3	135.4	159.9	-74.4	-15.8	0	0	0	125.2
389	N	31.7	Very low	32.8	Very low	144 Å²	144	138.6 Å²	138.6	77%	0.77	73%	0.733	S	S	*	*			trans	-88.9	-173	169.4	-57.2	-72.4	0	0	0	110.1
390	M	33.1	Very low	32.7	Very low	149 Å²	149	137.7 Å²	137.7	73%	0.734	73%	0.732	S	S	*	*			cis	-147.6	-179.1	10.8	-38.4	-97.1	-60.8	0	0	106.8
391	D	30.4	Very low	32.8	Very low	113 Å²	113	135 Å²	135	60%	0.604	73%	0.729	S	S	*	*			cis	-156.9	145.9	-9.6	-121.3	-4.2	0	0	0	105.1
392	T	34.9	Very low	31.7	Very low	87 Å²	87	140.1 Å²	140.1	53%	0.534	74%	0.74	S	S	.	*				85.2	116.7	54.7	-52.9	0	0	0	0	115	L394	T392-L394 HydrophobicContact CG2-CD1 3.6Å; T392-L394 HydrophobicContact CG2-CD2 4.49Å; T392-L394 HydrophobicContact CG2-CG 3.72Å
393	F	28	Very low	31.7	Very low	191 Å²	191	142.1 Å²	142.1	84%	0.838	74%	0.743	S	S	*	*			trans	-174.6	98.6	134.8	-112	-81.7	0	0	0	106.7
394	L	35.1	Very low	31.6	Very low	106 Å²	106	142.3 Å²	142.3	56%	0.555	74%	0.744	S	S	*	*				72.6	139.8	75.9	-64.5	167.8	0	0	0	112.9	T392	T392-L394 HydrophobicContact CG2-CD1 3.6Å; T392-L394 HydrophobicContact CG2-CD2 4.49Å; T392-L394 HydrophobicContact CG2-CG 3.72Å
395	E	31.6	Very low	31.6	Very low	127 Å²	127	143.2 Å²	143.2	59%	0.593	75%	0.745	S	S	*	*			cis	-158.1	147.1	16.6	-149	164.8	124.6	0	0	116.9
396	R	30.5	Very low	31.5	Very low	193 Å²	193	139.2 Å²	139.2	73%	0.728	73%	0.729	S	S	*	*			trans	35.1	162.8	146.7	-69.3	174.6	179.3	118.2	2.1	124.5
397	L	25.4	Very low	31.3	Very low	154 Å²	154	139 Å²	139	81%	0.806	73%	0.727	S	S	*	*			cis	-175.5	170.5	-40.5	-103.1	-171.2	0	0	0	108.2
398	P	53.4	Low	31.3	Very low	106 Å²	106	135.2 Å²	135.2	69%	0.688	72%	0.718	S	S	*	*			trans	-96.5	-163.6	-170.7	40.3	-37.7	0	0	0	114.8
399	P	42.8	Very low	31.4	Very low	120 Å²	120	135.5 Å²	135.5	78%	0.779	72%	0.719	S	S	*	*				-154.9	168.7	102.2	40.7	-23.1	0	0	0	119
400	S	28.5	Very low	31.3	Very low	110 Å²	110	135.1 Å²	135.1	77%	0.769	72%	0.715	S	S	*	*			trans	68.8	142.7	163.9	-158.9	0	0	0	0	117.6
401	G	27.2	Very low	31	Very low	64 Å²	64	134.9 Å²	134.9	66%	0.66	72%	0.715	S	S	*	*			cis	113.1	122.8	11.6	0	0	0	0	0	109.9
402	K	27.8	Very low	30.6	Very low	208 Å²	208	134.9 Å²	134.9	90%	0.904	72%	0.724	S	S	*	*				-158.3	174.2	63.1	-75.2	169.5	-179	174.5	0	114.3
403	M	28	Very low	30.1	Very low	168 Å²	168	135.7 Å²	135.7	83%	0.828	73%	0.734	S	S	*	*			trans	-66.1	175.6	173.3	-52.6	140.6	63.6	0	0	113.5
404	T	27	Very low	29.9	Very low	109 Å²	109	133.2 Å²	133.2	67%	0.669	73%	0.729	S	S	*	*			cis	-164.1	166	15.3	-17.1	0	0	0	0	111.6
405	K	29.9	Very low	29.5	Very low	189 Å²	189	138 Å²	138	82%	0.822	74%	0.74	S	S	*	*			trans	23.4	148.4	140	-92.5	-165.6	174.4	-171.8	0	121.6
406	T	28.4	Very low	29.2	Very low	96 Å²	96	139.2 Å²	139.2	59%	0.589	75%	0.745	S	S	*	*			cis	-159	178.7	14.4	-18.2	0	0	0	0	111.9
407	E	26.7	Very low	29	Very low	172 Å²	172	136.9 Å²	136.9	80%	0.804	74%	0.743	S	S	*	*			trans	-6.3	157.3	144.3	-70.6	156.7	-175	0	0	120.4
408	S	29.5	Very low	28.9	Very low	92 Å²	92	134.6 Å²	134.6	64%	0.643	75%	0.746	S	S	*	*			cis	-176.2	-176.5	-12.5	58.8	0	0	0	0	111.5
409	L	30	Very low	27.8	Very low	148 Å²	148	137 Å²	137	78%	0.775	75%	0.745	S	S	*	*			trans	82.7	135.2	152.5	-72.3	167.5	0	0	0	124.2
410	I	28.6	Very low	27.1	Very low	135 Å²	135	139 Å²	139	69%	0.692	75%	0.748	S	S	*	*			trans	91.6	94	139.6	-69.3	164.8	0	0	0	122.9
411	I	27.4	Very low	26.9	Very low	145 Å²	145	138.7 Å²	138.7	74%	0.744	75%	0.753	S	S	*	*				59.1	132.9	117.9	-59.6	164	0	0	0	123.2
412	S	22.6	Very low	26.9	Very low	112 Å²	112	138.7 Å²	138.7	78%	0.783	75%	0.753	S	S	*	*			trans	77.3	157	150.5	70	0	0	0	0	121.8
413	S	24.4	Very low	27	Very low	105 Å²	105	139.3 Å²	139.3	73%	0.734	75%	0.75	S	S	*	*			cis	-173.9	158.3	-30.2	-174.4	0	0	0	0	112.6
414	N	22.8	Very low	27.1	Very low	139 Å²	139	141.7 Å²	141.7	74%	0.743	75%	0.75	S	S	*	*			trans	91.1	144	139.8	-127.9	-12.5	0	0	0	123.7
415	R	27.5	Very low	27.1	Very low	206 Å²	206	140.1 Å²	140.1	78%	0.777	76%	0.755	S	S	*	*			trans	64.8	151.6	154	-78.4	-168.8	157.8	170.9	-2.3	121.3
416	Q	24.2	Very low	27.1	Very low	153 Å²	153	142.4 Å²	142.4	72%	0.715	76%	0.758	S	S	*	*			cis	-161.4	174.6	-28.4	-141	171.6	-26.7	0	0	110.3
417	E	26	Very low	27.3	Very low	144 Å²	144	142.8 Å²	142.8	67%	0.673	77%	0.765	S	S	*	*			trans	-63.3	152.7	-179.8	-75.3	-178.7	90.7	0	0	116.4	K419	E417-K419 WeakPolarHBondContact OE1-CE 3.27Å; E417-K419 IonicContact OE1-NZ 3.02Å; E417-K419 PolarHBondContact OE1-NZ 3.37Å
418	A	25.4	Very low	27.4	Very low	105 Å²	105	140.8 Å²	140.8	87%	0.868	77%	0.765	S	S	*	*			trans	-146.9	157.9	144.5	0	0	0	0	0	110.5
419	K	28.8	Very low	27.4	Very low	156 Å²	156	141.5 Å²	141.5	68%	0.678	77%	0.77	S	S	*	*			trans	-128.6	138.6	-162.5	-96	173.3	176.1	129.3	0	116.1	E417	E417-K419 WeakPolarHBondContact OE1-CE 3.27Å; E417-K419 IonicContact OE1-NZ 3.02Å; E417-K419 PolarHBondContact OE1-NZ 3.37Å
420	L	29	Very low	27.3	Very low	162 Å²	162	142 Å²	142	85%	0.848	77%	0.772	S	S	*	*			trans	77.8	149.1	140.5	-68.8	168.3	0	0	0	123.1
421	A	24.8	Very low	27.4	Very low	104 Å²	104	143.5 Å²	143.5	86%	0.86	77%	0.774	S	S	*	*			trans	73.4	136.3	160.2	0	0	0	0	0	119.8
422	G	25.7	Very low	27.4	Very low	65 Å²	65	143.5 Å²	143.5	67%	0.67	77%	0.771	S	S	*	*			cis	157	147.9	-16.6	0	0	0	0	0	116.6
423	R	31.2	Very low	27.7	Very low	220 Å²	220	147.5 Å²	147.5	83%	0.83	77%	0.769	S	S	*	*			trans	73.2	157.3	174.1	-44.6	-180	179.2	-95.3	7.3	114.6
424	R	28.8	Very low	27.9	Very low	219 Å²	219	151.1 Å²	151.1	83%	0.826	77%	0.774	S	S	*	*			cis	-158	150.3	-2.9	-141.8	-169.5	-74.5	-138.7	5.3	112.4
425	G	27.5	Very low	28.3	Very low	76 Å²	76	149.6 Å²	149.6	78%	0.784	77%	0.772	S	S	*	*			trans	103.5	153.5	159.2	0	0	0	0	0	116.4
426	R	29.7	Very low	28.1	Very low	236 Å²	236	144.5 Å²	144.5	89%	0.891	77%	0.768	S	S	*	*			cis	-160.3	114.2	-2.9	176.6	-173.7	-179.2	-176.8	0.5	113
427	S	33.1	Very low	28.7	Very low	105 Å²	105	148.5 Å²	148.5	73%	0.734	78%	0.776	S	S	*	*			trans	62.2	166.4	155.2	-48	0	0	0	0	118.4
428	T	29.5	Very low	28.8	Very low	129 Å²	129	147.8 Å²	147.8	79%	0.791	78%	0.784	S	S	*	*			cis	-143.8	154.8	13.7	44.2	0	0	0	0	113.9
429	S	27.7	Very low	28.9	Very low	107 Å²	107	151 Å²	151	75%	0.748	78%	0.781	S	S	*	*			trans	60.9	139.2	142.8	-155.3	0	0	0	0	122
430	L	27.7	Very low	28.9	Very low	158 Å²	158	148.9 Å²	148.9	83%	0.827	78%	0.777	S	S	*	*			cis	-153.6	163.4	-20.7	-114.4	174.1	0	0	0	110.5
431	K	31.7	Very low	29	Very low	168 Å²	168	147.1 Å²	147.1	73%	0.73	77%	0.765	S	S	*	*			trans	-55.5	166.1	178.6	-87.8	168.5	174.4	174.4	0	115.1
432	E	28.3	Very low	29.3	Very low	144 Å²	144	152.6 Å²	152.6	67%	0.673	76%	0.763	S	S	*	*			cis	-149.8	131.8	40.4	-173.6	142.9	-149.8	0	0	118.8
433	R	28.3	Very low	29.3	Very low	196 Å²	196	154.4 Å²	154.4	74%	0.74	77%	0.772	S	S	*	*			trans	37	100.9	150.9	-70.9	174.5	165.1	144.1	-18.8	121.1
434	Q	29.2	Very low	29.1	Very low	181 Å²	181	151.7 Å²	151.7	85%	0.846	77%	0.774	S	S	*	*			trans	-130.9	133.6	135.6	-92.3	-79.2	-3.8	0	0	108.4
435	P	29.6	Very low	28.9	Very low	108 Å²	108	146.1 Å²	146.1	70%	0.701	77%	0.768	S	S	*	*			trans	-122.5	93.5	160.3	32.7	-17.7	0	0	0	109.9
436	S	24.2	Very low	29.1	Very low	98 Å²	98	150.4 Å²	150.4	69%	0.685	77%	0.772	S	S	*	*				77.9	111.7	81.8	70.3	0	0	0	0	114.6
437	R	35.9	Very low	29	Very low	238 Å²	238	146 Å²	146	90%	0.898	77%	0.767	S	S	*	*			trans	-60.4	147.4	152.1	-65.6	175.2	175.3	169.8	-2.9	109.4
438	P	28.5	Very low	28.7	Very low	129 Å²	129	148.7 Å²	148.7	84%	0.838	77%	0.773	S	S	*	*			trans	-96.7	133.2	145.6	33.2	-27.1	0	0	0	110.2
439	Q	28.6	Very low	28.7	Very low	171 Å²	171	149.9 Å²	149.9	80%	0.799	77%	0.769	S	S	*	*			trans	-112.4	124.2	164.2	161	-175.1	-13.6	0	0	105.9
440	N	27.8	Very low	28.8	Very low	112 Å²	112	155.3 Å²	155.3	60%	0.599	77%	0.773	S	S	*	*				-174.9	149.3	106.9	-138.7	30.2	0	0	0	115.1
441	E	32.2	Very low	28.5	Very low	125 Å²	125	152.9 Å²	152.9	58%	0.584	77%	0.769	S	S	*	*			trans	17.8	144.5	150.3	-68.8	-178.8	95.5	0	0	125.8
442	R	30.4	Very low	28.6	Very low	220 Å²	220	153.7 Å²	153.7	83%	0.83	78%	0.781	S	S	*	*			trans	66.8	109	141.6	-77.9	176.8	161.9	127	-13.5	121
443	A	25.3	Very low	28.5	Very low	103 Å²	103	151.6 Å²	151.6	85%	0.851	77%	0.774	S	S	*	*			trans	-145.1	156.6	139	0	0	0	0	0	109.6
444	N	26.9	Very low	28.7	Very low	163 Å²	163	148.5 Å²	148.5	87%	0.872	78%	0.777	S	S	*	*			trans	-95.4	140.8	-176.7	-63.1	-35.6	0	0	0	112.7
445	S	24.7	Very low	28.7	Very low	101 Å²	101	149.1 Å²	149.1	71%	0.706	77%	0.772	S	S	*	*			trans	-168.5	127.5	160.2	174.5	0	0	0	0	105.4	D447	S445-D447 PolarHBondContact OG-N 2.94Å; S445-D447 VanDerWaalsContact OG-N 3.14Å
446	L	32.8	Very low	29	Very low	167 Å²	167	148.2 Å²	148.2	87%	0.874	77%	0.767	S	S	*	*			cis	54.6	61.8	17.9	-63	-177.1	0	0	0	113.1
447	D	27.3	Very low	29.5	Very low	144 Å²	144	150.9 Å²	150.9	77%	0.77	77%	0.769	S	S	*	*				-173.5	119.7	124.8	-116.2	-32.4	0	0	0	109.5	S445	S445-D447 PolarHBondContact OG-N 2.94Å; S445-D447 VanDerWaalsContact OG-N 3.14Å
448	N	25.8	Very low	29.9	Very low	161 Å²	161	146.8 Å²	146.8	86%	0.861	76%	0.764	S	S	*	*			trans	-162.6	45.3	160.2	-149.4	12.3	0	0	0	113.1
449	E	29.5	Very low	31.6	Very low	153 Å²	153	146.2 Å²	146.2	72%	0.715	75%	0.75	S	S	*	*			trans	-77	149	172.8	-118.1	-67.1	84.1	0	0	111
450	R	29.9	Very low	34.2	Very low	222 Å²	222	145.1 Å²	145.1	84%	0.838	75%	0.748	S	S	*	*			trans	70.9	75.2	172.3	-50.4	178.8	-176.6	-163.7	0.1	118.9
451	S	22.5	Very low	37.1	Very low	107 Å²	107	141.3 Å²	141.3	75%	0.748	73%	0.729	S	S	*	*			trans	-153.4	102.1	133.3	52.1	0	0	0	0	113.8	D453	S451-D453 VanDerWaalsContact C-N 3.28Å; S451-D453 PolarHBondContact O-N 3.17Å; S451-D453 VanDerWaalsContact O-N 3.12Å
452	L	32.8	Very low	39.9	Very low	185 Å²	185	139.3 Å²	139.3	97%	0.969	72%	0.716	S	S	*	*			trans	-82.8	67.8	167.9	-78	166.4	0	0	0	110.4
453	D	25.5	Very low	42.9	Very low	99 Å²	99	135.8 Å²	135.8	53%	0.529	71%	0.707	S	S	.	*			trans	-82.5	133.8	175.2	-168.5	21.2	0	0	0	111.6	S451 R455	S451-D453 VanDerWaalsContact C-N 3.28Å; S451-D453 PolarHBondContact O-N 3.17Å; S451-D453 VanDerWaalsContact O-N 3.12Å; D453-R455 PolarHBondContact O-N 2.77Å; D453-R455 IonicContact OD2-CZ 2.76Å; D453-R455 VanDerWaalsContact OD2-CZ 3.24Å; D453-R455 IonicContact OD2-NE 3.55Å; D453-R455 PolarHBondContact OD2-NE 2.83Å; D453-R455 IonicContact OD2-NH2 3.94Å; D453-R455 PolarHBondContact OD2-NH2 3.34Å
454	T	33.5	Very low	46.2	Very low	132 Å²	132	134 Å²	134	81%	0.81	69%	0.686	S	S	*	*			trans	-84.9	75.7	-163.2	-46.8	0	0	0	0	111.9
455	R	29.9	Very low	49.4	Very low	193 Å²	193	126.3 Å²	126.3	73%	0.728	64%	0.644	S	S	*	*			trans	-125.2	108.4	176.9	-56.3	-173.6	-156.5	-166.9	7.9	111.4	D453 H457	D453-R455 PolarHBondContact O-N 2.77Å; D453-R455 IonicContact OD2-CZ 2.76Å; D453-R455 VanDerWaalsContact OD2-CZ 3.24Å; D453-R455 IonicContact OD2-NE 3.55Å; D453-R455 PolarHBondContact OD2-NE 2.83Å; D453-R455 IonicContact OD2-NH2 3.94Å; D453-R455 PolarHBondContact OD2-NH2 3.34Å; R455-H457 PolarHBondContact O-N 3.23Å
456	C	34.3	Very low	52.8	Low	90 Å²	90	125.9 Å²	125.9	61%	0.608	63%	0.628	S	S	*	*			trans	-69.3	65.8	167.7	-60.2	0	0	0	0	110.9	H660	C456-H660 PolarHBondContact O-CD2 3.48Å; C456-H660 PolarHBondContact O-NE2 2.78Å
457	H	35.7	Very low	55.8	Low	154 Å²	154	120.4 Å²	120.4	71%	0.713	60%	0.6	S	S	*	*			trans	-58.2	141.8	160.5	-158.5	-81.4	0	0	0	107.7	R455 Q459	R455-H457 PolarHBondContact O-N 3.23Å; H457-Q459 VanDerWaalsContact C-N 3.26Å; H457-Q459 PolarHBondContact O-N 3.45Å
458	L	44.9	Very low	59.1	Low	152 Å²	152	115.2 Å²	115.2	80%	0.796	57%	0.571	S	S	*	*			trans	-66.4	92.4	173.2	-72.7	164.2	0	0	0	107.9	I460	L458-I460 PolarHBondContact O-N 3.29Å
459	Q	64	Low	62.4	Low	116 Å²	116	107.6 Å²	107.6	54%	0.542	53%	0.53	S	S	.	.			trans	-72.3	112.4	171.5	-74	179.3	-30.4	0	0	106.7	H457 T512 A514	H457-Q459 VanDerWaalsContact C-N 3.26Å; H457-Q459 PolarHBondContact O-N 3.45Å; Q459-T512 VanDerWaalsContact OE1-CB 3.29Å; Q459-T512 VanDerWaalsContact OE1-CG2 3.3Å; Q459-A514 HydrophobicContact CB-CB 4.2Å; Q459-A514 WeakPolarHBondContact O-CB 3.35Å
460	I	82.9	Confident	65.5	Low	149 Å²	149	105.2 Å²	105.2	76%	0.764	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-73	131.9	172	-59.6	174.4	0	0	0	106.5	L458 R462	L458-I460 PolarHBondContact O-N 3.29Å; I460-R462 PolarHBondContact O-N 3.02Å
461	P	88.3	Confident	68.4	Low	32 Å²	32	102 Å²	102	21%	0.208	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-55.8	137.6	178.2	-19.2	27.7	0	0	0	110.9	K463 Y466 A514 A518	P461-K463 PolarHBondContact O-N 2.65Å; P461-Y466 HydrophobicContact CB-CE2 3.96Å; P461-Y466 HydrophobicContact CG-CE2 4.5Å; P461-A514 HydrophobicContact CG-CB 4.07Å; P461-A514 WeakPolarHBondContact CG-O 3.46Å; P461-A518 HydrophobicContact CB-CB 3.5Å; P461-A518 VanDerWaalsContact CB-CB 3.5Å; P461-A518 HydrophobicContact CG-CB 3.71Å
462	R	91.8	Very high	71.9	Confident	83 Å²	83	98.4 Å²	98.4	31%	0.313	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-66.7	135.6	-175.8	-68.9	176.9	-67.3	126.6	14.7	110.3	I460 T464 V465 C509 C511 D515	I460-R462 PolarHBondContact O-N 3.02Å; R462-T464 PolarHBondContact O-N 3.46Å; R462-T464 VanDerWaalsContact O-N 3.08Å; R462-V465 HydrophobicContact CB-CG2 4.36Å; R462-V465 WeakPolarHBondContact O-CB 3.48Å; R462-V465 PolarHBondContact O-N 3.21Å; R462-C509 PolarHBondContact NH2-O 3.44Å; R462-C511 VanDerWaalsContact NH2-N 3.2Å; R462-D515 IonicContact CZ-OD2 2.86Å; R462-D515 VanDerWaalsContact CZ-OD2 3.29Å; R462-D515 PolarHBondContact N-OD1 2.95Å; R462-D515 IonicContact NE-OD1 3.34Å; R462-D515 IonicContact NE-OD2 2.63Å; R462-D515 PolarHBondContact NE-OD2 3.31Å; R462-D515 IonicContact NH2-OD1 2.66Å; R462-D515 IonicContact NH2-OD2 2.68Å; R462-D515 PolarHBondContact NH2-OD2 2.72Å
463	K	93.1	Very high	74.7	Confident	145 Å²	145	90 Å²	90	63%	0.63	45%	0.445	S	S	*	.	H	α-helix	trans	-51.1	-37.7	179.2	-169.8	-168.4	173.9	-64.3	0	112.4	P461 V465 Y466 D467	P461-K463 PolarHBondContact O-N 2.65Å; K463-V465 PolarHBondContact O-N 2.9Å; K463-V465 VanDerWaalsContact O-N 3.16Å; K463-Y466 PolarHBondContact O-N 3.37Å; K463-Y466 VanDerWaalsContact O-N 3.08Å; K463-D467 IonicContact NZ-OD1 3.55Å; K463-D467 PolarHBondContact NZ-OD1 2.83Å; K463-D467 IonicContact NZ-OD2 3.83Å; K463-D467 PolarHBondContact NZ-OD2 2.9Å; K463-D467 VanDerWaalsContact O-CG 3.29Å; K463-D467 PolarHBondContact O-N 2.85Å
464	T	93.3	Very high	77.5	Confident	67 Å²	67	91 Å²	91	41%	0.411	45%	0.454	S	S	.	.	H	α-helix	trans	-53.9	-32.4	176.7	54	0	0	0	0	113.9	R462 D467 Q468	R462-T464 PolarHBondContact O-N 3.46Å; R462-T464 VanDerWaalsContact O-N 3.08Å; T464-D467 PolarHBondContact O-N 2.79Å; T464-Q468 WeakPolarHBondContact O-CB 3.32Å; T464-Q468 VanDerWaalsContact O-CG 3.3Å; T464-Q468 WeakPolarHBondContact O-CG 3.46Å; T464-Q468 PolarHBondContact O-N 3.1Å
465	V	95.9	Very high	79.8	Confident	0 Å²	0	87 Å²	87	0%	0	43%	0.432	C	S	.	.	H	α-helix	trans	-66.9	-48.1	177.8	177.6	0	0	0	0	109.9	R462 K463 Q468 L469 V508 D515 A519	R462-V465 HydrophobicContact CB-CG2 4.36Å; R462-V465 WeakPolarHBondContact O-CB 3.48Å; R462-V465 PolarHBondContact O-N 3.21Å; K463-V465 PolarHBondContact O-N 2.9Å; K463-V465 VanDerWaalsContact O-N 3.16Å; V465-Q468 PolarHBondContact O-N 3.15Å; V465-L469 HydrophobicContact CG1-CD1 3.71Å; V465-L469 WeakPolarHBondContact O-CB 3.32Å; V465-L469 WeakPolarHBondContact O-CD1 2.93Å; V465-L469 WeakPolarHBondContact O-CG 3.35Å; V465-L469 PolarHBondContact O-N 3.32Å; V465-V508 HydrophobicContact CG1-CG1 3.93Å; V465-D515 HydrophobicContact CG2-CB 3.88Å; V465-A519 HydrophobicContact CG1-CB 4.15Å
466	Y	95.4	Very high	82.3	Confident	93 Å²	93	80.4 Å²	80.4	37%	0.365	41%	0.41	S	S	.	.	H	α-helix	trans	-65.4	-39.6	174.8	-65.7	-68.3	0	0	0	112.1	P461 K463 L469 N470 A518	P461-Y466 HydrophobicContact CB-CE2 3.96Å; P461-Y466 HydrophobicContact CG-CE2 4.5Å; K463-Y466 PolarHBondContact O-N 3.37Å; K463-Y466 VanDerWaalsContact O-N 3.08Å; Y466-L469 PolarHBondContact O-N 3.07Å; Y466-N470 WeakPolarHBondContact O-CB 3.44Å; Y466-N470 PolarHBondContact O-N 3.16Å; Y466-N470 PolarHBondContact O-ND2 3.22Å; Y466-N470 VanDerWaalsContact O-ND2 3.08Å; Y466-A518 HydrophobicContact CE1-CB 4.08Å; Y466-A518 HydrophobicContact CE2-CB 4.35Å; Y466-A518 WeakPolarHBondContact OH-CB 3.34Å
467	D	95.2	Very high	84.6	Confident	51 Å²	51	81 Å²	81	27%	0.273	41%	0.408	S	S	.	.	H	α-helix	trans	-60.9	-49.3	176.9	-63.2	-27.5	0	0	0	110.8	K463 T464 L469 N470 H471	K463-D467 IonicContact NZ-OD1 3.55Å; K463-D467 PolarHBondContact NZ-OD1 2.83Å; K463-D467 IonicContact NZ-OD2 3.83Å; K463-D467 PolarHBondContact NZ-OD2 2.9Å; K463-D467 VanDerWaalsContact O-CG 3.29Å; K463-D467 PolarHBondContact O-N 2.85Å; T464-D467 PolarHBondContact O-N 2.79Å; D467-L469 PolarHBondContact O-N 3.08Å; D467-N470 PolarHBondContact O-N 2.87Å; D467-H471 PolarHBondContact O-CD2 2.85Å; D467-H471 PolarHBondContact O-N 2.8Å; D467-H471 VanDerWaalsContact O-N 3.11Å
468	Q	96.1	Very high	87.1	Confident	36 Å²	36	79.6 Å²	79.6	17%	0.168	40%	0.401	C	S	.	.	H	α-helix	trans	-58.3	-46.5	174.4	-76.5	173.1	-33	0	0	112.1	T464 V465 N470 H471 I472 V508	T464-Q468 WeakPolarHBondContact O-CB 3.32Å; T464-Q468 VanDerWaalsContact O-CG 3.3Å; T464-Q468 WeakPolarHBondContact O-CG 3.46Å; T464-Q468 PolarHBondContact O-N 3.1Å; V465-Q468 PolarHBondContact O-N 3.15Å; Q468-N470 PolarHBondContact O-N 3.34Å; Q468-H471 PolarHBondContact O-N 3.08Å; Q468-I472 WeakPolarHBondContact O-CG1 3.25Å; Q468-I472 PolarHBondContact O-N 3.28Å; Q468-I472 VanDerWaalsContact O-N 3.14Å; Q468-V508 HydrophobicContact CB-CG2 4.43Å
469	L	95.8	Very high	89.3	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-64	-38.3	178.2	-72	157.9	0	0	0	112.6	V465 Y466 D467 H471 I472 L473 V508 A519 T522 I523	V465-L469 HydrophobicContact CG1-CD1 3.71Å; V465-L469 WeakPolarHBondContact O-CB 3.32Å; V465-L469 WeakPolarHBondContact O-CD1 2.93Å; V465-L469 WeakPolarHBondContact O-CG 3.35Å; V465-L469 PolarHBondContact O-N 3.32Å; Y466-L469 PolarHBondContact O-N 3.07Å; D467-L469 PolarHBondContact O-N 3.08Å; L469-H471 VanDerWaalsContact C-N 3.31Å; L469-H471 PolarHBondContact O-N 2.93Å; L469-I472 PolarHBondContact O-N 3.21Å; L469-L473 HydrophobicContact CB-CD1 4.28Å; L469-L473 HydrophobicContact CD2-CD1 3.99Å; L469-L473 WeakPolarHBondContact O-CB 3.43Å; L469-L473 VanDerWaalsContact O-CG 3.24Å; L469-L473 WeakPolarHBondContact O-CG 3.41Å; L469-L473 PolarHBondContact O-N 2.98Å; L469-V508 HydrophobicContact CD1-CG1 4.44Å; L469-V508 HydrophobicContact CD2-CG1 4.42Å; L469-V508 HydrophobicContact CD2-CG2 3.84Å; L469-V508 HydrophobicContact CG-CG1 4.15Å; L469-V508 HydrophobicContact CG-CG2 4.1Å; L469-A519 HydrophobicContact CD1-CB 4.05Å; L469-T522 HydrophobicContact CB-CG2 4.24Å; L469-T522 HydrophobicContact CD1-CG2 4.25Å; L469-I523 HydrophobicContact CD2-CG1 4.29Å
470	N	93.8	Very high	90.7	Very high	103 Å²	103	68.7 Å²	68.7	55%	0.551	35%	0.349	S	S	*	.	H	α-helix	trans	-66.9	-32.9	177	-70.6	-28.3	0	0	0	112	Y466 D467 Q468	Y466-N470 WeakPolarHBondContact O-CB 3.44Å; Y466-N470 PolarHBondContact O-N 3.16Å; Y466-N470 PolarHBondContact O-ND2 3.22Å; Y466-N470 VanDerWaalsContact O-ND2 3.08Å; D467-N470 PolarHBondContact O-N 2.87Å; Q468-N470 PolarHBondContact O-N 3.34Å
471	H	92.4	Very high	91.3	Very high	154 Å²	154	67 Å²	67	71%	0.713	34%	0.341	S	S	*	.	H	α-helix	trans	-72.1	-29.3	173.8	-70.6	-56.7	0	0	0	113.5	D467 Q468 L469 V474	D467-H471 PolarHBondContact O-CD2 2.85Å; D467-H471 PolarHBondContact O-N 2.8Å; D467-H471 VanDerWaalsContact O-N 3.11Å; Q468-H471 PolarHBondContact O-N 3.08Å; L469-H471 VanDerWaalsContact C-N 3.31Å; L469-H471 PolarHBondContact O-N 2.93Å; H471-V474 VanDerWaalsContact O-CG2 3.25Å; H471-V474 WeakPolarHBondContact O-CG2 3.31Å
472	I	94.4	Very high	91.6	Very high	33 Å²	33	66.6 Å²	66.6	17%	0.169	34%	0.339	C	S	.	.	H	α-helix	trans	-86.3	-37.8	178.7	-63.7	162.3	0	0	0	111.5	Q468 L469 V474 P480 I483 P506 V508	Q468-I472 WeakPolarHBondContact O-CG1 3.25Å; Q468-I472 PolarHBondContact O-N 3.28Å; Q468-I472 VanDerWaalsContact O-N 3.14Å; L469-I472 PolarHBondContact O-N 3.21Å; I472-V474 PolarHBondContact O-N 3.25Å; I472-P480 HydrophobicContact CG2-CB 4.3Å; I472-P480 HydrophobicContact CG2-CG 4.16Å; I472-I483 HydrophobicContact CG2-CG1 4.22Å; I472-P506 HydrophobicContact CD1-CB 3.95Å; I472-P506 HydrophobicContact CG1-CB 3.93Å; I472-P506 HydrophobicContact CG2-CB 4Å; I472-V508 HydrophobicContact CD1-CG2 3.64Å
473	L	91.8	Very high	91.9	Very high	9 Å²	9	62.7 Å²	62.7	5%	0.047	32%	0.324	C	S	.	.			trans	-102	44.7	-168.3	-55.2	176.7	0	0	0	112.7	L469 S475 P480 I483 T522 R526	L469-L473 HydrophobicContact CB-CD1 4.28Å; L469-L473 HydrophobicContact CD2-CD1 3.99Å; L469-L473 WeakPolarHBondContact O-CB 3.43Å; L469-L473 VanDerWaalsContact O-CG 3.24Å; L469-L473 WeakPolarHBondContact O-CG 3.41Å; L469-L473 PolarHBondContact O-N 2.98Å; L473-S475 PolarHBondContact O-N 2.89Å; L473-P480 HydrophobicContact CD2-CG 3.62Å; L473-I483 HydrophobicContact CD2-CD1 3.88Å; L473-T522 HydrophobicContact CD1-CG2 3.95Å; L473-R526 HydrophobicContact CB-CG 4.17Å; L473-R526 HydrophobicContact CD1-CB 4.39Å; L473-R526 HydrophobicContact CD1-CG 4.31Å; L473-R526 HydrophobicContact CD2-CG 4.25Å; L473-R526 HydrophobicContact CG-CG 4.49Å; L473-R526 VanDerWaalsContact O-CZ 3.27Å; L473-R526 PolarHBondContact O-NE 2.87Å; L473-R526 PolarHBondContact O-NH2 3Å
474	V	85.8	Confident	92.2	Very high	118 Å²	118	55.8 Å²	55.8	72%	0.715	29%	0.294	S	S	*	.			trans	-59.8	-37.3	-164.2	-172.6	0	0	0	0	114.4	H471 I472	H471-V474 VanDerWaalsContact O-CG2 3.25Å; H471-V474 WeakPolarHBondContact O-CG2 3.31Å; I472-V474 PolarHBondContact O-N 3.25Å
475	S	82.2	Confident	92.4	Very high	50 Å²	50	52.6 Å²	52.6	35%	0.35	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-118.2	141.2	-171.6	-176.4	0	0	0	0	113.4	L473 N477 R526	L473-S475 PolarHBondContact O-N 2.89Å; S475-N477 VanDerWaalsContact C-N 3.26Å; S475-N477 PolarHBondContact OG-N 3.45Å; S475-R526 PolarHBondContact O-NH2 2.99Å
476	D	81.7	Confident	92.5	Very high	53 Å²	53	52.6 Å²	52.6	28%	0.283	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-19.3	173.3	-69.7	59.8	0	0	0	112	R526 R529	D476-R526 IonicContact OD1-CZ 3.22Å; D476-R526 IonicContact OD1-NH1 2.7Å; D476-R526 PolarHBondContact OD1-NH1 3.33Å; D476-R526 VanDerWaalsContact OD1-NH1 3.08Å; D476-R526 IonicContact OD1-NH2 3.77Å; D476-R526 PolarHBondContact OD1-NH2 2.94Å; D476-R526 IonicContact OD2-CZ 3.45Å; D476-R526 IonicContact OD2-NH1 3.75Å; D476-R526 PolarHBondContact OD2-NH1 2.86Å; D476-R526 IonicContact OD2-NH2 2.8Å; D476-R529 WeakPolarHBondContact OD2-CD 3.22Å; D476-R529 IonicContact OD2-CZ 3.79Å; D476-R529 IonicContact OD2-NE 2.76Å; D476-R529 IonicContact OD2-NH1 3.24Å; D476-R529 PolarHBondContact OD2-NH1 2.87Å; D476-R529 VanDerWaalsContact OD2-NH1 3.14Å
477	N	82.7	Confident	92.6	Very high	104 Å²	104	48.7 Å²	48.7	56%	0.556	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	2.5	-179.3	-59.7	-5.5	0	0	0	113.2	S475 F530	S475-N477 VanDerWaalsContact C-N 3.26Å; S475-N477 PolarHBondContact OG-N 3.45Å; N477-F530 WeakPolarHBondContact O-CE2 3.2Å
478	H	86.9	Confident	92.6	Very high	124 Å²	124	46.7 Å²	46.7	57%	0.574	25%	0.25	S	S	*	.	B	Isolated β-bridge	trans	-148.7	116.1	-179.3	-170.5	-71	0	0	0	111.3
479	L	92.1	Very high	92.4	Very high	17 Å²	17	47.8 Å²	47.8	9%	0.089	26%	0.261	C	S	.	.			trans	-84.9	143.4	172.4	-62	171.9	0	0	0	109.9	R526 I527 F530 P538 I541	L479-R526 HydrophobicContact CD2-CB 4.18Å; L479-R526 HydrophobicContact CD2-CG 3.81Å; L479-I527 HydrophobicContact CD1-CG1 4.18Å; L479-I527 HydrophobicContact CD2-CG1 4.38Å; L479-F530 HydrophobicContact CD1-CB 3.87Å; L479-F530 HydrophobicContact CD1-CD1 3.8Å; L479-F530 HydrophobicContact CD1-CD2 4.16Å; L479-F530 HydrophobicContact CD1-CE1 4.4Å; L479-F530 HydrophobicContact CD1-CG 3.66Å; L479-F530 HydrophobicContact CD2-CB 3.86Å; L479-F530 HydrophobicContact CD2-CG 4.3Å; L479-F530 HydrophobicContact CG-CB 3.82Å; L479-F530 HydrophobicContact CG-CD1 4.33Å; L479-F530 HydrophobicContact CG-CD2 3.78Å; L479-F530 HydrophobicContact CG-CE2 4.45Å; L479-F530 HydrophobicContact CG-CG 3.7Å; L479-P538 HydrophobicContact CD1-CB 3.95Å; L479-P538 HydrophobicContact CD1-CG 4.43Å; L479-I541 HydrophobicContact CB-CD1 3.98Å; L479-I541 HydrophobicContact CB-CG1 4.23Å; L479-I541 HydrophobicContact CD1-CD1 4.22Å; L479-I541 HydrophobicContact CD2-CD1 4.17Å; L479-I541 HydrophobicContact CG-CD1 4.34Å
480	P	94.2	Very high	92.2	Very high	22 Å²	22	51.1 Å²	51.1	14%	0.143	28%	0.28	C	S	.	.			trans	-71.4	148.9	176.2	33.3	-38.3	0	0	0	111	I472 L473 S482 I483	I472-P480 HydrophobicContact CG2-CB 4.3Å; I472-P480 HydrophobicContact CG2-CG 4.16Å; L473-P480 HydrophobicContact CD2-CG 3.62Å; P480-S482 PolarHBondContact O-N 2.87Å; P480-I483 HydrophobicContact CG-CD1 4.08Å; P480-I483 HydrophobicContact CG-CG1 3.88Å
481	D	93.7	Very high	92.2	Very high	112 Å²	112	48.3 Å²	48.3	60%	0.599	26%	0.261	S	S	*	.	S	Bend	trans	-60.6	-32.3	173.7	-62.9	-59.2	0	0	0	112.4	K542	D481-K542 WeakPolarHBondContact O-CB 3.37Å; D481-K542 PolarHBondContact O-N 3.06Å
482	S	95.9	Very high	92.2	Very high	25 Å²	25	42.1 Å²	42.1	18%	0.175	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	158.5	-177.6	73.8	0	0	0	0	115.2	P480 P506 K542 M633	P480-S482 PolarHBondContact O-N 2.87Å; S482-P506 WeakPolarHBondContact O-CG 3.43Å; S482-K542 CarbonylContact C-O 3.52Å; S482-K542 WeakPolarHBondContact CA-O 3.4Å; S482-K542 WeakPolarHBondContact CB-O 3.5Å; S482-M633 VanDerWaalsContact CB-CE 3.41Å
483	I	97.7	Very high	92.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	134.1	176	-49.8	174.4	0	0	0	107.4	I472 L473 P480 L485 V508 I523 I541 K542 I543 A544	I472-I483 HydrophobicContact CG2-CG1 4.22Å; L473-I483 HydrophobicContact CD2-CD1 3.88Å; P480-I483 HydrophobicContact CG-CD1 4.08Å; P480-I483 HydrophobicContact CG-CG1 3.88Å; I483-L485 HydrophobicContact CG2-CD2 4.02Å; I483-V508 HydrophobicContact CG2-CG2 3.89Å; I483-I523 HydrophobicContact CD1-CD1 3.73Å; I483-I523 HydrophobicContact CD1-CG1 3.69Å; I483-I523 HydrophobicContact CD1-CG2 4.27Å; I483-I523 HydrophobicContact CG2-CD1 4.43Å; I483-I541 HydrophobicContact CD1-CG2 4.03Å; I483-I541 HydrophobicContact CG1-CG2 4.04Å; I483-K542 PolarHBondContact N-O 3.13Å; I483-I543 CarbonylContact O-C 3.57Å; I483-I543 WeakPolarHBondContact O-CA 3.33Å; I483-A544 PolarHBondContact O-N 3.16Å
484	I	98.4	Very high	92.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	102.7	-178.9	-48.5	-179.1	0	0	0	110	I486 L500 L505 P506 V507 V508 A544 V629 M633	I484-I486 HydrophobicContact CG2-CD1 4.12Å; I484-I486 HydrophobicContact CG2-CG1 3.83Å; I484-L500 HydrophobicContact CD1-CD1 4.07Å; I484-L500 HydrophobicContact CG2-CD1 4.19Å; I484-L505 HydrophobicContact CD1-CB 4.12Å; I484-P506 PolarHBondContact N-O 3.04Å; I484-V507 HydrophobicContact CB-CG2 4.37Å; I484-V507 WeakPolarHBondContact O-CA 3.46Å; I484-V508 PolarHBondContact O-N 2.76Å; I484-A544 HydrophobicContact CB-CB 4.34Å; I484-A544 HydrophobicContact CG1-CB 4.23Å; I484-A544 HydrophobicContact CG2-CB 4.07Å; I484-V629 HydrophobicContact CD1-CG1 4.21Å; I484-M633 HydrophobicContact CD1-CE 4.48Å; I484-M633 HydrophobicContact CD1-CG 4.42Å; I484-M633 HydrophobicContact CD1-SD 4.36Å; I484-M633 HydrophobicContact CG1-CE 3.97Å; I484-M633 HydrophobicContact CG1-SD 4.3Å
485	L	98.4	Very high	92.8	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	119.3	174	-51.5	-175.8	0	0	0	109.4	I483 V508 A519 I523 I543 A544 A546 Y551	I483-L485 HydrophobicContact CG2-CD2 4.02Å; L485-V508 HydrophobicContact CD2-CB 3.85Å; L485-V508 HydrophobicContact CD2-CG1 4.33Å; L485-V508 HydrophobicContact CD2-CG2 4.23Å; L485-A519 HydrophobicContact CD2-CB 4.22Å; L485-I523 HydrophobicContact CD2-CD1 4.31Å; L485-I543 HydrophobicContact CD1-CG2 3.68Å; L485-I543 HydrophobicContact CG-CG2 3.97Å; L485-A544 WeakPolarHBondContact CB-O 3.41Å; L485-A544 PolarHBondContact N-O 3.26Å; L485-A546 PolarHBondContact O-N 3.26Å; L485-Y551 WeakPolarHBondContact CB-OH 3.29Å
486	I	98.3	Very high	93.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	134.9	-177.4	-49	-175.7	0	0	0	110.6	I484 T488 G493 L500 V507 V508 T510 A546 Y551	I484-I486 HydrophobicContact CG2-CD1 4.12Å; I484-I486 HydrophobicContact CG2-CG1 3.83Å; I486-T488 HydrophobicContact CB-CG2 4.24Å; I486-T488 HydrophobicContact CG2-CG2 3.94Å; I486-T488 PolarHBondContact O-N 3.42Å; I486-G493 WeakPolarHBondContact CG2-O 3.4Å; I486-L500 HydrophobicContact CD1-CD1 4.07Å; I486-V507 HydrophobicContact CD1-CG1 3.57Å; I486-V507 HydrophobicContact CD1-CG2 4.18Å; I486-V507 HydrophobicContact CG1-CG1 4.15Å; I486-V508 PolarHBondContact N-O 3.25Å; I486-T510 PolarHBondContact O-N 3.14Å; I486-T510 PolarHBondContact O-OG1 2.78Å; I486-A546 HydrophobicContact CB-CB 4.42Å; I486-A546 HydrophobicContact CG1-CB 4.1Å; I486-A546 HydrophobicContact CG2-CB 4.25Å; I486-Y551 PolarHBondContact N-OH 3.23Å; I486-Y551 PolarHBondContact O-OH 2.71Å
487	N	96.4	Very high	94.2	Very high	10 Å²	10	36.8 Å²	36.8	5%	0.053	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	92.1	167.4	178.7	38	0	0	0	110.8	S489 D490 G493 T510 A546 Y551	N487-S489 VanDerWaalsContact C-N 3.26Å; N487-S489 PolarHBondContact O-N 3.4Å; N487-S489 WeakPolarHBondContact OD1-CB 3.48Å; N487-S489 PolarHBondContact OD1-OG 3.01Å; N487-D490 PolarHBondContact ND2-OD2 3.39Å; N487-G493 WeakPolarHBondContact O-CA 3.28Å; N487-T510 CarbonylContact C-O 3.54Å; N487-T510 WeakPolarHBondContact CA-O 3.18Å; N487-A546 PolarHBondContact N-O 2.78Å; N487-Y551 HydrophobicContact CB-CD1 4.04Å; N487-Y551 HydrophobicContact CB-CD2 3.64Å; N487-Y551 HydrophobicContact CB-CE1 4.17Å; N487-Y551 HydrophobicContact CB-CE2 3.77Å; N487-Y551 HydrophobicContact CB-CG 3.77Å
488	T	96	Very high	94.8	Very high	10 Å²	10	36.4 Å²	36.4	6%	0.061	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	17.7	-179.7	55.4	0	0	0	0	113.4	I486 Q494 C509 T510 C511	I486-T488 HydrophobicContact CB-CG2 4.24Å; I486-T488 HydrophobicContact CG2-CG2 3.94Å; I486-T488 PolarHBondContact O-N 3.42Å; T488-Q494 WeakPolarHBondContact O-CG 3.49Å; T488-Q494 PolarHBondContact O-NE2 3.04Å; T488-C509 HydrophobicContact CG2-CB 3.77Å; T488-T510 PolarHBondContact N-O 2.92Å; T488-T510 PolarHBondContact OG1-O 2.94Å; T488-C511 PolarHBondContact OG1-SG 2.87Å
489	S	92.7	Very high	95.1	Very high	58 Å²	58	32.7 Å²	32.7	41%	0.406	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-35.5	171.4	-66.6	0	0	0	0	112.9	N487 C511	N487-S489 VanDerWaalsContact C-N 3.26Å; N487-S489 PolarHBondContact O-N 3.4Å; N487-S489 WeakPolarHBondContact OD1-CB 3.48Å; N487-S489 PolarHBondContact OD1-OG 3.01Å; S489-C511 WeakPolarHBondContact OG-CA 3.42Å; S489-C511 PolarHBondContact OG-O 3.48Å
490	D	90.9	Very high	95.3	Very high	71 Å²	71	31.9 Å²	31.9	38%	0.38	17%	0.168	S	C	.	.	S	Bend	trans	-103.9	154	-179.5	-46.6	-77.1	0	0	0	110.5	N487 Q492 G493 Q494	N487-D490 PolarHBondContact ND2-OD2 3.39Å; D490-Q492 PolarHBondContact O-N 3.47Å; D490-Q492 VanDerWaalsContact O-N 3.16Å; D490-G493 PolarHBondContact O-N 2.88Å; D490-G493 VanDerWaalsContact O-N 3.08Å; D490-Q494 PolarHBondContact O-N 2.9Å
491	W	92.8	Very high	95.3	Very high	44 Å²	44	34.6 Å²	34.6	17%	0.167	18%	0.179	C	C	.	.	H	α-helix	trans	-59.3	-31.7	-175.5	74.4	-97.7	0	0	0	112.8	G493 Q494 Y495 L609 T613 E614 A615 P616	W491-G493 VanDerWaalsContact C-N 3.27Å; W491-G493 PolarHBondContact O-N 3.37Å; W491-Q494 PolarHBondContact O-N 3.2Å; W491-Y495 WeakPolarHBondContact O-CB 3.49Å; W491-Y495 PolarHBondContact O-N 2.66Å; W491-L609 HydrophobicContact CH2-CD1 4.21Å; W491-L609 WeakPolarHBondContact CH2-O 3.29Å; W491-L609 HydrophobicContact CZ3-CD1 4.45Å; W491-T613 PolarHBondContact NE1-O 3.21Å; W491-E614 WeakPolarHBondContact CZ2-O 3.21Å; W491-E614 VanDerWaalsContact NE1-C 3.28Å; W491-A615 HydrophobicContact CB-CB 4.36Å; W491-A615 HydrophobicContact CD2-CB 3.7Å; W491-A615 HydrophobicContact CE3-CB 4.02Å; W491-A615 HydrophobicContact CG-CB 3.84Å; W491-P616 VanDerWaalsContact CH2-CD 3.42Å; W491-P616 HydrophobicContact CH2-CG 4.33Å; W491-P616 HydrophobicContact CZ3-CG 4.34Å
492	Q	94.2	Very high	95.3	Very high	23 Å²	23	35.2 Å²	35.2	11%	0.107	18%	0.182	C	C	.	.	H	α-helix	trans	-57.9	-43.4	178.7	-64.4	84.9	-10.1	0	0	110.6	D490 L496 L581 F610 K612	D490-Q492 PolarHBondContact O-N 3.47Å; D490-Q492 VanDerWaalsContact O-N 3.16Å; Q492-L496 WeakPolarHBondContact O-CB 3.3Å; Q492-L496 PolarHBondContact O-N 3.03Å; Q492-L496 VanDerWaalsContact O-N 3.09Å; Q492-L581 HydrophobicContact CB-CB 4.23Å; Q492-L581 HydrophobicContact CB-CD1 4.21Å; Q492-F610 HydrophobicContact CB-CD1 3.87Å; Q492-F610 HydrophobicContact CB-CE1 4.39Å; Q492-F610 HydrophobicContact CG-CD1 4.09Å; Q492-K612 PolarHBondContact NE2-O 2.9Å
493	G	95.3	Very high	95.3	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-76.3	-32.8	-179.7	0	0	0	0	0	112.8	I486 N487 D490 W491 L496 S497	I486-G493 WeakPolarHBondContact CG2-O 3.4Å; N487-G493 WeakPolarHBondContact O-CA 3.28Å; D490-G493 PolarHBondContact O-N 2.88Å; D490-G493 VanDerWaalsContact O-N 3.08Å; W491-G493 VanDerWaalsContact C-N 3.27Å; W491-G493 PolarHBondContact O-N 3.37Å; G493-L496 PolarHBondContact O-N 3.39Å; G493-S497 WeakPolarHBondContact O-CB 3.39Å; G493-S497 PolarHBondContact O-N 2.88Å; G493-S497 PolarHBondContact O-OG 3.09Å
494	Q	94.8	Very high	95.1	Very high	91 Å²	91	48 Å²	48	43%	0.425	24%	0.239	S	C	.	.	H	α-helix	trans	-65	-49.4	174.2	-65.2	167.4	8.8	0	0	110.9	T488 D490 W491 L496 S497 D498	T488-Q494 WeakPolarHBondContact O-CG 3.49Å; T488-Q494 PolarHBondContact O-NE2 3.04Å; D490-Q494 PolarHBondContact O-N 2.9Å; W491-Q494 PolarHBondContact O-N 3.2Å; Q494-L496 VanDerWaalsContact C-N 3.29Å; Q494-L496 PolarHBondContact O-N 3.04Å; Q494-S497 WeakPolarHBondContact CA-OG 3.36Å; Q494-S497 PolarHBondContact O-N 2.93Å; Q494-S497 VanDerWaalsContact O-N 3.16Å; Q494-S497 PolarHBondContact O-OG 3.19Å; Q494-D498 VanDerWaalsContact O-CG 3.25Å; Q494-D498 PolarHBondContact O-N 3.13Å
495	Y	94.3	Very high	94.9	Very high	55 Å²	55	50.1 Å²	50.1	22%	0.216	25%	0.25	C	C	.	.	H	α-helix	trans	-57	-42.5	172.9	176.4	-101.1	0	0	0	112.1	W491 L499 L609 F610	W491-Y495 WeakPolarHBondContact O-CB 3.49Å; W491-Y495 PolarHBondContact O-N 2.66Å; Y495-L499 HydrophobicContact CD1-CD1 4.15Å; Y495-L499 HydrophobicContact CE1-CD1 3.57Å; Y495-L499 HydrophobicContact CE2-CD1 4.26Å; Y495-L499 WeakPolarHBondContact O-CG 3.37Å; Y495-L499 PolarHBondContact O-N 3.44Å; Y495-L609 HydrophobicContact CE1-CD2 3.96Å; Y495-F610 HydrophobicContact CD1-CE1 4.11Å; Y495-F610 HydrophobicContact CD1-CZ 4.27Å; Y495-F610 HydrophobicContact CE1-CZ 4.43Å
496	L	95.7	Very high	94.8	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65	-43.9	176.3	-135.9	-35.1	0	0	0	111.9	Q492 G493 Q494 D498 L499 L500 A546 I579 L581 F610 V625 V629	Q492-L496 WeakPolarHBondContact O-CB 3.3Å; Q492-L496 PolarHBondContact O-N 3.03Å; Q492-L496 VanDerWaalsContact O-N 3.09Å; G493-L496 PolarHBondContact O-N 3.39Å; Q494-L496 VanDerWaalsContact C-N 3.29Å; Q494-L496 PolarHBondContact O-N 3.04Å; L496-D498 VanDerWaalsContact C-N 3.34Å; L496-D498 PolarHBondContact O-N 3.39Å; L496-L499 PolarHBondContact O-N 3.04Å; L496-L500 HydrophobicContact CD1-CD1 3.53Å; L496-L500 HydrophobicContact CD1-CD2 4.19Å; L496-L500 HydrophobicContact CD1-CG 3.66Å; L496-L500 WeakPolarHBondContact O-CG 3.35Å; L496-L500 PolarHBondContact O-N 3.38Å; L496-A546 HydrophobicContact CD2-CB 3.68Å; L496-I579 HydrophobicContact CD2-CG2 4.2Å; L496-L581 HydrophobicContact CD2-CD1 4.29Å; L496-L581 HydrophobicContact CD2-CD2 4.02Å; L496-L581 HydrophobicContact CG-CD2 4.48Å; L496-F610 HydrophobicContact CG-CZ 4.39Å; L496-V625 HydrophobicContact CD1-CG1 3.53Å; L496-V625 HydrophobicContact CG-CG1 4.28Å; L496-V629 HydrophobicContact CD1-CG2 4.38Å
497	S	96.4	Very high	94.7	Very high	5 Å²	5	52 Å²	52	4%	0.035	26%	0.262	C	S	.	.	H	α-helix	trans	-66.6	-36.4	-177.1	62.1	0	0	0	0	112.5	G493 Q494 Q501	G493-S497 WeakPolarHBondContact O-CB 3.39Å; G493-S497 PolarHBondContact O-N 2.88Å; G493-S497 PolarHBondContact O-OG 3.09Å; Q494-S497 WeakPolarHBondContact CA-OG 3.36Å; Q494-S497 PolarHBondContact O-N 2.93Å; Q494-S497 VanDerWaalsContact O-N 3.16Å; Q494-S497 PolarHBondContact O-OG 3.19Å; S497-Q501 VanDerWaalsContact O-CB 3.26Å; S497-Q501 WeakPolarHBondContact O-CB 3.35Å; S497-Q501 VanDerWaalsContact O-CG 3.23Å; S497-Q501 WeakPolarHBondContact O-CG 3.43Å; S497-Q501 PolarHBondContact O-N 3.4Å; S497-Q501 PolarHBondContact O-NE2 2.94Å
498	D	94.8	Very high	94.8	Very high	95 Å²	95	51.5 Å²	51.5	51%	0.508	26%	0.259	S	S	.	.	H	α-helix	trans	-70.4	-43.9	-179.9	-66.4	0.1	0	0	0	110.4	Q494 L496 N502	Q494-D498 VanDerWaalsContact O-CG 3.25Å; Q494-D498 PolarHBondContact O-N 3.13Å; L496-D498 VanDerWaalsContact C-N 3.34Å; L496-D498 PolarHBondContact O-N 3.39Å; D498-N502 WeakPolarHBondContact O-CB 3.38Å; D498-N502 PolarHBondContact O-N 3.13Å; D498-N502 VanDerWaalsContact O-N 3.08Å; D498-N502 PolarHBondContact O-ND2 3.11Å
499	L	95.1	Very high	94.9	Very high	46 Å²	46	51.6 Å²	51.6	24%	0.241	26%	0.26	C	S	.	.	H	α-helix	trans	-58.9	-51.5	173.7	-73.4	179.3	0	0	0	112.3	Y495 L496 Q501 N502 H503 V625 V626	Y495-L499 HydrophobicContact CD1-CD1 4.15Å; Y495-L499 HydrophobicContact CE1-CD1 3.57Å; Y495-L499 HydrophobicContact CE2-CD1 4.26Å; Y495-L499 WeakPolarHBondContact O-CG 3.37Å; Y495-L499 PolarHBondContact O-N 3.44Å; L496-L499 PolarHBondContact O-N 3.04Å; L499-Q501 PolarHBondContact O-N 3.47Å; L499-N502 PolarHBondContact O-N 2.68Å; L499-H503 PolarHBondContact O-CD2 3.43Å; L499-H503 PolarHBondContact O-N 3.12Å; L499-V625 HydrophobicContact CD1-CB 4.09Å; L499-V625 HydrophobicContact CD1-CG1 4.27Å; L499-V626 HydrophobicContact CB-CG2 4.11Å
500	L	96.3	Very high	95.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-70.9	-30.3	-175.6	-61.1	179.4	0	0	0	112.7	I484 I486 L496 H503 H504 L505 V507 V626 V629	I484-L500 HydrophobicContact CD1-CD1 4.07Å; I484-L500 HydrophobicContact CG2-CD1 4.19Å; I486-L500 HydrophobicContact CD1-CD1 4.07Å; L496-L500 HydrophobicContact CD1-CD1 3.53Å; L496-L500 HydrophobicContact CD1-CD2 4.19Å; L496-L500 HydrophobicContact CD1-CG 3.66Å; L496-L500 WeakPolarHBondContact O-CG 3.35Å; L496-L500 PolarHBondContact O-N 3.38Å; L500-H503 CarbonylContact O-C 3.58Å; L500-H503 PolarHBondContact O-N 3.48Å; L500-H504 PolarHBondContact O-N 3.21Å; L500-L505 HydrophobicContact CB-CB 4.31Å; L500-L505 HydrophobicContact CB-CD1 4.09Å; L500-L505 HydrophobicContact CD2-CD1 3.51Å; L500-L505 HydrophobicContact CG-CD1 4.29Å; L500-L505 WeakPolarHBondContact O-CB 3.45Å; L500-L505 PolarHBondContact O-N 3.17Å; L500-L505 VanDerWaalsContact O-N 3.09Å; L500-V507 HydrophobicContact CB-CG2 3.63Å; L500-V507 HydrophobicContact CD1-CG2 4.38Å; L500-V626 HydrophobicContact CD2-CG1 4.32Å; L500-V626 HydrophobicContact CD2-CG2 4.35Å; L500-V629 HydrophobicContact CD1-CG1 4.04Å; L500-V629 HydrophobicContact CD2-CB 4.03Å; L500-V629 HydrophobicContact CD2-CG1 3.97Å; L500-V629 HydrophobicContact CD2-CG2 4.38Å
501	Q	94.2	Very high	95.2	Very high	79 Å²	79	47.6 Å²	47.6	37%	0.369	24%	0.237	S	C	.	.	H	α-helix	trans	-69.8	-37.6	173.2	-78.4	172.8	78.7	0	0	112.7	S497 L499 H503 H504 V507	S497-Q501 VanDerWaalsContact O-CB 3.26Å; S497-Q501 WeakPolarHBondContact O-CB 3.35Å; S497-Q501 VanDerWaalsContact O-CG 3.23Å; S497-Q501 WeakPolarHBondContact O-CG 3.43Å; S497-Q501 PolarHBondContact O-N 3.4Å; S497-Q501 PolarHBondContact O-NE2 2.94Å; L499-Q501 PolarHBondContact O-N 3.47Å; Q501-H503 PolarHBondContact O-N 3.07Å; Q501-H504 PolarHBondContact O-N 3.35Å; Q501-V507 HydrophobicContact CG-CB 4.05Å; Q501-V507 HydrophobicContact CG-CG1 4.19Å; Q501-V507 HydrophobicContact CG-CG2 4.38Å
502	N	93.6	Very high	95.2	Very high	125 Å²	125	46.7 Å²	46.7	67%	0.668	24%	0.237	S	C	*	.	H	α-helix	trans	-63	-22.7	173.6	-73.7	-34.8	0	0	0	112.8	D498 L499	D498-N502 WeakPolarHBondContact O-CB 3.38Å; D498-N502 PolarHBondContact O-N 3.13Å; D498-N502 VanDerWaalsContact O-N 3.08Å; D498-N502 PolarHBondContact O-ND2 3.11Å; L499-N502 PolarHBondContact O-N 2.68Å
503	H	94.2	Very high	95.1	Very high	119 Å²	119	50.3 Å²	50.3	55%	0.551	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	15.8	172.4	-74	-102	0	0	0	113.7	L499 L500 Q501 L505 V626	L499-H503 PolarHBondContact O-CD2 3.43Å; L499-H503 PolarHBondContact O-N 3.12Å; L500-H503 CarbonylContact O-C 3.58Å; L500-H503 PolarHBondContact O-N 3.48Å; Q501-H503 PolarHBondContact O-N 3.07Å; H503-L505 VanDerWaalsContact C-N 3.26Å; H503-L505 PolarHBondContact O-N 3.02Å; H503-V626 HydrophobicContact CB-CG1 3.99Å
504	H	93.4	Very high	95.1	Very high	176 Å²	176	51 Å²	51	82%	0.815	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	26.6	175	-54.9	-43.1	0	0	0	116.1	L500 Q501	L500-H504 PolarHBondContact O-N 3.21Å; Q501-H504 PolarHBondContact O-N 3.35Å
505	L	95.3	Very high	95.1	Very high	43 Å²	43	46.7 Å²	46.7	23%	0.225	24%	0.24	C	C	.	.			trans	-76.2	155	177.9	-66.9	169.6	0	0	0	112	I484 L500 H503 V507 V626	I484-L505 HydrophobicContact CD1-CB 4.12Å; L500-L505 HydrophobicContact CB-CB 4.31Å; L500-L505 HydrophobicContact CB-CD1 4.09Å; L500-L505 HydrophobicContact CD2-CD1 3.51Å; L500-L505 HydrophobicContact CG-CD1 4.29Å; L500-L505 WeakPolarHBondContact O-CB 3.45Å; L500-L505 PolarHBondContact O-N 3.17Å; L500-L505 VanDerWaalsContact O-N 3.09Å; H503-L505 VanDerWaalsContact C-N 3.26Å; H503-L505 PolarHBondContact O-N 3.02Å; L505-V507 VanDerWaalsContact C-N 3.27Å; L505-V507 HydrophobicContact CB-CG2 4.41Å; L505-V507 PolarHBondContact O-N 3.12Å; L505-V626 HydrophobicContact CD1-CG1 4.36Å
506	P	95.4	Very high	95.2	Very high	32 Å²	32	44.5 Å²	44.5	21%	0.208	23%	0.232	C	C	.	.			trans	-75.8	71	-172.7	31.1	-36.5	0	0	0	112.7	I472 S482 I484	I472-P506 HydrophobicContact CD1-CB 3.95Å; I472-P506 HydrophobicContact CG1-CB 3.93Å; I472-P506 HydrophobicContact CG2-CB 4Å; S482-P506 WeakPolarHBondContact O-CG 3.43Å; I484-P506 PolarHBondContact N-O 3.04Å
507	V	97.8	Very high	95.2	Very high	8 Å²	8	48.9 Å²	48.9	5%	0.048	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	134.4	-173.5	173.4	0	0	0	0	112.6	I484 I486 L500 Q501 L505	I484-V507 HydrophobicContact CB-CG2 4.37Å; I484-V507 WeakPolarHBondContact O-CA 3.46Å; I486-V507 HydrophobicContact CD1-CG1 3.57Å; I486-V507 HydrophobicContact CD1-CG2 4.18Å; I486-V507 HydrophobicContact CG1-CG1 4.15Å; L500-V507 HydrophobicContact CB-CG2 3.63Å; L500-V507 HydrophobicContact CD1-CG2 4.38Å; Q501-V507 HydrophobicContact CG-CB 4.05Å; Q501-V507 HydrophobicContact CG-CG1 4.19Å; Q501-V507 HydrophobicContact CG-CG2 4.38Å; L505-V507 VanDerWaalsContact C-N 3.27Å; L505-V507 HydrophobicContact CB-CG2 4.41Å; L505-V507 PolarHBondContact O-N 3.12Å
508	V	98	Very high	95.1	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	116.4	170.2	-173.9	0	0	0	0	109.1	V465 Q468 L469 I472 I483 I484 L485 I486 T510 A519	V465-V508 HydrophobicContact CG1-CG1 3.93Å; Q468-V508 HydrophobicContact CB-CG2 4.43Å; L469-V508 HydrophobicContact CD1-CG1 4.44Å; L469-V508 HydrophobicContact CD2-CG1 4.42Å; L469-V508 HydrophobicContact CD2-CG2 3.84Å; L469-V508 HydrophobicContact CG-CG1 4.15Å; L469-V508 HydrophobicContact CG-CG2 4.1Å; I472-V508 HydrophobicContact CD1-CG2 3.64Å; I483-V508 HydrophobicContact CG2-CG2 3.89Å; I484-V508 PolarHBondContact O-N 2.76Å; L485-V508 HydrophobicContact CD2-CB 3.85Å; L485-V508 HydrophobicContact CD2-CG1 4.33Å; L485-V508 HydrophobicContact CD2-CG2 4.23Å; I486-V508 PolarHBondContact N-O 3.25Å; V508-T510 HydrophobicContact CG1-CG2 4.44Å; V508-A519 HydrophobicContact CG1-CB 4.36Å
509	C	97.6	Very high	95.2	Very high	12 Å²	12	44.4 Å²	44.4	8%	0.081	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	113	-173.6	-63.4	0	0	0	0	110.9	R462 T488	R462-C509 PolarHBondContact NH2-O 3.44Å; T488-C509 HydrophobicContact CG2-CB 3.77Å
510	T	96.8	Very high	95.3	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.006	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	139.9	-177.5	62	0	0	0	0	111.3	I486 N487 T488 V508 D515 I516 Y551	I486-T510 PolarHBondContact O-N 3.14Å; I486-T510 PolarHBondContact O-OG1 2.78Å; N487-T510 CarbonylContact C-O 3.54Å; N487-T510 WeakPolarHBondContact CA-O 3.18Å; T488-T510 PolarHBondContact N-O 2.92Å; T488-T510 PolarHBondContact OG1-O 2.94Å; V508-T510 HydrophobicContact CG1-CG2 4.44Å; T510-D515 HydrophobicContact CG2-CB 3.97Å; T510-I516 HydrophobicContact CG2-CG1 4.4Å; T510-Y551 VanDerWaalsContact OG1-CE2 3.25Å; T510-Y551 WeakPolarHBondContact OG1-CE2 3.38Å; T510-Y551 PolarHBondContact OG1-OH 3.44Å
511	C	93.4	Very high	95.2	Very high	44 Å²	44	44.7 Å²	44.7	30%	0.297	23%	0.231	S	C	.	.			trans	-126.1	-18.1	177.4	-65.7	0	0	0	0	113	R462 T488 S489 D515	R462-C511 VanDerWaalsContact NH2-N 3.2Å; T488-C511 PolarHBondContact OG1-SG 2.87Å; S489-C511 WeakPolarHBondContact OG-CA 3.42Å; S489-C511 PolarHBondContact OG-O 3.48Å; C511-D515 PolarHBondContact N-OD2 3.4Å
512	T	93.3	Very high	95.3	Very high	26 Å²	26	42.3 Å²	42.3	16%	0.16	22%	0.222	C	C	.	.	S	Bend	trans	-129	157.2	-172.8	64.8	0	0	0	0	111.1	Q459 A514 D515 I516	Q459-T512 VanDerWaalsContact OE1-CB 3.29Å; Q459-T512 VanDerWaalsContact OE1-CG2 3.3Å; T512-A514 PolarHBondContact O-N 3.1Å; T512-D515 PolarHBondContact N-OD2 3.06Å; T512-D515 VanDerWaalsContact N-OD2 3.09Å; T512-D515 WeakPolarHBondContact O-CB 3.21Å; T512-D515 PolarHBondContact O-N 3.45Å; T512-D515 PolarHBondContact OG1-N 2.67Å; T512-D515 PolarHBondContact OG1-OD1 3.39Å; T512-D515 PolarHBondContact OG1-OD2 3.34Å; T512-I516 WeakPolarHBondContact O-CG1 3.02Å; T512-I516 PolarHBondContact O-N 3.03Å; T512-I516 VanDerWaalsContact O-N 3.13Å
513	M	92.6	Very high	95.4	Very high	99 Å²	99	36.4 Å²	36.4	49%	0.488	19%	0.19	S	C	.	.	H	α-helix	trans	-55.7	-34.7	172.4	-172.9	62.4	63.3	0	0	111.6	I516 Q517 A554	M513-I516 PolarHBondContact O-N 3.34Å; M513-Q517 WeakPolarHBondContact O-CB 3.24Å; M513-Q517 PolarHBondContact O-N 3.02Å; M513-A554 HydrophobicContact CE-CB 3.67Å; M513-A554 HydrophobicContact SD-CB 3.99Å
514	A	94.1	Very high	95.4	Very high	15 Å²	15	31.1 Å²	31.1	12%	0.124	17%	0.166	C	C	.	.	H	α-helix	trans	-66.3	-38.8	176.1	0	0	0	0	0	112.8	Q459 P461 T512 A518	Q459-A514 HydrophobicContact CB-CB 4.2Å; Q459-A514 WeakPolarHBondContact O-CB 3.35Å; P461-A514 HydrophobicContact CG-CB 4.07Å; P461-A514 WeakPolarHBondContact CG-O 3.46Å; T512-A514 PolarHBondContact O-N 3.1Å; A514-A518 VanDerWaalsContact O-CB 3.29Å; A514-A518 WeakPolarHBondContact O-CB 3.45Å; A514-A518 PolarHBondContact O-N 3.28Å
515	D	95.5	Very high	95.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63.3	-44.4	173.3	-63.4	-31.9	0	0	0	111.5	R462 V465 T510 C511 T512 A518 A519	R462-D515 IonicContact CZ-OD2 2.86Å; R462-D515 VanDerWaalsContact CZ-OD2 3.29Å; R462-D515 PolarHBondContact N-OD1 2.95Å; R462-D515 IonicContact NE-OD1 3.34Å; R462-D515 IonicContact NE-OD2 2.63Å; R462-D515 PolarHBondContact NE-OD2 3.31Å; R462-D515 IonicContact NH2-OD1 2.66Å; R462-D515 IonicContact NH2-OD2 2.68Å; R462-D515 PolarHBondContact NH2-OD2 2.72Å; V465-D515 HydrophobicContact CG2-CB 3.88Å; T510-D515 HydrophobicContact CG2-CB 3.97Å; C511-D515 PolarHBondContact N-OD2 3.4Å; T512-D515 PolarHBondContact N-OD2 3.06Å; T512-D515 VanDerWaalsContact N-OD2 3.09Å; T512-D515 WeakPolarHBondContact O-CB 3.21Å; T512-D515 PolarHBondContact O-N 3.45Å; T512-D515 PolarHBondContact OG1-N 2.67Å; T512-D515 PolarHBondContact OG1-OD1 3.39Å; T512-D515 PolarHBondContact OG1-OD2 3.34Å; D515-A518 PolarHBondContact O-N 2.69Å; D515-A519 WeakPolarHBondContact O-CB 3.3Å; D515-A519 PolarHBondContact O-N 3.28Å
516	I	95.4	Very high	95.3	Very high	10 Å²	10	24.4 Å²	24.4	5%	0.051	14%	0.139	C	C	.	.	H	α-helix	trans	-65.6	-43.6	179.6	-51.6	167.4	0	0	0	109.9	T510 T512 M513 A519 F520 Y551 A554 V555 L558	T510-I516 HydrophobicContact CG2-CG1 4.4Å; T512-I516 WeakPolarHBondContact O-CG1 3.02Å; T512-I516 PolarHBondContact O-N 3.03Å; T512-I516 VanDerWaalsContact O-N 3.13Å; M513-I516 PolarHBondContact O-N 3.34Å; I516-A519 PolarHBondContact O-N 2.9Å; I516-F520 WeakPolarHBondContact O-CB 3.31Å; I516-F520 PolarHBondContact O-N 2.96Å; I516-Y551 HydrophobicContact CD1-CD2 3.65Å; I516-Y551 HydrophobicContact CD1-CE2 3.49Å; I516-Y551 VanDerWaalsContact CD1-CE2 3.49Å; I516-Y551 HydrophobicContact CG1-CD2 4.42Å; I516-Y551 HydrophobicContact CG1-CE2 3.76Å; I516-A554 HydrophobicContact CD1-CB 3.85Å; I516-V555 HydrophobicContact CG2-CG2 3.87Å; I516-L558 HydrophobicContact CB-CD1 4.08Å; I516-L558 HydrophobicContact CG2-CD1 3.54Å
517	Q	95.5	Very high	95.3	Very high	92 Å²	92	22.9 Å²	22.9	43%	0.43	13%	0.129	S	C	.	.	H	α-helix	trans	-61.8	-46.9	175	-173.4	173.1	21.9	0	0	111.2	M513 A519 F520 N521 L558	M513-Q517 WeakPolarHBondContact O-CB 3.24Å; M513-Q517 PolarHBondContact O-N 3.02Å; Q517-A519 VanDerWaalsContact C-N 3.34Å; Q517-A519 PolarHBondContact O-N 3.13Å; Q517-F520 PolarHBondContact O-N 3.45Å; Q517-N521 WeakPolarHBondContact O-CB 3.4Å; Q517-N521 PolarHBondContact O-N 3.38Å; Q517-N521 PolarHBondContact O-OD1 2.85Å; Q517-L558 HydrophobicContact CB-CD1 4.31Å; Q517-L558 HydrophobicContact CB-CD2 3.98Å; Q517-L558 HydrophobicContact CG-CD2 3.84Å
518	A	95.9	Very high	95	Very high	6 Å²	6	26.2 Å²	26.2	5%	0.05	14%	0.144	C	C	.	.	H	α-helix	trans	-59.1	-44	176.4	0	0	0	0	0	112.5	P461 Y466 A514 D515 T522	P461-A518 HydrophobicContact CB-CB 3.5Å; P461-A518 VanDerWaalsContact CB-CB 3.5Å; P461-A518 HydrophobicContact CG-CB 3.71Å; Y466-A518 HydrophobicContact CE1-CB 4.08Å; Y466-A518 HydrophobicContact CE2-CB 4.35Å; Y466-A518 WeakPolarHBondContact OH-CB 3.34Å; A514-A518 VanDerWaalsContact O-CB 3.29Å; A514-A518 WeakPolarHBondContact O-CB 3.45Å; A514-A518 PolarHBondContact O-N 3.28Å; D515-A518 PolarHBondContact O-N 2.69Å; A518-T522 VanDerWaalsContact O-CB 3.31Å; A518-T522 WeakPolarHBondContact O-CB 3.16Å; A518-T522 PolarHBondContact O-N 3.39Å; A518-T522 PolarHBondContact O-OG1 2.96Å
519	A	96.8	Very high	94.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.6	-51.5	176.5	0	0	0	0	0	111.9	V465 L469 L485 V508 D515 I516 Q517 N521 T522 I523	V465-A519 HydrophobicContact CG1-CB 4.15Å; L469-A519 HydrophobicContact CD1-CB 4.05Å; L485-A519 HydrophobicContact CD2-CB 4.22Å; V508-A519 HydrophobicContact CG1-CB 4.36Å; D515-A519 WeakPolarHBondContact O-CB 3.3Å; D515-A519 PolarHBondContact O-N 3.28Å; I516-A519 PolarHBondContact O-N 2.9Å; Q517-A519 VanDerWaalsContact C-N 3.34Å; Q517-A519 PolarHBondContact O-N 3.13Å; A519-N521 PolarHBondContact O-N 2.9Å; A519-T522 PolarHBondContact O-N 3.47Å; A519-I523 WeakPolarHBondContact O-CG1 3.39Å; A519-I523 PolarHBondContact O-N 3.23Å
520	F	95.8	Very high	94.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.7	-45.7	-178.6	-160.7	-95.4	0	0	0	112	I516 Q517 T522 I523 V524 L558 F559 H562 M574 F576	I516-F520 WeakPolarHBondContact O-CB 3.31Å; I516-F520 PolarHBondContact O-N 2.96Å; Q517-F520 PolarHBondContact O-N 3.45Å; F520-T522 VanDerWaalsContact C-N 3.27Å; F520-T522 PolarHBondContact O-N 3.35Å; F520-I523 PolarHBondContact O-N 3.05Å; F520-V524 HydrophobicContact CD1-CG2 3.77Å; F520-V524 HydrophobicContact CE1-CG2 3.47Å; F520-V524 VanDerWaalsContact CE1-CG2 3.47Å; F520-V524 HydrophobicContact CZ-CG2 4.13Å; F520-V524 WeakPolarHBondContact O-CG2 3.05Å; F520-V524 PolarHBondContact O-N 3.13Å; F520-L558 HydrophobicContact CB-CB 4.28Å; F520-L558 HydrophobicContact CB-CD1 4.3Å; F520-L558 HydrophobicContact CD1-CB 3.91Å; F520-L558 HydrophobicContact CE1-CB 4.48Å; F520-L558 WeakPolarHBondContact CE1-O 3.27Å; F520-L558 HydrophobicContact CG-CB 3.99Å; F520-F559 HydrophobicContact CE2-CB 4.38Å; F520-F559 HydrophobicContact CZ-CB 3.9Å; F520-F559 HydrophobicContact CZ-CD2 4.26Å; F520-H562 AromaticContact CD1-ND1 3.8Å; F520-H562 HydrophobicContact CE1-CB 4.13Å; F520-M574 HydrophobicContact CE2-CE 4.29Å; F520-M574 HydrophobicContact CE2-SD 4Å; F520-M574 HydrophobicContact CZ-CE 3.91Å; F520-M574 HydrophobicContact CZ-SD 3.76Å; F520-F576 HydrophobicContact CE2-CE1 4.14Å; F520-F576 AromaticContact CE2-CZ 3.96Å; F520-F576 HydrophobicContact CE2-CZ 3.96Å; F520-F576 HydrophobicContact CZ-CZ 4.46Å
521	N	94.8	Very high	94.3	Very high	52 Å²	52	34.9 Å²	34.9	28%	0.278	18%	0.181	S	C	.	.	H	α-helix	trans	-61.7	-36	177.5	-68.7	33.3	0	0	0	111.7	Q517 A519 S525 H562	Q517-N521 WeakPolarHBondContact O-CB 3.4Å; Q517-N521 PolarHBondContact O-N 3.38Å; Q517-N521 PolarHBondContact O-OD1 2.85Å; A519-N521 PolarHBondContact O-N 2.9Å; N521-S525 VanDerWaalsContact O-CB 3.24Å; N521-S525 WeakPolarHBondContact O-CB 3.45Å; N521-S525 PolarHBondContact O-N 3.36Å; N521-S525 PolarHBondContact O-OG 3.01Å; N521-H562 PolarHBondContact ND2-NE2 2.87Å; N521-H562 PolarHBondContact OD1-CE1 3.11Å; N521-H562 PolarHBondContact OD1-NE2 3.37Å
522	T	96	Very high	94.2	Very high	29 Å²	29	38.9 Å²	38.9	18%	0.178	20%	0.2	C	C	.	.	H	α-helix	trans	-69.3	-41.9	177	-56.7	0	0	0	0	111.2	L469 L473 A518 A519 F520 S525 R526	L469-T522 HydrophobicContact CB-CG2 4.24Å; L469-T522 HydrophobicContact CD1-CG2 4.25Å; L473-T522 HydrophobicContact CD1-CG2 3.95Å; A518-T522 VanDerWaalsContact O-CB 3.31Å; A518-T522 WeakPolarHBondContact O-CB 3.16Å; A518-T522 PolarHBondContact O-N 3.39Å; A518-T522 PolarHBondContact O-OG1 2.96Å; A519-T522 PolarHBondContact O-N 3.47Å; F520-T522 VanDerWaalsContact C-N 3.27Å; F520-T522 PolarHBondContact O-N 3.35Å; T522-S525 PolarHBondContact O-N 2.89Å; T522-R526 PolarHBondContact O-N 3.33Å
523	I	95.3	Very high	94.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.5	-47.5	177	-63.4	163.9	0	0	0	111.1	L469 I483 L485 A519 F520 S525 R526 I527 I541 I543 M574	L469-I523 HydrophobicContact CD2-CG1 4.29Å; I483-I523 HydrophobicContact CD1-CD1 3.73Å; I483-I523 HydrophobicContact CD1-CG1 3.69Å; I483-I523 HydrophobicContact CD1-CG2 4.27Å; I483-I523 HydrophobicContact CG2-CD1 4.43Å; L485-I523 HydrophobicContact CD2-CD1 4.31Å; A519-I523 WeakPolarHBondContact O-CG1 3.39Å; A519-I523 PolarHBondContact O-N 3.23Å; F520-I523 PolarHBondContact O-N 3.05Å; I523-S525 VanDerWaalsContact C-N 3.28Å; I523-S525 PolarHBondContact O-N 2.82Å; I523-R526 WeakPolarHBondContact O-CB 3.3Å; I523-R526 PolarHBondContact O-N 3.06Å; I523-I527 HydrophobicContact CG2-CD1 4.19Å; I523-I527 WeakPolarHBondContact O-CG1 3.36Å; I523-I527 PolarHBondContact O-N 3.12Å; I523-I541 HydrophobicContact CG2-CD1 4.44Å; I523-I543 HydrophobicContact CG2-CD1 4.04Å; I523-M574 HydrophobicContact CG2-CE 4.25Å
524	V	94.7	Very high	93.8	Very high	9 Å²	9	39 Å²	39	6%	0.055	21%	0.207	C	C	.	.	H	α-helix	trans	-56.4	-44.2	173.9	169.5	0	0	0	0	110.8	F520 R526 I527 Q528 H562 W570 M574	F520-V524 HydrophobicContact CD1-CG2 3.77Å; F520-V524 HydrophobicContact CE1-CG2 3.47Å; F520-V524 VanDerWaalsContact CE1-CG2 3.47Å; F520-V524 HydrophobicContact CZ-CG2 4.13Å; F520-V524 WeakPolarHBondContact O-CG2 3.05Å; F520-V524 PolarHBondContact O-N 3.13Å; V524-R526 VanDerWaalsContact C-N 3.31Å; V524-R526 PolarHBondContact O-N 2.98Å; V524-I527 PolarHBondContact O-N 2.78Å; V524-Q528 PolarHBondContact O-N 3.49Å; V524-H562 HydrophobicContact CG2-CB 4.48Å; V524-W570 HydrophobicContact CG1-CH2 4.45Å; V524-W570 HydrophobicContact CG1-CZ3 3.96Å; V524-M574 HydrophobicContact CG2-CE 3.71Å
525	S	94.2	Very high	93.3	Very high	55 Å²	55	44.7 Å²	44.7	39%	0.385	25%	0.246	S	C	.	.	H	α-helix	trans	-64.9	-34	176.9	-58.6	0	0	0	0	112.4	N521 T522 I523 Q528 R529	N521-S525 VanDerWaalsContact O-CB 3.24Å; N521-S525 WeakPolarHBondContact O-CB 3.45Å; N521-S525 PolarHBondContact O-N 3.36Å; N521-S525 PolarHBondContact O-OG 3.01Å; T522-S525 PolarHBondContact O-N 2.89Å; I523-S525 VanDerWaalsContact C-N 3.28Å; I523-S525 PolarHBondContact O-N 2.82Å; S525-Q528 PolarHBondContact O-N 3.42Å; S525-R529 WeakPolarHBondContact O-CG 3.36Å; S525-R529 PolarHBondContact O-N 2.86Å; S525-R529 VanDerWaalsContact O-N 3.11Å
526	R	93.6	Very high	92.8	Very high	23 Å²	23	51.4 Å²	51.4	9%	0.087	28%	0.277	C	S	.	.	H	α-helix	trans	-65.7	-49.7	176.2	-150.5	79.1	-171.8	107.7	-22.2	111.5	L473 S475 D476 L479 T522 I523 V524 Q528 R529 F530	L473-R526 HydrophobicContact CB-CG 4.17Å; L473-R526 HydrophobicContact CD1-CB 4.39Å; L473-R526 HydrophobicContact CD1-CG 4.31Å; L473-R526 HydrophobicContact CD2-CG 4.25Å; L473-R526 HydrophobicContact CG-CG 4.49Å; L473-R526 VanDerWaalsContact O-CZ 3.27Å; L473-R526 PolarHBondContact O-NE 2.87Å; L473-R526 PolarHBondContact O-NH2 3Å; S475-R526 PolarHBondContact O-NH2 2.99Å; D476-R526 IonicContact OD1-CZ 3.22Å; D476-R526 IonicContact OD1-NH1 2.7Å; D476-R526 PolarHBondContact OD1-NH1 3.33Å; D476-R526 VanDerWaalsContact OD1-NH1 3.08Å; D476-R526 IonicContact OD1-NH2 3.77Å; D476-R526 PolarHBondContact OD1-NH2 2.94Å; D476-R526 IonicContact OD2-CZ 3.45Å; D476-R526 IonicContact OD2-NH1 3.75Å; D476-R526 PolarHBondContact OD2-NH1 2.86Å; D476-R526 IonicContact OD2-NH2 2.8Å; L479-R526 HydrophobicContact CD2-CB 4.18Å; L479-R526 HydrophobicContact CD2-CG 3.81Å; T522-R526 PolarHBondContact O-N 3.33Å; I523-R526 WeakPolarHBondContact O-CB 3.3Å; I523-R526 PolarHBondContact O-N 3.06Å; V524-R526 VanDerWaalsContact C-N 3.31Å; V524-R526 PolarHBondContact O-N 2.98Å; R526-Q528 VanDerWaalsContact C-N 3.28Å; R526-Q528 PolarHBondContact O-N 2.64Å; R526-R529 PolarHBondContact O-N 2.91Å; R526-F530 PolarHBondContact O-N 3.49Å
527	I	94	Very high	92.3	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-59.1	-42.9	176	-63.4	166.5	0	0	0	109.6	L479 I523 V524 R529 F530 C531 P538 I541 W570 Y573 M574	L479-I527 HydrophobicContact CD1-CG1 4.18Å; L479-I527 HydrophobicContact CD2-CG1 4.38Å; I523-I527 HydrophobicContact CG2-CD1 4.19Å; I523-I527 WeakPolarHBondContact O-CG1 3.36Å; I523-I527 PolarHBondContact O-N 3.12Å; V524-I527 PolarHBondContact O-N 2.78Å; I527-R529 PolarHBondContact O-N 3.31Å; I527-F530 PolarHBondContact O-N 2.78Å; I527-C531 PolarHBondContact O-N 3.22Å; I527-C531 PolarHBondContact O-SG 3.09Å; I527-P538 HydrophobicContact CG2-CG 4.34Å; I527-I541 HydrophobicContact CD1-CD1 3.96Å; I527-I541 HydrophobicContact CG1-CD1 3.77Å; I527-W570 HydrophobicContact CB-CH2 4.31Å; I527-W570 HydrophobicContact CB-CZ3 4.08Å; I527-W570 HydrophobicContact CG2-CE3 4.35Å; I527-W570 HydrophobicContact CG2-CH2 4.01Å; I527-W570 HydrophobicContact CG2-CZ3 3.83Å; I527-Y573 HydrophobicContact CG2-CD2 3.81Å; I527-Y573 HydrophobicContact CG2-CG 4.28Å; I527-M574 HydrophobicContact CD1-CE 3.6Å; I527-M574 HydrophobicContact CD1-CG 4.1Å
528	Q	92.9	Very high	92	Very high	77 Å²	77	51.8 Å²	51.8	36%	0.36	29%	0.287	S	S	.	.	H	α-helix	trans	-59.3	-44.6	177.9	-164.4	164.5	-34.1	0	0	112.5	V524 S525 R526 C531 N532 W570	V524-Q528 PolarHBondContact O-N 3.49Å; S525-Q528 PolarHBondContact O-N 3.42Å; R526-Q528 VanDerWaalsContact C-N 3.28Å; R526-Q528 PolarHBondContact O-N 2.64Å; Q528-C531 PolarHBondContact O-N 3.03Å; Q528-N532 PolarHBondContact O-N 3.04Å; Q528-N532 PolarHBondContact O-OD1 2.85Å; Q528-N532 VanDerWaalsContact O-OD1 3.13Å; Q528-W570 HydrophobicContact CB-CH2 3.82Å; Q528-W570 HydrophobicContact CB-CZ2 4.32Å; Q528-W570 HydrophobicContact CG-CH2 4.36Å; Q528-W570 HydrophobicContact CG-CZ2 4.4Å
529	R	92.8	Very high	91.7	Very high	134 Å²	134	57.2 Å²	57.2	51%	0.506	31%	0.313	S	S	.	.	H	α-helix	trans	-66.6	-41.9	177.2	-67.4	-175.1	-159.6	170.1	4.4	112.3	D476 S525 R526 I527 C531 N532 C533	D476-R529 WeakPolarHBondContact OD2-CD 3.22Å; D476-R529 IonicContact OD2-CZ 3.79Å; D476-R529 IonicContact OD2-NE 2.76Å; D476-R529 IonicContact OD2-NH1 3.24Å; D476-R529 PolarHBondContact OD2-NH1 2.87Å; D476-R529 VanDerWaalsContact OD2-NH1 3.14Å; S525-R529 WeakPolarHBondContact O-CG 3.36Å; S525-R529 PolarHBondContact O-N 2.86Å; S525-R529 VanDerWaalsContact O-N 3.11Å; R526-R529 PolarHBondContact O-N 2.91Å; I527-R529 PolarHBondContact O-N 3.31Å; R529-C531 PolarHBondContact O-N 3.18Å; R529-N532 WeakPolarHBondContact O-CB 3.47Å; R529-N532 PolarHBondContact O-N 3.21Å; R529-N532 VanDerWaalsContact O-N 3.12Å; R529-C533 PolarHBondContact O-N 3.06Å; R529-C533 PolarHBondContact O-SG 3.44Å
530	F	92.9	Very high	91.5	Very high	23 Å²	23	59 Å²	59	10%	0.101	33%	0.325	C	S	.	.	H	α-helix	trans	-57.7	-48	175.7	178.6	-84.8	0	0	0	111.2	N477 L479 R526 I527 N532 C533 N534 P538	N477-F530 WeakPolarHBondContact O-CE2 3.2Å; L479-F530 HydrophobicContact CD1-CB 3.87Å; L479-F530 HydrophobicContact CD1-CD1 3.8Å; L479-F530 HydrophobicContact CD1-CD2 4.16Å; L479-F530 HydrophobicContact CD1-CE1 4.4Å; L479-F530 HydrophobicContact CD1-CG 3.66Å; L479-F530 HydrophobicContact CD2-CB 3.86Å; L479-F530 HydrophobicContact CD2-CG 4.3Å; L479-F530 HydrophobicContact CG-CB 3.82Å; L479-F530 HydrophobicContact CG-CD1 4.33Å; L479-F530 HydrophobicContact CG-CD2 3.78Å; L479-F530 HydrophobicContact CG-CE2 4.45Å; L479-F530 HydrophobicContact CG-CG 3.7Å; R526-F530 PolarHBondContact O-N 3.49Å; I527-F530 PolarHBondContact O-N 2.78Å; F530-N532 VanDerWaalsContact C-N 3.28Å; F530-N532 PolarHBondContact O-N 2.9Å; F530-C533 PolarHBondContact O-N 3.31Å; F530-C533 VanDerWaalsContact O-N 3.1Å; F530-N534 HydrophobicContact CD1-CB 4.35Å; F530-N534 WeakPolarHBondContact CD2-ND2 3.44Å; F530-N534 HydrophobicContact CE1-CB 3.96Å; F530-N534 HydrophobicContact CE2-CB 4.38Å; F530-N534 HydrophobicContact CZ-CB 3.98Å; F530-N534 WeakPolarHBondContact O-CB 3.33Å; F530-N534 PolarHBondContact O-N 2.86Å; F530-N534 PolarHBondContact O-ND2 2.98Å; F530-P538 HydrophobicContact CD1-CB 4.42Å; F530-P538 HydrophobicContact CD1-CG 3.91Å; F530-P538 HydrophobicContact CE1-CB 4.37Å; F530-P538 HydrophobicContact CE1-CG 4.09Å
531	C	91.9	Very high	91.5	Very high	39 Å²	39	59.1 Å²	59.1	26%	0.264	33%	0.325	S	S	.	.	H	α-helix	trans	-64.4	-28.4	176.5	-62.1	0	0	0	0	113.6	I527 Q528 R529 C533 P538	I527-C531 PolarHBondContact O-N 3.22Å; I527-C531 PolarHBondContact O-SG 3.09Å; Q528-C531 PolarHBondContact O-N 3.03Å; R529-C531 PolarHBondContact O-N 3.18Å; C531-C533 VanDerWaalsContact C-N 3.35Å; C531-P538 WeakPolarHBondContact SG-CG 3.24Å
532	N	91.3	Very high	91.7	Very high	127 Å²	127	57.8 Å²	57.8	68%	0.679	32%	0.317	S	S	*	.	H	α-helix	trans	-74.9	-25.6	174.4	-70.9	4.2	0	0	0	112.5	Q528 R529 F530	Q528-N532 PolarHBondContact O-N 3.04Å; Q528-N532 PolarHBondContact O-OD1 2.85Å; Q528-N532 VanDerWaalsContact O-OD1 3.13Å; R529-N532 WeakPolarHBondContact O-CB 3.47Å; R529-N532 PolarHBondContact O-N 3.21Å; R529-N532 VanDerWaalsContact O-N 3.12Å; F530-N532 VanDerWaalsContact C-N 3.28Å; F530-N532 PolarHBondContact O-N 2.9Å
533	C	89.3	Confident	91.8	Very high	80 Å²	80	56.4 Å²	56.4	54%	0.541	31%	0.309	S	S	.	.	H	α-helix	trans	-101.6	-15.1	-177.2	-66.4	0	0	0	0	114	R529 F530 C531	R529-C533 PolarHBondContact O-N 3.06Å; R529-C533 PolarHBondContact O-SG 3.44Å; F530-C533 PolarHBondContact O-N 3.31Å; F530-C533 VanDerWaalsContact O-N 3.1Å; C531-C533 VanDerWaalsContact C-N 3.35Å
534	N	86.6	Confident	91.9	Very high	49 Å²	49	56.4 Å²	56.4	26%	0.262	31%	0.309	S	S	.	.			trans	-133.9	130.5	-174.1	-57.1	-91.2	0	0	0	110.3	F530 Q536	F530-N534 HydrophobicContact CD1-CB 4.35Å; F530-N534 WeakPolarHBondContact CD2-ND2 3.44Å; F530-N534 HydrophobicContact CE1-CB 3.96Å; F530-N534 HydrophobicContact CE2-CB 4.38Å; F530-N534 HydrophobicContact CZ-CB 3.98Å; F530-N534 WeakPolarHBondContact O-CB 3.33Å; F530-N534 PolarHBondContact O-N 2.86Å; F530-N534 PolarHBondContact O-ND2 2.98Å; N534-Q536 VanDerWaalsContact C-N 3.31Å
535	S	83.5	Confident	92.1	Very high	134 Å²	134	56.1 Å²	56.1	94%	0.937	31%	0.307	S	S	*	.	S	Bend	trans	-79.6	-11	175.9	53	0	0	0	0	113.9
536	Q	85.4	Confident	92.3	Very high	141 Å²	141	53.5 Å²	53.5	66%	0.659	29%	0.289	S	S	*	.	S	Bend	trans	-79.9	139.3	175.3	-173.6	175.7	-0.3	0	0	110.6	N534	N534-Q536 VanDerWaalsContact C-N 3.31Å
537	T	84.9	Confident	92.4	Very high	101 Å²	101	52.5 Å²	52.5	62%	0.62	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-59.8	131	173.3	43.5	0	0	0	0	111.2	I539	T537-I539 PolarHBondContact O-N 2.73Å
538	P	89.1	Confident	92.4	Very high	9 Å²	9	53.6 Å²	53.6	6%	0.058	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-49.3	135.5	173.3	-28.9	30.9	0	0	0	113.7	L479 I527 F530 C531 Y573	L479-P538 HydrophobicContact CD1-CB 3.95Å; L479-P538 HydrophobicContact CD1-CG 4.43Å; I527-P538 HydrophobicContact CG2-CG 4.34Å; F530-P538 HydrophobicContact CD1-CB 4.42Å; F530-P538 HydrophobicContact CD1-CG 3.91Å; F530-P538 HydrophobicContact CE1-CB 4.37Å; F530-P538 HydrophobicContact CE1-CG 4.09Å; C531-P538 WeakPolarHBondContact SG-CG 3.24Å; P538-Y573 HydrophobicContact CB-CD1 3.8Å; P538-Y573 HydrophobicContact CB-CE1 4.35Å; P538-Y573 HydrophobicContact CB-CG 4.03Å; P538-Y573 HydrophobicContact CG-CD1 3.78Å; P538-Y573 HydrophobicContact CG-CD2 4.13Å; P538-Y573 HydrophobicContact CG-CE1 3.94Å; P538-Y573 HydrophobicContact CG-CE2 4.27Å; P538-Y573 HydrophobicContact CG-CG 3.91Å
539	I	90.5	Very high	92.4	Very high	120 Å²	120	50.3 Å²	50.3	62%	0.615	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-64.6	133.1	161.4	-61	178.9	0	0	0	107.4	T537 I541	T537-I539 PolarHBondContact O-N 2.73Å; I539-I541 PolarHBondContact O-N 2.95Å; I539-I541 VanDerWaalsContact O-N 3.15Å
540	P	93	Very high	92.4	Very high	38 Å²	38	47.6 Å²	47.6	25%	0.247	27%	0.272	C	S	.	.			trans	-70.1	114.4	-171.3	-19	31.6	0	0	0	112.4	K542 G572 R575	P540-K542 PolarHBondContact O-N 3.18Å; P540-G572 WeakPolarHBondContact CB-O 3.46Å; P540-G572 WeakPolarHBondContact CG-O 3.33Å; P540-R575 PolarHBondContact O-NH1 3.19Å
541	I	95.9	Very high	92.6	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	127.4	-178.4	-54.7	-178.1	0	0	0	109.6	L479 I483 I523 I527 I539 I543 Y573 R575	L479-I541 HydrophobicContact CB-CD1 3.98Å; L479-I541 HydrophobicContact CB-CG1 4.23Å; L479-I541 HydrophobicContact CD1-CD1 4.22Å; L479-I541 HydrophobicContact CD2-CD1 4.17Å; L479-I541 HydrophobicContact CG-CD1 4.34Å; I483-I541 HydrophobicContact CD1-CG2 4.03Å; I483-I541 HydrophobicContact CG1-CG2 4.04Å; I523-I541 HydrophobicContact CG2-CD1 4.44Å; I527-I541 HydrophobicContact CD1-CD1 3.96Å; I527-I541 HydrophobicContact CG1-CD1 3.77Å; I539-I541 PolarHBondContact O-N 2.95Å; I539-I541 VanDerWaalsContact O-N 3.15Å; I541-I543 HydrophobicContact CG2-CG1 4.11Å; I541-I543 PolarHBondContact O-N 2.91Å; I541-Y573 PolarHBondContact N-O 2.85Å; I541-Y573 VanDerWaalsContact N-O 3.1Å; I541-R575 PolarHBondContact O-N 3.02Å
542	K	97.4	Very high	92.9	Very high	24 Å²	24	44.9 Å²	44.9	10%	0.104	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	96	174.4	-65.9	172.3	174.9	173.5	0	110.4	D481 S482 I483 P540 A544 R575 L577 M633 E634 N637	D481-K542 WeakPolarHBondContact O-CB 3.37Å; D481-K542 PolarHBondContact O-N 3.06Å; S482-K542 CarbonylContact C-O 3.52Å; S482-K542 WeakPolarHBondContact CA-O 3.4Å; S482-K542 WeakPolarHBondContact CB-O 3.5Å; I483-K542 PolarHBondContact N-O 3.13Å; P540-K542 PolarHBondContact O-N 3.18Å; K542-A544 PolarHBondContact O-N 2.82Å; K542-R575 CarbonylContact C-O 3.57Å; K542-R575 VanDerWaalsContact CA-O 3.32Å; K542-R575 WeakPolarHBondContact CA-O 3.4Å; K542-L577 HydrophobicContact CB-CD1 3.94Å; K542-L577 HydrophobicContact CB-CG 4.46Å; K542-L577 HydrophobicContact CD-CD1 4.31Å; K542-L577 HydrophobicContact CG-CD1 4.36Å; K542-M633 HydrophobicContact CB-CE 4.47Å; K542-M633 WeakPolarHBondContact CD-O 3.4Å; K542-M633 WeakPolarHBondContact CE-O 3.36Å; K542-M633 PolarHBondContact NZ-O 2.83Å; K542-E634 PolarHBondContact NZ-O 2.91Å; K542-N637 WeakPolarHBondContact CE-OD1 3.45Å; K542-N637 PolarHBondContact NZ-OD1 2.84Å
543	I	98	Very high	93.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	97.8	177.7	-55.1	176	0	0	0	108.3	I483 L485 I523 I541 V545 M574 R575 F576 L577	I483-I543 CarbonylContact O-C 3.57Å; I483-I543 WeakPolarHBondContact O-CA 3.33Å; L485-I543 HydrophobicContact CD1-CG2 3.68Å; L485-I543 HydrophobicContact CG-CG2 3.97Å; I523-I543 HydrophobicContact CG2-CD1 4.04Å; I541-I543 HydrophobicContact CG2-CG1 4.11Å; I541-I543 PolarHBondContact O-N 2.91Å; I543-V545 HydrophobicContact CG2-CG2 4.46Å; I543-M574 HydrophobicContact CD1-CB 4.25Å; I543-M574 HydrophobicContact CD1-CE 4.3Å; I543-M574 HydrophobicContact CD1-CG 3.93Å; I543-M574 HydrophobicContact CD1-SD 3.79Å; I543-R575 PolarHBondContact N-O 2.97Å; I543-F576 HydrophobicContact CB-CD1 3.94Å; I543-F576 HydrophobicContact CB-CE1 3.99Å; I543-F576 HydrophobicContact CD1-CE1 3.96Å; I543-F576 HydrophobicContact CD1-CZ 4.18Å; I543-F576 HydrophobicContact CG2-CD1 4.08Å; I543-F576 HydrophobicContact CG2-CE1 3.99Å; I543-F576 CarbonylContact O-C 3.55Å; I543-F576 VanDerWaalsContact O-CA 3.27Å; I543-F576 WeakPolarHBondContact O-CA 3.46Å; I543-L577 PolarHBondContact O-N 2.89Å
544	A	98.4	Very high	93.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	140.4	171.2	0	0	0	0	0	111.3	I483 I484 L485 K542 L577 I579 M633	I483-A544 PolarHBondContact O-N 3.16Å; I484-A544 HydrophobicContact CB-CB 4.34Å; I484-A544 HydrophobicContact CG1-CB 4.23Å; I484-A544 HydrophobicContact CG2-CB 4.07Å; L485-A544 WeakPolarHBondContact CB-O 3.41Å; L485-A544 PolarHBondContact N-O 3.26Å; K542-A544 PolarHBondContact O-N 2.82Å; A544-L577 CarbonylContact C-O 3.58Å; A544-L577 VanDerWaalsContact CA-O 3.29Å; A544-L577 WeakPolarHBondContact CA-O 3.39Å; A544-L577 HydrophobicContact CB-CB 4Å; A544-I579 HydrophobicContact CB-CD1 3.94Å; A544-M633 HydrophobicContact CB-CE 3.74Å; A544-M633 HydrophobicContact CB-SD 3.58Å; A544-M633 VanDerWaalsContact CB-SD 3.58Å
545	V	98.3	Very high	94	Very high	3 Å²	3	33 Å²	33	2%	0.018	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	97.3	-176.9	-178.9	0	0	0	0	106.7	I543 Y551 L552 V555 F576 L577 I579	I543-V545 HydrophobicContact CG2-CG2 4.46Å; V545-Y551 HydrophobicContact CG1-CD1 3.56Å; V545-Y551 HydrophobicContact CG1-CE1 3.59Å; V545-L552 HydrophobicContact CB-CD1 4.27Å; V545-L552 HydrophobicContact CG1-CB 4.46Å; V545-L552 HydrophobicContact CG1-CD1 3.92Å; V545-L552 HydrophobicContact CG2-CD1 4.48Å; V545-V555 HydrophobicContact CG1-CG2 4.02Å; V545-V555 HydrophobicContact CG2-CG1 4.11Å; V545-V555 HydrophobicContact CG2-CG2 4.31Å; V545-F576 HydrophobicContact CG2-CD1 4.04Å; V545-L577 PolarHBondContact N-O 2.83Å; V545-I579 PolarHBondContact O-N 2.8Å
546	A	97.9	Very high	94.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	108	-179.2	0	0	0	0	0	110.8	L485 I486 N487 L496 Y551 I579	L485-A546 PolarHBondContact O-N 3.26Å; I486-A546 HydrophobicContact CB-CB 4.42Å; I486-A546 HydrophobicContact CG1-CB 4.1Å; I486-A546 HydrophobicContact CG2-CB 4.25Å; N487-A546 PolarHBondContact N-O 2.78Å; L496-A546 HydrophobicContact CD2-CB 3.68Å; A546-Y551 WeakPolarHBondContact O-CE1 3.28Å; A546-I579 WeakPolarHBondContact CA-O 3.48Å; A546-I579 HydrophobicContact CB-CB 3.95Å; A546-I579 HydrophobicContact CB-CD1 4.42Å; A546-I579 HydrophobicContact CB-CG2 4.14Å
547	G	95.9	Very high	95.2	Very high	2 Å²	2	21.6 Å²	21.6	2%	0.021	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.6	-175.6	-176	0	0	0	0	0	113.8	I579 L581	G547-I579 PolarHBondContact N-O 2.94Å; G547-L581 CarbonylContact C-O 3.6Å; G547-L581 PolarHBondContact O-N 3.31Å
548	A	93.9	Very high	95.7	Very high	23 Å²	23	17.3 Å²	17.3	19%	0.19	9%	0.091	C	C	.	.			trans	-77	166.1	172.4	0	0	0	0	0	111.7	H550 Y551 L552 L581	A548-H550 PolarHBondContact O-N 3.11Å; A548-Y551 VanDerWaalsContact O-CB 3.32Å; A548-Y551 WeakPolarHBondContact O-CB 3.29Å; A548-Y551 PolarHBondContact O-N 3.28Å; A548-L552 PolarHBondContact O-N 3.36Å; A548-L581 WeakPolarHBondContact CA-O 3.15Å; A548-L581 WeakPolarHBondContact CB-O 3.48Å; A548-L581 PolarHBondContact N-O 3.29Å
549	Q	93.5	Very high	96.1	Very high	8 Å²	8	16.9 Å²	16.9	4%	0.037	9%	0.088	C	C	.	.	H	α-helix	trans	-51.3	-31.9	-179.6	-178	66	75.8	0	0	114	S553 H584 V586 D856	Q549-S553 PolarHBondContact O-N 2.99Å; Q549-H584 VanDerWaalsContact CD-CE1 3.46Å; Q549-H584 PolarHBondContact OE1-CE1 2.86Å; Q549-H584 PolarHBondContact OE1-ND1 3Å; Q549-V586 VanDerWaalsContact OE1-N 3.17Å; Q549-D856 CarbonylContact C-O 3.5Å; Q549-D856 HydrophobicContact CG-CB 4.38Å; Q549-D856 VanDerWaalsContact O-O 3.13Å
550	H	93.8	Very high	96.4	Very high	77 Å²	77	11.1 Å²	11.1	36%	0.356	6%	0.059	S	C	.	.	H	α-helix	trans	-69.9	-31.4	177.7	71	-112.2	0	0	0	113.2	A548 S553 A554 D856 V858	A548-H550 PolarHBondContact O-N 3.11Å; H550-S553 WeakPolarHBondContact O-CB 3.38Å; H550-S553 PolarHBondContact O-N 3.02Å; H550-A554 PolarHBondContact O-N 3.41Å; H550-A554 VanDerWaalsContact O-N 3.13Å; H550-D856 VanDerWaalsContact CA-O 3.3Å; H550-D856 WeakPolarHBondContact CA-O 3.27Å; H550-D856 PolarHBondContact N-O 2.97Å; H550-V858 HydrophobicContact CB-CG2 3.88Å
551	Y	96.7	Very high	96.4	Very high	4 Å²	4	13.5 Å²	13.5	2%	0.016	7%	0.07	C	C	.	.	H	α-helix	trans	-71.9	-43.1	176.7	179.3	-111.9	0	0	0	110.5	L485 I486 N487 T510 I516 V545 A546 A548 S553 A554 V555	L485-Y551 WeakPolarHBondContact CB-OH 3.29Å; I486-Y551 PolarHBondContact N-OH 3.23Å; I486-Y551 PolarHBondContact O-OH 2.71Å; N487-Y551 HydrophobicContact CB-CD1 4.04Å; N487-Y551 HydrophobicContact CB-CD2 3.64Å; N487-Y551 HydrophobicContact CB-CE1 4.17Å; N487-Y551 HydrophobicContact CB-CE2 3.77Å; N487-Y551 HydrophobicContact CB-CG 3.77Å; T510-Y551 VanDerWaalsContact OG1-CE2 3.25Å; T510-Y551 WeakPolarHBondContact OG1-CE2 3.38Å; T510-Y551 PolarHBondContact OG1-OH 3.44Å; I516-Y551 HydrophobicContact CD1-CD2 3.65Å; I516-Y551 HydrophobicContact CD1-CE2 3.49Å; I516-Y551 VanDerWaalsContact CD1-CE2 3.49Å; I516-Y551 HydrophobicContact CG1-CD2 4.42Å; I516-Y551 HydrophobicContact CG1-CE2 3.76Å; V545-Y551 HydrophobicContact CG1-CD1 3.56Å; V545-Y551 HydrophobicContact CG1-CE1 3.59Å; A546-Y551 WeakPolarHBondContact O-CE1 3.28Å; A548-Y551 VanDerWaalsContact O-CB 3.32Å; A548-Y551 WeakPolarHBondContact O-CB 3.29Å; A548-Y551 PolarHBondContact O-N 3.28Å; Y551-S553 VanDerWaalsContact C-N 3.26Å; Y551-S553 PolarHBondContact O-N 2.94Å; Y551-A554 WeakPolarHBondContact O-CB 3.4Å; Y551-A554 PolarHBondContact O-N 3.24Å; Y551-V555 PolarHBondContact O-N 3.06Å; Y551-V555 VanDerWaalsContact O-N 3.13Å
552	L	96.9	Very high	96.3	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-59.1	-38.2	169.7	-175.3	66.4	0	0	0	111.8	V545 A548 A554 V555 L556 I578 H584 V586 I679 F879	V545-L552 HydrophobicContact CB-CD1 4.27Å; V545-L552 HydrophobicContact CG1-CB 4.46Å; V545-L552 HydrophobicContact CG1-CD1 3.92Å; V545-L552 HydrophobicContact CG2-CD1 4.48Å; A548-L552 PolarHBondContact O-N 3.36Å; L552-A554 VanDerWaalsContact C-N 3.27Å; L552-A554 PolarHBondContact O-N 3.1Å; L552-V555 PolarHBondContact O-N 3.01Å; L552-L556 WeakPolarHBondContact O-CB 3.4Å; L552-L556 PolarHBondContact O-N 2.82Å; L552-I578 HydrophobicContact CD1-CD1 4.19Å; L552-I578 HydrophobicContact CD1-CG1 4.02Å; L552-I578 HydrophobicContact CD2-CD1 3.49Å; L552-I578 VanDerWaalsContact CD2-CD1 3.49Å; L552-I578 HydrophobicContact CD2-CG1 4.01Å; L552-I578 HydrophobicContact CD2-CG2 4.44Å; L552-H584 VanDerWaalsContact CD2-CE1 3.48Å; L552-H584 WeakPolarHBondContact CD2-CE1 3.44Å; L552-V586 HydrophobicContact CD2-CB 4.4Å; L552-V586 HydrophobicContact CD2-CG1 4.45Å; L552-V586 HydrophobicContact CD2-CG2 4.35Å; L552-I679 HydrophobicContact CD2-CD1 3.98Å; L552-I679 HydrophobicContact CG-CD1 4.49Å; L552-F879 HydrophobicContact CD1-CE1 3.95Å; L552-F879 HydrophobicContact CD1-CZ 4.06Å
553	S	96.1	Very high	96.1	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.007	8%	0.076	C	C	.	.	H	α-helix	trans	-64.8	-29.5	175.5	-159.9	0	0	0	0	113.1	Q549 H550 Y551 R557 D856	Q549-S553 PolarHBondContact O-N 2.99Å; H550-S553 WeakPolarHBondContact O-CB 3.38Å; H550-S553 PolarHBondContact O-N 3.02Å; Y551-S553 VanDerWaalsContact C-N 3.26Å; Y551-S553 PolarHBondContact O-N 2.94Å; S553-R557 WeakPolarHBondContact O-CD 3.28Å; S553-R557 VanDerWaalsContact O-CG 3.24Å; S553-R557 WeakPolarHBondContact O-CG 3.34Å; S553-R557 PolarHBondContact O-N 2.86Å; S553-R557 PolarHBondContact O-NE 2.9Å; S553-R557 PolarHBondContact OG-NH2 3.19Å; S553-D856 WeakPolarHBondContact OG-CB 3.08Å
554	A	96.6	Very high	95.9	Very high	5 Å²	5	16 Å²	16	4%	0.041	9%	0.085	C	C	.	.	H	α-helix	trans	-69	-46.4	172.3	0	0	0	0	0	111.7	M513 I516 H550 Y551 L552 R557 L558	M513-A554 HydrophobicContact CE-CB 3.67Å; M513-A554 HydrophobicContact SD-CB 3.99Å; I516-A554 HydrophobicContact CD1-CB 3.85Å; H550-A554 PolarHBondContact O-N 3.41Å; H550-A554 VanDerWaalsContact O-N 3.13Å; Y551-A554 WeakPolarHBondContact O-CB 3.4Å; Y551-A554 PolarHBondContact O-N 3.24Å; L552-A554 VanDerWaalsContact C-N 3.27Å; L552-A554 PolarHBondContact O-N 3.1Å; A554-R557 PolarHBondContact O-N 2.76Å; A554-L558 PolarHBondContact O-N 3.35Å
555	V	97.6	Very high	95.5	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.2	-41.6	176.7	179.6	0	0	0	0	111.5	I516 V545 Y551 L552 R557 L558 F559 F576	I516-V555 HydrophobicContact CG2-CG2 3.87Å; V545-V555 HydrophobicContact CG1-CG2 4.02Å; V545-V555 HydrophobicContact CG2-CG1 4.11Å; V545-V555 HydrophobicContact CG2-CG2 4.31Å; Y551-V555 PolarHBondContact O-N 3.06Å; Y551-V555 VanDerWaalsContact O-N 3.13Å; L552-V555 PolarHBondContact O-N 3.01Å; V555-R557 VanDerWaalsContact C-N 3.33Å; V555-R557 PolarHBondContact O-N 2.7Å; V555-L558 PolarHBondContact O-N 2.76Å; V555-F559 WeakPolarHBondContact O-CB 3.2Å; V555-F559 PolarHBondContact O-N 2.78Å; V555-F576 HydrophobicContact CG1-CD1 4.13Å; V555-F576 HydrophobicContact CG1-CE1 3.73Å
556	L	97.7	Very high	95.2	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-57.2	-43.6	175.9	175.1	66.6	0	0	0	112.3	L552 F559 V560 I644 P677 I679 F879	L552-L556 WeakPolarHBondContact O-CB 3.4Å; L552-L556 PolarHBondContact O-N 2.82Å; L556-F559 PolarHBondContact O-N 2.78Å; L556-V560 HydrophobicContact CD1-CG2 4.32Å; L556-V560 WeakPolarHBondContact O-CG2 3.42Å; L556-V560 PolarHBondContact O-N 3.47Å; L556-I644 HydrophobicContact CD1-CD1 3.91Å; L556-I644 HydrophobicContact CD1-CG1 4.2Å; L556-P677 HydrophobicContact CD2-CB 4.45Å; L556-P677 HydrophobicContact CG-CB 4.41Å; L556-I679 HydrophobicContact CD1-CG2 4.07Å; L556-I679 HydrophobicContact CD2-CB 4.41Å; L556-I679 HydrophobicContact CD2-CD1 4.31Å; L556-I679 HydrophobicContact CD2-CG1 4.02Å; L556-I679 HydrophobicContact CD2-CG2 3.91Å; L556-F879 HydrophobicContact CD1-CB 4.06Å; L556-F879 HydrophobicContact CD1-CD2 3.56Å; L556-F879 HydrophobicContact CD1-CE2 4.12Å; L556-F879 HydrophobicContact CD1-CG 3.85Å
557	R	96.5	Very high	95	Very high	36 Å²	36	30.1 Å²	30.1	14%	0.136	15%	0.154	C	C	.	.	H	α-helix	trans	-62.7	-51	177.2	-70.3	162.7	-156.7	169.7	8.1	110.5	S553 A554 V555 F559 V560 D561 P677 V858	S553-R557 WeakPolarHBondContact O-CD 3.28Å; S553-R557 VanDerWaalsContact O-CG 3.24Å; S553-R557 WeakPolarHBondContact O-CG 3.34Å; S553-R557 PolarHBondContact O-N 2.86Å; S553-R557 PolarHBondContact O-NE 2.9Å; S553-R557 PolarHBondContact OG-NH2 3.19Å; A554-R557 PolarHBondContact O-N 2.76Å; V555-R557 VanDerWaalsContact C-N 3.33Å; V555-R557 PolarHBondContact O-N 2.7Å; R557-F559 VanDerWaalsContact C-N 3.28Å; R557-F559 PolarHBondContact O-N 2.86Å; R557-V560 PolarHBondContact O-N 3.19Å; R557-V560 VanDerWaalsContact O-N 3.11Å; R557-D561 WeakPolarHBondContact O-CB 3.45Å; R557-D561 PolarHBondContact O-N 3.07Å; R557-P677 HydrophobicContact CB-CG 4.47Å; R557-P677 HydrophobicContact CG-CG 3.87Å; R557-V858 VanDerWaalsContact NH2-CG2 3.31Å
558	L	96.6	Very high	94.7	Very high	11 Å²	11	34 Å²	34	6%	0.058	18%	0.179	C	C	.	.	H	α-helix	trans	-60	-36.4	178.8	-70.1	164.6	0	0	0	112.9	I516 Q517 F520 A554 V555 H562	I516-L558 HydrophobicContact CB-CD1 4.08Å; I516-L558 HydrophobicContact CG2-CD1 3.54Å; Q517-L558 HydrophobicContact CB-CD1 4.31Å; Q517-L558 HydrophobicContact CB-CD2 3.98Å; Q517-L558 HydrophobicContact CG-CD2 3.84Å; F520-L558 HydrophobicContact CB-CB 4.28Å; F520-L558 HydrophobicContact CB-CD1 4.3Å; F520-L558 HydrophobicContact CD1-CB 3.91Å; F520-L558 HydrophobicContact CE1-CB 4.48Å; F520-L558 WeakPolarHBondContact CE1-O 3.27Å; F520-L558 HydrophobicContact CG-CB 3.99Å; A554-L558 PolarHBondContact O-N 3.35Å; V555-L558 PolarHBondContact O-N 2.76Å; L558-H562 WeakPolarHBondContact O-CB 3.3Å; L558-H562 PolarHBondContact O-N 2.82Å; L558-H562 VanDerWaalsContact O-N 3.1Å; L558-H562 PolarHBondContact O-ND1 2.97Å
559	F	97.4	Very high	94.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.4	-51	171.9	170.8	-95.4	0	0	0	112	F520 V555 L556 R557 L563 L571 M574 F576 I644 V876 F879 P880	F520-F559 HydrophobicContact CE2-CB 4.38Å; F520-F559 HydrophobicContact CZ-CB 3.9Å; F520-F559 HydrophobicContact CZ-CD2 4.26Å; V555-F559 WeakPolarHBondContact O-CB 3.2Å; V555-F559 PolarHBondContact O-N 2.78Å; L556-F559 PolarHBondContact O-N 2.78Å; R557-F559 VanDerWaalsContact C-N 3.28Å; R557-F559 PolarHBondContact O-N 2.86Å; F559-L563 HydrophobicContact CD2-CD1 3.61Å; F559-L563 HydrophobicContact CD2-CG 4.32Å; F559-L563 HydrophobicContact CE2-CD1 3.34Å; F559-L563 HydrophobicContact CE2-CG 4.44Å; F559-L563 HydrophobicContact CG-CD1 4.44Å; F559-L563 HydrophobicContact CZ-CD1 3.97Å; F559-L563 VanDerWaalsContact O-CB 3.3Å; F559-L563 WeakPolarHBondContact O-CB 3.39Å; F559-L563 WeakPolarHBondContact O-CG 3.39Å; F559-L563 PolarHBondContact O-N 3.01Å; F559-L571 HydrophobicContact CE1-CD2 4.3Å; F559-L571 HydrophobicContact CE2-CD2 4.43Å; F559-L571 HydrophobicContact CZ-CD2 3.7Å; F559-M574 HydrophobicContact CD2-SD 4.28Å; F559-F576 HydrophobicContact CB-CZ 4.39Å; F559-F576 AromaticContact CD2-CE2 3.45Å; F559-F576 HydrophobicContact CD2-CE2 3.45Å; F559-F576 VanDerWaalsContact CD2-CE2 3.45Å; F559-F576 AromaticContact CD2-CZ 3.6Å; F559-F576 HydrophobicContact CD2-CZ 3.6Å; F559-F576 AromaticContact CE2-CE2 3.62Å; F559-F576 HydrophobicContact CE2-CE2 3.62Å; F559-F576 HydrophobicContact CE2-CZ 4.21Å; F559-F576 HydrophobicContact CG-CE2 4.21Å; F559-F576 HydrophobicContact CG-CZ 4.26Å; F559-F576 HydrophobicContact CZ-CE2 4.48Å; F559-I644 HydrophobicContact CE1-CD1 4.28Å; F559-V876 HydrophobicContact CD1-CG1 4Å; F559-V876 HydrophobicContact CE1-CG1 3.46Å; F559-V876 VanDerWaalsContact CE1-CG1 3.46Å; F559-V876 HydrophobicContact CZ-CG1 4.24Å; F559-F879 HydrophobicContact CB-CE2 4.22Å; F559-F879 AromaticContact CD1-CD2 3.64Å; F559-F879 HydrophobicContact CD1-CD2 3.64Å; F559-F879 HydrophobicContact CD1-CE2 4.12Å; F559-F879 AromaticContact CE1-CD2 3.84Å; F559-F879 HydrophobicContact CE1-CD2 3.84Å; F559-F879 HydrophobicContact CG-CD2 4.04Å; F559-F879 HydrophobicContact CG-CE2 4.06Å; F559-F879 HydrophobicContact CZ-CD2 4.4Å; F559-P880 HydrophobicContact CE2-CG 4.27Å; F559-P880 VanDerWaalsContact CZ-CD 3.42Å; F559-P880 HydrophobicContact CZ-CG 4.13Å
560	V	96.4	Very high	94.5	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64	-45.9	178.6	170.8	0	0	0	0	111.7	L556 R557 S564 I644 P677 W872 V876	L556-V560 HydrophobicContact CD1-CG2 4.32Å; L556-V560 WeakPolarHBondContact O-CG2 3.42Å; L556-V560 PolarHBondContact O-N 3.47Å; R557-V560 PolarHBondContact O-N 3.19Å; R557-V560 VanDerWaalsContact O-N 3.11Å; V560-S564 VanDerWaalsContact O-CB 3.22Å; V560-S564 WeakPolarHBondContact O-CB 3.28Å; V560-S564 PolarHBondContact O-N 3.04Å; V560-S564 PolarHBondContact O-OG 2.83Å; V560-I644 HydrophobicContact CG2-CD1 3.76Å; V560-I644 HydrophobicContact CG2-CG2 4.48Å; V560-P677 HydrophobicContact CB-CB 4.34Å; V560-P677 HydrophobicContact CB-CG 4.03Å; V560-P677 HydrophobicContact CG1-CB 4.32Å; V560-P677 HydrophobicContact CG1-CG 4.18Å; V560-P677 HydrophobicContact CG2-CB 3.88Å; V560-P677 HydrophobicContact CG2-CG 4.03Å; V560-W872 HydrophobicContact CG1-CD2 4.19Å; V560-W872 VanDerWaalsContact CG1-CE2 3.42Å; V560-W872 HydrophobicContact CG1-CH2 4.49Å; V560-W872 HydrophobicContact CG1-CZ2 3.59Å; V560-W872 VanDerWaalsContact CG1-NE1 3.32Å; V560-V876 HydrophobicContact CG2-CG1 4.04Å
561	D	93.3	Very high	94.4	Very high	88 Å²	88	35.9 Å²	35.9	47%	0.471	19%	0.187	S	C	.	.	H	α-helix	trans	-63.4	-44.1	-176.7	-64.8	-20.8	0	0	0	111.4	R557	R557-D561 WeakPolarHBondContact O-CB 3.45Å; R557-D561 PolarHBondContact O-N 3.07Å
562	H	92.7	Very high	94.2	Very high	51 Å²	51	37.6 Å²	37.6	24%	0.236	21%	0.206	C	C	.	.	H	α-helix	trans	-79	-37.1	-179.7	-71.3	89.7	0	0	0	113.5	F520 N521 V524 L558	F520-H562 AromaticContact CD1-ND1 3.8Å; F520-H562 HydrophobicContact CE1-CB 4.13Å; N521-H562 PolarHBondContact ND2-NE2 2.87Å; N521-H562 PolarHBondContact OD1-CE1 3.11Å; N521-H562 PolarHBondContact OD1-NE2 3.37Å; V524-H562 HydrophobicContact CG2-CB 4.48Å; L558-H562 WeakPolarHBondContact O-CB 3.3Å; L558-H562 PolarHBondContact O-N 2.82Å; L558-H562 VanDerWaalsContact O-N 3.1Å; L558-H562 PolarHBondContact O-ND1 2.97Å
563	L	94.7	Very high	94.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-86.3	-18.6	-175.4	-58.4	-166	0	0	0	113.5	F559 H565 K566 W570 L571 H875 V876	F559-L563 HydrophobicContact CD2-CD1 3.61Å; F559-L563 HydrophobicContact CD2-CG 4.32Å; F559-L563 HydrophobicContact CE2-CD1 3.34Å; F559-L563 HydrophobicContact CE2-CG 4.44Å; F559-L563 HydrophobicContact CG-CD1 4.44Å; F559-L563 HydrophobicContact CZ-CD1 3.97Å; F559-L563 VanDerWaalsContact O-CB 3.3Å; F559-L563 WeakPolarHBondContact O-CB 3.39Å; F559-L563 WeakPolarHBondContact O-CG 3.39Å; F559-L563 PolarHBondContact O-N 3.01Å; L563-H565 PolarHBondContact O-N 2.77Å; L563-K566 HydrophobicContact CD2-CB 4.45Å; L563-K566 HydrophobicContact CD2-CG 3.95Å; L563-K566 PolarHBondContact O-N 2.79Å; L563-W570 HydrophobicContact CD1-CB 4.31Å; L563-W570 HydrophobicContact CD2-CB 4.05Å; L563-W570 HydrophobicContact CD2-CD2 4.31Å; L563-W570 HydrophobicContact CD2-CE3 3.74Å; L563-W570 HydrophobicContact CD2-CG 4.49Å; L563-L571 HydrophobicContact CB-CD2 4.45Å; L563-L571 HydrophobicContact CD1-CD2 4Å; L563-H875 PolarHBondContact O-CE1 3.17Å; L563-H875 PolarHBondContact O-NE2 3.02Å; L563-V876 HydrophobicContact CB-CG2 4.13Å
564	S	93.2	Very high	94.1	Very high	27 Å²	27	39.3 Å²	39.3	19%	0.189	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-17.7	174.2	-66.6	0	0	0	0	113.8	V560 S874	V560-S564 VanDerWaalsContact O-CB 3.22Å; V560-S564 WeakPolarHBondContact O-CB 3.28Å; V560-S564 PolarHBondContact O-N 3.04Å; V560-S564 PolarHBondContact O-OG 2.83Å; S564-S874 WeakPolarHBondContact OG-CB 3.27Å; S564-S874 PolarHBondContact OG-OG 3.39Å
565	H	90.1	Very high	94.1	Very high	168 Å²	168	40.9 Å²	40.9	78%	0.778	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.4	20.1	175.9	-55.3	-66.9	0	0	0	113.5	L563	L563-H565 PolarHBondContact O-N 2.77Å
566	K	92.7	Very high	94.1	Very high	58 Å²	58	40.9 Å²	40.9	25%	0.252	22%	0.217	S	C	.	.	S	Bend	trans	-114.6	175.7	175.4	-64.8	-60	-167.1	-178.9	0	111.2	L563 W570 H875	L563-K566 HydrophobicContact CD2-CB 4.45Å; L563-K566 HydrophobicContact CD2-CG 3.95Å; L563-K566 PolarHBondContact O-N 2.79Å; K566-W570 HydrophobicContact CB-CB 4.01Å; K566-W570 HydrophobicContact CB-CD2 4.07Å; K566-W570 HydrophobicContact CB-CG 3.64Å; K566-W570 HydrophobicContact CD-CD2 4.13Å; K566-W570 HydrophobicContact CD-CZ2 4.13Å; K566-W570 HydrophobicContact CG-CD2 3.9Å; K566-W570 HydrophobicContact CG-CE3 4.31Å; K566-W570 HydrophobicContact CG-CG 4.02Å; K566-H875 PolarHBondContact O-CE1 3.37Å
567	T	91.8	Very high	94.2	Very high	73 Å²	73	40.9 Å²	40.9	45%	0.448	22%	0.217	S	C	.	.			trans	-77.3	153.8	169.2	63.8	0	0	0	0	110.5	D569 W570	T567-D569 WeakPolarHBondContact CB-OD2 3.37Å; T567-D569 PolarHBondContact O-N 2.8Å; T567-D569 PolarHBondContact OG1-OD2 3.11Å; T567-W570 WeakPolarHBondContact O-CB 3.37Å; T567-W570 PolarHBondContact O-N 3.02Å; T567-W570 VanDerWaalsContact O-N 3.09Å
568	P	90.3	Very high	94.2	Very high	82 Å²	82	39.1 Å²	39.1	53%	0.532	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-56.6	-24.1	-177.9	-28	36.6	0	0	0	115.1	W570 L571	P568-W570 PolarHBondContact O-N 2.76Å; P568-L571 VanDerWaalsContact O-CB 3.27Å; P568-L571 WeakPolarHBondContact O-CB 3.4Å; P568-L571 VanDerWaalsContact O-CG 3.31Å; P568-L571 WeakPolarHBondContact O-CG 3.29Å; P568-L571 PolarHBondContact O-N 3.01Å
569	D	90.6	Very high	94.3	Very high	93 Å²	93	38.6 Å²	38.6	50%	0.497	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-58.6	-28.3	178.2	-35.4	-75.1	0	0	0	112.3	T567 L571 G572	T567-D569 WeakPolarHBondContact CB-OD2 3.37Å; T567-D569 PolarHBondContact O-N 2.8Å; T567-D569 PolarHBondContact OG1-OD2 3.11Å; D569-L571 PolarHBondContact O-N 3.14Å; D569-G572 WeakPolarHBondContact O-CA 3.22Å; D569-G572 PolarHBondContact O-N 2.84Å
570	W	93.6	Very high	94.2	Very high	23 Å²	23	38.7 Å²	38.7	9%	0.087	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-61.6	-25.2	176.2	-79.1	72.5	0	0	0	113.7	V524 I527 Q528 L563 K566 T567 P568 G572 Y573	V524-W570 HydrophobicContact CG1-CH2 4.45Å; V524-W570 HydrophobicContact CG1-CZ3 3.96Å; I527-W570 HydrophobicContact CB-CH2 4.31Å; I527-W570 HydrophobicContact CB-CZ3 4.08Å; I527-W570 HydrophobicContact CG2-CE3 4.35Å; I527-W570 HydrophobicContact CG2-CH2 4.01Å; I527-W570 HydrophobicContact CG2-CZ3 3.83Å; Q528-W570 HydrophobicContact CB-CH2 3.82Å; Q528-W570 HydrophobicContact CB-CZ2 4.32Å; Q528-W570 HydrophobicContact CG-CH2 4.36Å; Q528-W570 HydrophobicContact CG-CZ2 4.4Å; L563-W570 HydrophobicContact CD1-CB 4.31Å; L563-W570 HydrophobicContact CD2-CB 4.05Å; L563-W570 HydrophobicContact CD2-CD2 4.31Å; L563-W570 HydrophobicContact CD2-CE3 3.74Å; L563-W570 HydrophobicContact CD2-CG 4.49Å; K566-W570 HydrophobicContact CB-CB 4.01Å; K566-W570 HydrophobicContact CB-CD2 4.07Å; K566-W570 HydrophobicContact CB-CG 3.64Å; K566-W570 HydrophobicContact CD-CD2 4.13Å; K566-W570 HydrophobicContact CD-CZ2 4.13Å; K566-W570 HydrophobicContact CG-CD2 3.9Å; K566-W570 HydrophobicContact CG-CE3 4.31Å; K566-W570 HydrophobicContact CG-CG 4.02Å; T567-W570 WeakPolarHBondContact O-CB 3.37Å; T567-W570 PolarHBondContact O-N 3.02Å; T567-W570 VanDerWaalsContact O-N 3.09Å; P568-W570 PolarHBondContact O-N 2.76Å; W570-G572 PolarHBondContact O-N 2.93Å; W570-Y573 HydrophobicContact CB-CD2 4.36Å; W570-Y573 HydrophobicContact CD2-CD2 4.06Å; W570-Y573 HydrophobicContact CD2-CE2 4.32Å; W570-Y573 HydrophobicContact CE3-CD2 4.36Å; W570-Y573 HydrophobicContact CG-CD2 4.07Å; W570-Y573 HydrophobicContact CG-CE2 4.13Å; W570-Y573 PolarHBondContact O-N 2.86Å
571	L	91.8	Very high	94.2	Very high	32 Å²	32	39.1 Å²	39.1	17%	0.168	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-66.8	-19.4	172.2	-53.9	178.4	0	0	0	112	F559 L563 P568 D569 V876	F559-L571 HydrophobicContact CE1-CD2 4.3Å; F559-L571 HydrophobicContact CE2-CD2 4.43Å; F559-L571 HydrophobicContact CZ-CD2 3.7Å; L563-L571 HydrophobicContact CB-CD2 4.45Å; L563-L571 HydrophobicContact CD1-CD2 4Å; P568-L571 VanDerWaalsContact O-CB 3.27Å; P568-L571 WeakPolarHBondContact O-CB 3.4Å; P568-L571 VanDerWaalsContact O-CG 3.31Å; P568-L571 WeakPolarHBondContact O-CG 3.29Å; P568-L571 PolarHBondContact O-N 3.01Å; D569-L571 PolarHBondContact O-N 3.14Å; L571-V876 HydrophobicContact CD2-CB 4.44Å; L571-V876 HydrophobicContact CD2-CG1 3.86Å; L571-V876 HydrophobicContact CD2-CG2 4.25Å
572	G	92.7	Very high	94	Very high	41 Å²	41	35.6 Å²	35.6	42%	0.423	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-85.5	-20.1	173.6	0	0	0	0	0	114.4	P540 D569 W570 M574	P540-G572 WeakPolarHBondContact CB-O 3.46Å; P540-G572 WeakPolarHBondContact CG-O 3.33Å; D569-G572 WeakPolarHBondContact O-CA 3.22Å; D569-G572 PolarHBondContact O-N 2.84Å; W570-G572 PolarHBondContact O-N 2.93Å; G572-M574 VanDerWaalsContact C-N 3.33Å; G572-M574 PolarHBondContact O-N 2.66Å
573	Y	94.9	Very high	93.7	Very high	34 Å²	34	36.9 Å²	36.9	13%	0.133	21%	0.214	C	C	.	.	S	Bend	trans	-84.4	-2.3	-173.1	-54.6	-26.7	0	0	0	114.6	I527 P538 I541 W570	I527-Y573 HydrophobicContact CG2-CD2 3.81Å; I527-Y573 HydrophobicContact CG2-CG 4.28Å; P538-Y573 HydrophobicContact CB-CD1 3.8Å; P538-Y573 HydrophobicContact CB-CE1 4.35Å; P538-Y573 HydrophobicContact CB-CG 4.03Å; P538-Y573 HydrophobicContact CG-CD1 3.78Å; P538-Y573 HydrophobicContact CG-CD2 4.13Å; P538-Y573 HydrophobicContact CG-CE1 3.94Å; P538-Y573 HydrophobicContact CG-CE2 4.27Å; P538-Y573 HydrophobicContact CG-CG 3.91Å; I541-Y573 PolarHBondContact N-O 2.85Å; I541-Y573 VanDerWaalsContact N-O 3.1Å; W570-Y573 HydrophobicContact CB-CD2 4.36Å; W570-Y573 HydrophobicContact CD2-CD2 4.06Å; W570-Y573 HydrophobicContact CD2-CE2 4.32Å; W570-Y573 HydrophobicContact CE3-CD2 4.36Å; W570-Y573 HydrophobicContact CG-CD2 4.07Å; W570-Y573 HydrophobicContact CG-CE2 4.13Å; W570-Y573 PolarHBondContact O-N 2.86Å
574	M	95.6	Very high	93.4	Very high	3 Å²	3	37.3 Å²	37.3	2%	0.015	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	141.8	179.6	-62.5	-177.3	176.3	0	0	111	F520 I523 V524 I527 I543 F559 G572 F576 P880	F520-M574 HydrophobicContact CE2-CE 4.29Å; F520-M574 HydrophobicContact CE2-SD 4Å; F520-M574 HydrophobicContact CZ-CE 3.91Å; F520-M574 HydrophobicContact CZ-SD 3.76Å; I523-M574 HydrophobicContact CG2-CE 4.25Å; V524-M574 HydrophobicContact CG2-CE 3.71Å; I527-M574 HydrophobicContact CD1-CE 3.6Å; I527-M574 HydrophobicContact CD1-CG 4.1Å; I543-M574 HydrophobicContact CD1-CB 4.25Å; I543-M574 HydrophobicContact CD1-CE 4.3Å; I543-M574 HydrophobicContact CD1-CG 3.93Å; I543-M574 HydrophobicContact CD1-SD 3.79Å; F559-M574 HydrophobicContact CD2-SD 4.28Å; G572-M574 VanDerWaalsContact C-N 3.33Å; G572-M574 PolarHBondContact O-N 2.66Å; M574-F576 HydrophobicContact CB-CE2 3.91Å; M574-F576 HydrophobicContact CB-CZ 4.17Å; M574-F576 HydrophobicContact SD-CE2 4.35Å; M574-F576 HydrophobicContact SD-CZ 3.84Å; M574-P880 VanDerWaalsContact O-CG 3.28Å; M574-P880 WeakPolarHBondContact O-CG 3.45Å
575	R	96.3	Very high	93.4	Very high	38 Å²	38	37.7 Å²	37.7	14%	0.143	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	119.3	171.2	-177.9	-170.6	-75.1	97.4	-8.6	109	P540 I541 K542 I543 A636 N637 G638 G882	P540-R575 PolarHBondContact O-NH1 3.19Å; I541-R575 PolarHBondContact O-N 3.02Å; K542-R575 CarbonylContact C-O 3.57Å; K542-R575 VanDerWaalsContact CA-O 3.32Å; K542-R575 WeakPolarHBondContact CA-O 3.4Å; I543-R575 PolarHBondContact N-O 2.97Å; R575-A636 VanDerWaalsContact CD-O 3.27Å; R575-A636 WeakPolarHBondContact CD-O 3.35Å; R575-N637 PolarHBondContact NE-O 2.74Å; R575-N637 PolarHBondContact NH2-O 2.78Å; R575-G638 PolarHBondContact NE-O 2.97Å; R575-G882 VanDerWaalsContact CG-CA 3.46Å
576	F	98.3	Very high	93.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	127.7	-174.4	-66.4	-85.9	0	0	0	112.4	F520 I543 V545 V555 F559 M574 F879 P880 V881 G882	F520-F576 HydrophobicContact CE2-CE1 4.14Å; F520-F576 AromaticContact CE2-CZ 3.96Å; F520-F576 HydrophobicContact CE2-CZ 3.96Å; F520-F576 HydrophobicContact CZ-CZ 4.46Å; I543-F576 HydrophobicContact CB-CD1 3.94Å; I543-F576 HydrophobicContact CB-CE1 3.99Å; I543-F576 HydrophobicContact CD1-CE1 3.96Å; I543-F576 HydrophobicContact CD1-CZ 4.18Å; I543-F576 HydrophobicContact CG2-CD1 4.08Å; I543-F576 HydrophobicContact CG2-CE1 3.99Å; I543-F576 CarbonylContact O-C 3.55Å; I543-F576 VanDerWaalsContact O-CA 3.27Å; I543-F576 WeakPolarHBondContact O-CA 3.46Å; V545-F576 HydrophobicContact CG2-CD1 4.04Å; V555-F576 HydrophobicContact CG1-CD1 4.13Å; V555-F576 HydrophobicContact CG1-CE1 3.73Å; F559-F576 HydrophobicContact CB-CZ 4.39Å; F559-F576 AromaticContact CD2-CE2 3.45Å; F559-F576 HydrophobicContact CD2-CE2 3.45Å; F559-F576 VanDerWaalsContact CD2-CE2 3.45Å; F559-F576 AromaticContact CD2-CZ 3.6Å; F559-F576 HydrophobicContact CD2-CZ 3.6Å; F559-F576 AromaticContact CE2-CE2 3.62Å; F559-F576 HydrophobicContact CE2-CE2 3.62Å; F559-F576 HydrophobicContact CE2-CZ 4.21Å; F559-F576 HydrophobicContact CG-CE2 4.21Å; F559-F576 HydrophobicContact CG-CZ 4.26Å; F559-F576 HydrophobicContact CZ-CE2 4.48Å; M574-F576 HydrophobicContact CB-CE2 3.91Å; M574-F576 HydrophobicContact CB-CZ 4.17Å; M574-F576 HydrophobicContact SD-CE2 4.35Å; M574-F576 HydrophobicContact SD-CZ 3.84Å; F576-F879 HydrophobicContact CB-CE1 3.72Å; F576-F879 HydrophobicContact CB-CE2 4.49Å; F576-F879 HydrophobicContact CB-CZ 3.63Å; F576-F879 HydrophobicContact CD1-CE2 4.16Å; F576-F879 AromaticContact CD1-CZ 3.71Å; F576-F879 HydrophobicContact CD1-CZ 3.71Å; F576-F879 HydrophobicContact CD2-CD2 4.11Å; F576-F879 HydrophobicContact CD2-CE1 4.11Å; F576-F879 AromaticContact CD2-CE2 3.48Å; F576-F879 HydrophobicContact CD2-CE2 3.48Å; F576-F879 VanDerWaalsContact CD2-CE2 3.48Å; F576-F879 AromaticContact CD2-CZ 3.49Å; F576-F879 HydrophobicContact CD2-CZ 3.49Å; F576-F879 VanDerWaalsContact CD2-CZ 3.49Å; F576-F879 HydrophobicContact CE1-CE2 4.27Å; F576-F879 HydrophobicContact CE1-CZ 4.24Å; F576-F879 HydrophobicContact CE2-CD2 4.26Å; F576-F879 AromaticContact CE2-CE2 3.63Å; F576-F879 HydrophobicContact CE2-CE2 3.63Å; F576-F879 HydrophobicContact CE2-CZ 4.07Å; F576-F879 AromaticContact CG-CE1 3.9Å; F576-F879 HydrophobicContact CG-CE1 3.9Å; F576-F879 AromaticContact CG-CE2 3.77Å; F576-F879 HydrophobicContact CG-CE2 3.77Å; F576-F879 AromaticContact CG-CZ 3.29Å; F576-F879 HydrophobicContact CG-CZ 3.29Å; F576-F879 HydrophobicContact CZ-CE2 4.03Å; F576-F879 HydrophobicContact CZ-CZ 4.41Å; F576-P880 HydrophobicContact CD2-CG 4.11Å; F576-P880 HydrophobicContact CE2-CG 4.27Å; F576-P880 PolarHBondContact N-O 3.03Å; F576-V881 CarbonylContact O-C 3.57Å; F576-V881 WeakPolarHBondContact O-CA 3.45Å; F576-G882 PolarHBondContact O-N 3.16Å
577	L	98.3	Very high	93.7	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	114.4	179.2	-60.4	-178.2	0	0	0	110	K542 I543 A544 V545 I579 Y632 M633 A636	K542-L577 HydrophobicContact CB-CD1 3.94Å; K542-L577 HydrophobicContact CB-CG 4.46Å; K542-L577 HydrophobicContact CD-CD1 4.31Å; K542-L577 HydrophobicContact CG-CD1 4.36Å; I543-L577 PolarHBondContact O-N 2.89Å; A544-L577 CarbonylContact C-O 3.58Å; A544-L577 VanDerWaalsContact CA-O 3.29Å; A544-L577 WeakPolarHBondContact CA-O 3.39Å; A544-L577 HydrophobicContact CB-CB 4Å; V545-L577 PolarHBondContact N-O 2.83Å; L577-I579 PolarHBondContact O-N 2.85Å; L577-Y632 HydrophobicContact CB-CD1 4.19Å; L577-Y632 HydrophobicContact CB-CE1 3.59Å; L577-Y632 HydrophobicContact CD2-CE1 4.25Å; L577-Y632 HydrophobicContact CD2-CE2 3.89Å; L577-Y632 HydrophobicContact CG-CE1 4.41Å; L577-M633 HydrophobicContact CD1-CE 3.87Å; L577-M633 HydrophobicContact CD1-SD 3.72Å; L577-A636 HydrophobicContact CD1-CB 4.47Å; L577-A636 HydrophobicContact CD2-CB 3.46Å; L577-A636 VanDerWaalsContact CD2-CB 3.46Å
578	I	98	Very high	93.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	110.3	-171.4	-64.8	171.1	0	0	0	109.7	L552 H584 V586 L590 Y597 Y632 V881	L552-I578 HydrophobicContact CD1-CD1 4.19Å; L552-I578 HydrophobicContact CD1-CG1 4.02Å; L552-I578 HydrophobicContact CD2-CD1 3.49Å; L552-I578 VanDerWaalsContact CD2-CD1 3.49Å; L552-I578 HydrophobicContact CD2-CG1 4.01Å; L552-I578 HydrophobicContact CD2-CG2 4.44Å; I578-H584 WeakPolarHBondContact CG2-NE2 3.36Å; I578-V586 HydrophobicContact CD1-CG1 3.67Å; I578-L590 HydrophobicContact CB-CD1 4.11Å; I578-L590 HydrophobicContact CD1-CD1 4.14Å; I578-Y597 VanDerWaalsContact O-CE2 3.29Å; I578-Y597 WeakPolarHBondContact O-CE2 3.48Å; I578-Y597 PolarHBondContact O-OH 3.03Å; I578-Y632 PolarHBondContact N-OH 3.39Å; I578-V881 HydrophobicContact CD1-CG1 4.06Å; I578-V881 HydrophobicContact CD1-CG2 3.87Å; I578-V881 HydrophobicContact CG1-CG1 4.43Å
579	I	97.8	Very high	94	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	109.3	177	-61.2	167.5	0	0	0	107.9	L496 A544 V545 A546 G547 L577 L581 F601 W606 V629 Y632	L496-I579 HydrophobicContact CD2-CG2 4.2Å; A544-I579 HydrophobicContact CB-CD1 3.94Å; V545-I579 PolarHBondContact O-N 2.8Å; A546-I579 WeakPolarHBondContact CA-O 3.48Å; A546-I579 HydrophobicContact CB-CB 3.95Å; A546-I579 HydrophobicContact CB-CD1 4.42Å; A546-I579 HydrophobicContact CB-CG2 4.14Å; G547-I579 PolarHBondContact N-O 2.94Å; L577-I579 PolarHBondContact O-N 2.85Å; I579-L581 PolarHBondContact O-N 3.13Å; I579-F601 HydrophobicContact CG1-CZ 4.5Å; I579-F601 HydrophobicContact CG2-CE1 4.34Å; I579-W606 HydrophobicContact CG2-CH2 4.04Å; I579-W606 HydrophobicContact CG2-CZ2 3.74Å; I579-V629 HydrophobicContact CD1-CG1 3.96Å; I579-V629 HydrophobicContact CD1-CG2 4.12Å; I579-V629 HydrophobicContact CG2-CG2 4.45Å; I579-Y632 HydrophobicContact CG1-CD1 4.15Å; I579-Y632 HydrophobicContact CG1-CE1 4.34Å
580	P	96.2	Very high	94.2	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.006	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	112.4	-166.2	32.5	-35.5	0	0	0	112.4	H584 S587 F601 W606	P580-H584 HydrophobicContact CB-CB 3.79Å; P580-S587 WeakPolarHBondContact CB-OG 3.28Å; P580-S587 VanDerWaalsContact CG-OG 3.31Å; P580-S587 WeakPolarHBondContact CG-OG 3.43Å; P580-F601 HydrophobicContact CG-CB 3.73Å; P580-F601 HydrophobicContact CG-CG 4.25Å; P580-W606 PolarHBondContact O-NE1 3.25Å
581	L	94.6	Very high	94.3	Very high	10 Å²	10	22.3 Å²	22.3	5%	0.052	13%	0.132	C	C	.	.	S	Bend	trans	-99.2	105.5	166.3	-52.7	-176.7	0	0	0	108.2	Q492 L496 G547 A548 I579 W606 F610	Q492-L581 HydrophobicContact CB-CB 4.23Å; Q492-L581 HydrophobicContact CB-CD1 4.21Å; L496-L581 HydrophobicContact CD2-CD1 4.29Å; L496-L581 HydrophobicContact CD2-CD2 4.02Å; L496-L581 HydrophobicContact CG-CD2 4.48Å; G547-L581 CarbonylContact C-O 3.6Å; G547-L581 PolarHBondContact O-N 3.31Å; A548-L581 WeakPolarHBondContact CA-O 3.15Å; A548-L581 WeakPolarHBondContact CB-O 3.48Å; A548-L581 PolarHBondContact N-O 3.29Å; I579-L581 PolarHBondContact O-N 3.13Å; L581-W606 HydrophobicContact CD2-CZ2 4.46Å; L581-F610 HydrophobicContact CD2-CB 4.45Å; L581-F610 HydrophobicContact CD2-CD1 3.65Å; L581-F610 HydrophobicContact CD2-CD2 4.4Å; L581-F610 HydrophobicContact CD2-CE1 3.83Å; L581-F610 HydrophobicContact CD2-CG 3.94Å; L581-F610 HydrophobicContact CD2-CZ 4.28Å
582	G	89.6	Confident	94.3	Very high	13 Å²	13	24.9 Å²	24.9	13%	0.134	15%	0.149	C	C	.	.	S	Bend	trans	82.6	-172.7	-173.4	0	0	0	0	0	114.9	H584 F610 H611	G582-H584 PolarHBondContact O-N 3.05Å; G582-H584 VanDerWaalsContact O-N 3.08Å; G582-F610 VanDerWaalsContact CA-O 3.26Å; G582-F610 WeakPolarHBondContact CA-O 3.38Å; G582-F610 PolarHBondContact N-O 2.78Å; G582-H611 PolarHBondContact O-CE1 2.86Å
583	A	85.9	Confident	94.3	Very high	78 Å²	78	24.6 Å²	24.6	65%	0.645	14%	0.138	S	C	*	.			trans	-66.3	107	-172.3	0	0	0	0	0	112.3
584	H	89.9	Confident	94.2	Very high	10 Å²	10	23.2 Å²	23.2	5%	0.046	13%	0.133	C	C	.	.			trans	-124.4	97.2	-168.9	-164.2	-27	0	0	0	112	Q549 L552 I578 P580 G582 V586 S587 K588	Q549-H584 VanDerWaalsContact CD-CE1 3.46Å; Q549-H584 PolarHBondContact OE1-CE1 2.86Å; Q549-H584 PolarHBondContact OE1-ND1 3Å; L552-H584 VanDerWaalsContact CD2-CE1 3.48Å; L552-H584 WeakPolarHBondContact CD2-CE1 3.44Å; I578-H584 WeakPolarHBondContact CG2-NE2 3.36Å; P580-H584 HydrophobicContact CB-CB 3.79Å; G582-H584 PolarHBondContact O-N 3.05Å; G582-H584 VanDerWaalsContact O-N 3.08Å; H584-V586 PolarHBondContact O-N 3.05Å; H584-S587 WeakPolarHBondContact O-CB 3.33Å; H584-S587 PolarHBondContact O-N 2.92Å; H584-K588 PolarHBondContact O-N 2.87Å
585	P	91.9	Very high	94.1	Very high	34 Å²	34	29.5 Å²	29.5	22%	0.221	16%	0.162	C	C	.	.	H	α-helix	trans	-55.2	-42.3	-177.3	-30.5	35.2	0	0	0	115.9	S587 K588 Y589 M681 L789	P585-S587 VanDerWaalsContact C-N 3.34Å; P585-S587 PolarHBondContact O-N 2.94Å; P585-K588 PolarHBondContact O-N 2.81Å; P585-Y589 PolarHBondContact O-N 2.64Å; P585-Y589 VanDerWaalsContact O-N 3.11Å; P585-M681 HydrophobicContact CB-CE 3.59Å; P585-M681 HydrophobicContact CG-CE 3.47Å; P585-M681 VanDerWaalsContact CG-CE 3.47Å; P585-M681 HydrophobicContact CG-SD 3.93Å; P585-L789 HydrophobicContact CB-CD1 4.39Å
586	V	95	Very high	94.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.5	-44	175.2	179.3	0	0	0	0	110.9	Q549 L552 I578 H584 K588 Y589 L590 L642 I679 L789	Q549-V586 VanDerWaalsContact OE1-N 3.17Å; L552-V586 HydrophobicContact CD2-CB 4.4Å; L552-V586 HydrophobicContact CD2-CG1 4.45Å; L552-V586 HydrophobicContact CD2-CG2 4.35Å; I578-V586 HydrophobicContact CD1-CG1 3.67Å; H584-V586 PolarHBondContact O-N 3.05Å; V586-K588 PolarHBondContact O-N 2.88Å; V586-Y589 WeakPolarHBondContact O-CB 3.03Å; V586-Y589 PolarHBondContact O-N 2.98Å; V586-Y589 VanDerWaalsContact O-N 3.12Å; V586-L590 WeakPolarHBondContact O-CG 3.49Å; V586-L590 PolarHBondContact O-N 3.5Å; V586-L642 HydrophobicContact CG1-CD1 3.46Å; V586-L642 VanDerWaalsContact CG1-CD1 3.46Å; V586-I679 HydrophobicContact CG2-CD1 4.21Å; V586-I679 HydrophobicContact CG2-CG1 3.96Å; V586-L789 HydrophobicContact CB-CD2 4.45Å; V586-L789 HydrophobicContact CG1-CD2 4.41Å; V586-L789 HydrophobicContact CG2-CD2 4.15Å
587	S	95.1	Very high	94	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.3	-39.9	176.7	-178.8	0	0	0	0	112.6	P580 H584 P585 Y589 L590 G591 Y597 Q602	P580-S587 WeakPolarHBondContact CB-OG 3.28Å; P580-S587 VanDerWaalsContact CG-OG 3.31Å; P580-S587 WeakPolarHBondContact CG-OG 3.43Å; H584-S587 WeakPolarHBondContact O-CB 3.33Å; H584-S587 PolarHBondContact O-N 2.92Å; P585-S587 VanDerWaalsContact C-N 3.34Å; P585-S587 PolarHBondContact O-N 2.94Å; S587-Y589 VanDerWaalsContact C-N 3.29Å; S587-Y589 PolarHBondContact O-N 3.08Å; S587-L590 PolarHBondContact O-N 2.87Å; S587-G591 PolarHBondContact O-N 2.81Å; S587-Y597 WeakPolarHBondContact CB-OH 3.28Å; S587-Y597 WeakPolarHBondContact O-CE1 3.49Å; S587-Y597 WeakPolarHBondContact OG-CE1 3.24Å; S587-Y597 PolarHBondContact OG-OH 2.75Å; S587-Q602 PolarHBondContact OG-NE2 2.83Å; S587-Q602 VanDerWaalsContact OG-NE2 3.12Å
588	K	94.1	Very high	93.8	Very high	147 Å²	147	34.8 Å²	34.8	64%	0.639	19%	0.187	S	C	*	.	H	α-helix	trans	-59.3	-40.6	172.5	-174	176	179.9	178.8	0	111.8	H584 P585 V586 G591 T592	H584-K588 PolarHBondContact O-N 2.87Å; P585-K588 PolarHBondContact O-N 2.81Å; V586-K588 PolarHBondContact O-N 2.88Å; K588-G591 PolarHBondContact O-N 2.86Å; K588-T592 PolarHBondContact O-N 3.14Å
589	Y	94.5	Very high	93.7	Very high	21 Å²	21	38.1 Å²	38.1	8%	0.082	21%	0.21	C	C	.	.	H	α-helix	trans	-66.9	-42	174.6	165.7	-93.6	0	0	0	112.7	P585 V586 S587 G591 T592 I593 H640 L642 L789 P790	P585-Y589 PolarHBondContact O-N 2.64Å; P585-Y589 VanDerWaalsContact O-N 3.11Å; V586-Y589 WeakPolarHBondContact O-CB 3.03Å; V586-Y589 PolarHBondContact O-N 2.98Å; V586-Y589 VanDerWaalsContact O-N 3.12Å; S587-Y589 VanDerWaalsContact C-N 3.29Å; S587-Y589 PolarHBondContact O-N 3.08Å; Y589-G591 PolarHBondContact O-N 2.83Å; Y589-T592 WeakPolarHBondContact O-CA 3.46Å; Y589-T592 PolarHBondContact O-N 3.15Å; Y589-T592 PolarHBondContact O-OG1 3.41Å; Y589-I593 HydrophobicContact CE1-CD1 3.78Å; Y589-I593 HydrophobicContact CE1-CG1 4.41Å; Y589-I593 HydrophobicContact CE2-CG2 4.13Å; Y589-I593 PolarHBondContact O-N 3.12Å; Y589-H640 AromaticContact CE1-NE2 3.56Å; Y589-H640 AromaticContact CZ-NE2 3.82Å; Y589-H640 PolarHBondContact OH-CE1 3.27Å; Y589-H640 PolarHBondContact OH-NE2 3.09Å; Y589-H640 VanDerWaalsContact OH-NE2 3.17Å; Y589-L642 HydrophobicContact CD1-CD2 4.03Å; Y589-L642 HydrophobicContact CE1-CD2 3.63Å; Y589-L789 HydrophobicContact CD1-CD2 3.88Å; Y589-L789 HydrophobicContact CD2-CB 4.23Å; Y589-L789 HydrophobicContact CG-CB 4.23Å; Y589-L789 HydrophobicContact CG-CD2 3.93Å; Y589-L789 HydrophobicContact CG-CG 4.46Å; Y589-P790 WeakPolarHBondContact CD2-O 3.46Å; Y589-P790 HydrophobicContact CE2-CB 4.14Å; Y589-P790 HydrophobicContact CE2-CG 4.4Å; Y589-P790 WeakPolarHBondContact CE2-O 3.3Å
590	L	94.7	Very high	93.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-55.9	-41.8	172.8	-66.2	179.7	0	0	0	111	I578 V586 S587 T592 I593 D594 Y597 V881 I883	I578-L590 HydrophobicContact CB-CD1 4.11Å; I578-L590 HydrophobicContact CD1-CD1 4.14Å; V586-L590 WeakPolarHBondContact O-CG 3.49Å; V586-L590 PolarHBondContact O-N 3.5Å; S587-L590 PolarHBondContact O-N 2.87Å; L590-T592 PolarHBondContact O-N 3.13Å; L590-T592 VanDerWaalsContact O-N 3.13Å; L590-I593 HydrophobicContact CD2-CD1 4.19Å; L590-I593 WeakPolarHBondContact O-CG1 3.48Å; L590-I593 PolarHBondContact O-N 3.48Å; L590-D594 PolarHBondContact O-N 2.8Å; L590-Y597 HydrophobicContact CB-CD1 3.53Å; L590-Y597 HydrophobicContact CB-CE1 3.5Å; L590-Y597 VanDerWaalsContact CB-CE1 3.5Å; L590-Y597 HydrophobicContact CB-CG 4.12Å; L590-Y597 HydrophobicContact CD1-CD2 4.46Å; L590-Y597 HydrophobicContact CD1-CE1 4.01Å; L590-Y597 HydrophobicContact CD1-CE2 3.91Å; L590-Y597 HydrophobicContact CG-CE1 4.4Å; L590-V881 HydrophobicContact CD1-CG1 3.9Å; L590-V881 HydrophobicContact CD2-CG1 3.93Å; L590-I883 HydrophobicContact CD2-CG2 4.34Å
591	G	94.2	Very high	93.6	Very high	7 Å²	7	38.5 Å²	38.5	7%	0.072	21%	0.212	C	C	.	.	H	α-helix	trans	-61.8	-14.4	172.7	0	0	0	0	0	115.5	S587 K588 Y589 N598	S587-G591 PolarHBondContact O-N 2.81Å; K588-G591 PolarHBondContact O-N 2.86Å; Y589-G591 PolarHBondContact O-N 2.83Å; G591-N598 PolarHBondContact O-ND2 3.39Å
592	T	93.1	Very high	93.6	Very high	85 Å²	85	39.7 Å²	39.7	52%	0.521	22%	0.217	S	C	.	.	H	α-helix	trans	-92.4	-14.3	172.2	65.4	0	0	0	0	114.3	K588 Y589 L590	K588-T592 PolarHBondContact O-N 3.14Å; Y589-T592 WeakPolarHBondContact O-CA 3.46Å; Y589-T592 PolarHBondContact O-N 3.15Å; Y589-T592 PolarHBondContact O-OG1 3.41Å; L590-T592 PolarHBondContact O-N 3.13Å; L590-T592 VanDerWaalsContact O-N 3.13Å
593	I	91.9	Very high	93.7	Very high	35 Å²	35	41 Å²	41	18%	0.179	22%	0.221	C	C	.	.	H	α-helix	trans	-113.6	-15	-179.8	63	165.3	0	0	0	113.5	Y589 L590 H640	Y589-I593 HydrophobicContact CE1-CD1 3.78Å; Y589-I593 HydrophobicContact CE1-CG1 4.41Å; Y589-I593 HydrophobicContact CE2-CG2 4.13Å; Y589-I593 PolarHBondContact O-N 3.12Å; L590-I593 HydrophobicContact CD2-CD1 4.19Å; L590-I593 WeakPolarHBondContact O-CG1 3.48Å; L590-I593 PolarHBondContact O-N 3.48Å; I593-H640 HydrophobicContact CD1-CB 4.38Å
594	D	93.5	Very high	94	Very high	6 Å²	6	39.9 Å²	39.9	3%	0.032	21%	0.212	C	C	.	.			trans	-136.8	107.5	-179.2	-176.3	-22.8	0	0	0	110	L590 R596 Y597 N598 I883 F884	L590-D594 PolarHBondContact O-N 2.8Å; D594-R596 VanDerWaalsContact C-N 3.33Å; D594-R596 PolarHBondContact O-N 3.35Å; D594-R596 WeakPolarHBondContact OD1-CB 3.47Å; D594-R596 PolarHBondContact OD1-N 2.92Å; D594-Y597 PolarHBondContact O-N 2.92Å; D594-Y597 PolarHBondContact OD1-N 2.8Å; D594-N598 PolarHBondContact O-N 2.76Å; D594-I883 WeakPolarHBondContact OD2-CB 3.36Å; D594-F884 WeakPolarHBondContact OD2-CB 3.5Å; D594-F884 WeakPolarHBondContact OD2-CD2 3.47Å; D594-F884 PolarHBondContact OD2-N 2.63Å
595	H	93.3	Very high	94	Very high	134 Å²	134	41.2 Å²	41.2	62%	0.62	22%	0.224	S	C	*	.	H	α-helix	trans	-69.4	-29	-178.6	72.7	-94.7	0	0	0	112.9	N598 S599	H595-N598 WeakPolarHBondContact O-CB 3.26Å; H595-N598 PolarHBondContact O-N 2.8Å; H595-S599 PolarHBondContact O-N 2.88Å
596	R	95.8	Very high	94.1	Very high	81 Å²	81	39.6 Å²	39.6	31%	0.306	21%	0.214	S	C	.	.	H	α-helix	trans	-71.4	-47.2	177	-66.3	-161.6	-82.2	172.2	-2.4	108.7	D594 N598 S599 L600 F884	D594-R596 VanDerWaalsContact C-N 3.33Å; D594-R596 PolarHBondContact O-N 3.35Å; D594-R596 WeakPolarHBondContact OD1-CB 3.47Å; D594-R596 PolarHBondContact OD1-N 2.92Å; R596-N598 VanDerWaalsContact C-N 3.29Å; R596-N598 PolarHBondContact O-N 3.35Å; R596-S599 PolarHBondContact O-N 3.1Å; R596-S599 VanDerWaalsContact O-N 3.17Å; R596-S599 PolarHBondContact O-OG 2.91Å; R596-L600 WeakPolarHBondContact O-CG 3.2Å; R596-L600 PolarHBondContact O-N 3.41Å; R596-F884 HydrophobicContact CB-CB 4.05Å; R596-F884 HydrophobicContact CB-CD1 4.21Å; R596-F884 HydrophobicContact CB-CD2 3.45Å; R596-F884 VanDerWaalsContact CB-CD2 3.45Å; R596-F884 HydrophobicContact CB-CE2 3.84Å; R596-F884 HydrophobicContact CB-CG 3.65Å; R596-F884 HydrophobicContact CB-CZ 4.36Å; R596-F884 HydrophobicContact CG-CG 4.45Å; R596-F884 PolarHBondContact NH2-O 2.87Å
597	Y	96.4	Very high	93.9	Very high	1 Å²	1	44.1 Å²	44.1	0%	0.004	23%	0.231	C	C	.	.	H	α-helix	trans	-56.1	-42.2	171.9	-174.6	-86.6	0	0	0	112.5	I578 S587 L590 D594 L600 F601 Y632	I578-Y597 VanDerWaalsContact O-CE2 3.29Å; I578-Y597 WeakPolarHBondContact O-CE2 3.48Å; I578-Y597 PolarHBondContact O-OH 3.03Å; S587-Y597 WeakPolarHBondContact CB-OH 3.28Å; S587-Y597 WeakPolarHBondContact O-CE1 3.49Å; S587-Y597 WeakPolarHBondContact OG-CE1 3.24Å; S587-Y597 PolarHBondContact OG-OH 2.75Å; L590-Y597 HydrophobicContact CB-CD1 3.53Å; L590-Y597 HydrophobicContact CB-CE1 3.5Å; L590-Y597 VanDerWaalsContact CB-CE1 3.5Å; L590-Y597 HydrophobicContact CB-CG 4.12Å; L590-Y597 HydrophobicContact CD1-CD2 4.46Å; L590-Y597 HydrophobicContact CD1-CE1 4.01Å; L590-Y597 HydrophobicContact CD1-CE2 3.91Å; L590-Y597 HydrophobicContact CG-CE1 4.4Å; D594-Y597 PolarHBondContact O-N 2.92Å; D594-Y597 PolarHBondContact OD1-N 2.8Å; Y597-L600 PolarHBondContact O-N 3Å; Y597-F601 HydrophobicContact CD1-CD2 4.4Å; Y597-F601 AromaticContact CD2-CD2 3.69Å; Y597-F601 HydrophobicContact CD2-CD2 3.69Å; Y597-F601 AromaticContact CD2-CE2 3.92Å; Y597-F601 HydrophobicContact CD2-CE2 3.92Å; Y597-F601 HydrophobicContact CE1-CB 4.42Å; Y597-F601 HydrophobicContact CE1-CD2 4.19Å; Y597-F601 AromaticContact CE2-CD2 3.46Å; Y597-F601 HydrophobicContact CE2-CD2 3.46Å; Y597-F601 VanDerWaalsContact CE2-CD2 3.46Å; Y597-F601 AromaticContact CE2-CE2 3.77Å; Y597-F601 HydrophobicContact CE2-CE2 3.77Å; Y597-F601 HydrophobicContact CG-CD2 4.15Å; Y597-F601 AromaticContact CZ-CD2 3.73Å; Y597-F601 PolarHBondContact O-N 3.09Å; Y597-Y632 HydrophobicContact CD2-CD2 4.25Å; Y597-Y632 HydrophobicContact CD2-CE1 4.15Å; Y597-Y632 AromaticContact CD2-CE2 3.66Å; Y597-Y632 HydrophobicContact CD2-CE2 3.66Å; Y597-Y632 AromaticContact CD2-CZ 3.62Å; Y597-Y632 AromaticContact CE2-CE1 3.75Å; Y597-Y632 HydrophobicContact CE2-CE1 3.75Å; Y597-Y632 HydrophobicContact CE2-CE2 4.08Å; Y597-Y632 AromaticContact CE2-CZ 3.53Å
598	N	95.4	Very high	93.6	Very high	68 Å²	68	48.5 Å²	48.5	36%	0.364	25%	0.254	S	S	.	.	H	α-helix	trans	-55.5	-53.1	174.7	-169.7	-57.9	0	0	0	111.5	G591 D594 H595 R596 L600 F601 Q602	G591-N598 PolarHBondContact O-ND2 3.39Å; D594-N598 PolarHBondContact O-N 2.76Å; H595-N598 WeakPolarHBondContact O-CB 3.26Å; H595-N598 PolarHBondContact O-N 2.8Å; R596-N598 VanDerWaalsContact C-N 3.29Å; R596-N598 PolarHBondContact O-N 3.35Å; N598-L600 PolarHBondContact O-N 2.64Å; N598-F601 PolarHBondContact O-N 2.72Å; N598-Q602 WeakPolarHBondContact O-CB 3.41Å; N598-Q602 PolarHBondContact O-N 3.42Å
599	S	95	Very high	93.4	Very high	69 Å²	69	42.3 Å²	42.3	48%	0.483	23%	0.228	S	C	.	.	H	α-helix	trans	-60.6	-27.9	-177.9	63.3	0	0	0	0	114.8	H595 R596	H595-S599 PolarHBondContact O-N 2.88Å; R596-S599 PolarHBondContact O-N 3.1Å; R596-S599 VanDerWaalsContact O-N 3.17Å; R596-S599 PolarHBondContact O-OG 2.91Å
600	L	95.6	Very high	93.3	Very high	10 Å²	10	41.3 Å²	41.3	5%	0.052	22%	0.224	C	C	.	.	H	α-helix	trans	-84.5	-31.9	-179	-59.4	178.8	0	0	0	113.2	R596 Y597 N598 R628 Q631 F884	R596-L600 WeakPolarHBondContact O-CG 3.2Å; R596-L600 PolarHBondContact O-N 3.41Å; Y597-L600 PolarHBondContact O-N 3Å; N598-L600 PolarHBondContact O-N 2.64Å; L600-R628 HydrophobicContact CB-CB 4.46Å; L600-R628 HydrophobicContact CB-CG 4.48Å; L600-R628 HydrophobicContact CD2-CB 4.28Å; L600-R628 HydrophobicContact CD2-CG 3.89Å; L600-R628 WeakPolarHBondContact O-CD 3.5Å; L600-R628 PolarHBondContact O-NH1 2.81Å; L600-Q631 VanDerWaalsContact CD2-OE1 3.29Å; L600-F884 HydrophobicContact CD1-CE2 3.74Å; L600-F884 HydrophobicContact CD1-CZ 3.53Å
601	F	95.9	Very high	93	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-132.9	-6.7	-164.7	-54.7	-60	0	0	0	116.2	I579 P580 Y597 N598 W606 Y632	I579-F601 HydrophobicContact CG1-CZ 4.5Å; I579-F601 HydrophobicContact CG2-CE1 4.34Å; P580-F601 HydrophobicContact CG-CB 3.73Å; P580-F601 HydrophobicContact CG-CG 4.25Å; Y597-F601 HydrophobicContact CD1-CD2 4.4Å; Y597-F601 AromaticContact CD2-CD2 3.69Å; Y597-F601 HydrophobicContact CD2-CD2 3.69Å; Y597-F601 AromaticContact CD2-CE2 3.92Å; Y597-F601 HydrophobicContact CD2-CE2 3.92Å; Y597-F601 HydrophobicContact CE1-CB 4.42Å; Y597-F601 HydrophobicContact CE1-CD2 4.19Å; Y597-F601 AromaticContact CE2-CD2 3.46Å; Y597-F601 HydrophobicContact CE2-CD2 3.46Å; Y597-F601 VanDerWaalsContact CE2-CD2 3.46Å; Y597-F601 AromaticContact CE2-CE2 3.77Å; Y597-F601 HydrophobicContact CE2-CE2 3.77Å; Y597-F601 HydrophobicContact CG-CD2 4.15Å; Y597-F601 AromaticContact CZ-CD2 3.73Å; Y597-F601 PolarHBondContact O-N 3.09Å; N598-F601 PolarHBondContact O-N 2.72Å; F601-W606 AromaticContact CD1-CD2 3.8Å; F601-W606 HydrophobicContact CD1-CD2 3.8Å; F601-W606 AromaticContact CD1-CE2 3.65Å; F601-W606 AromaticContact CD1-CE3 3.97Å; F601-W606 HydrophobicContact CD1-CE3 3.97Å; F601-W606 HydrophobicContact CD1-CG 4.47Å; F601-W606 AromaticContact CD1-CH2 3.89Å; F601-W606 HydrophobicContact CD1-CH2 3.89Å; F601-W606 AromaticContact CD1-CZ2 3.73Å; F601-W606 HydrophobicContact CD1-CZ2 3.73Å; F601-W606 AromaticContact CD1-CZ3 4Å; F601-W606 HydrophobicContact CD1-CZ3 4Å; F601-W606 HydrophobicContact CE1-CE3 4.35Å; F601-W606 AromaticContact CE1-CH2 3.74Å; F601-W606 HydrophobicContact CE1-CH2 3.74Å; F601-W606 AromaticContact CE1-CZ2 3.97Å; F601-W606 HydrophobicContact CE1-CZ2 3.97Å; F601-W606 AromaticContact CE1-CZ3 3.94Å; F601-W606 HydrophobicContact CE1-CZ3 3.94Å; F601-Y632 AromaticContact CE2-CD1 3.48Å; F601-Y632 HydrophobicContact CE2-CD1 3.48Å; F601-Y632 VanDerWaalsContact CE2-CD1 3.48Å; F601-Y632 HydrophobicContact CE2-CD2 4.37Å; F601-Y632 HydrophobicContact CE2-CE1 4.01Å; F601-Y632 AromaticContact CE2-CG 3.71Å; F601-Y632 HydrophobicContact CE2-CG 3.71Å; F601-Y632 AromaticContact CZ-CD1 3.67Å; F601-Y632 HydrophobicContact CZ-CD1 3.67Å; F601-Y632 HydrophobicContact CZ-CE1 4.48Å; F601-Y632 HydrophobicContact CZ-CG 4.01Å
602	Q	94.2	Very high	92.5	Very high	34 Å²	34	49.8 Å²	49.8	16%	0.159	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-3.7	179.4	-59.2	-61.8	-70.9	0	0	113.7	S587 N598 R607	S587-Q602 PolarHBondContact OG-NE2 2.83Å; S587-Q602 VanDerWaalsContact OG-NE2 3.12Å; N598-Q602 WeakPolarHBondContact O-CB 3.41Å; N598-Q602 PolarHBondContact O-N 3.42Å; Q602-R607 PolarHBondContact O-NE 2.83Å
603	D	92.9	Very high	91.9	Very high	42 Å²	42	51.5 Å²	51.5	23%	0.225	27%	0.271	C	S	.	.	S	Bend	trans	-65.1	175.1	177.4	80.2	-33.5	0	0	0	112.8	W606 R607 R628	D603-W606 WeakPolarHBondContact OD1-CB 3.47Å; D603-W606 PolarHBondContact OD1-N 3.22Å; D603-R607 WeakPolarHBondContact O-CB 3.47Å; D603-R607 VanDerWaalsContact O-CG 3.32Å; D603-R607 WeakPolarHBondContact O-CG 3.44Å; D603-R607 PolarHBondContact O-N 2.85Å; D603-R607 PolarHBondContact O-NE 2.96Å; D603-R607 VanDerWaalsContact O-NE 3.11Å; D603-R628 VanDerWaalsContact CG-NH1 3.26Å; D603-R628 IonicContact OD1-CZ 3.81Å; D603-R628 IonicContact OD1-NH1 2.69Å; D603-R628 PolarHBondContact OD1-NH1 3.16Å; D603-R628 IonicContact OD1-NH2 2.74Å; D603-R628 IonicContact OD2-CZ 3.7Å; D603-R628 IonicContact OD2-NH1 2.67Å; D603-R628 PolarHBondContact OD2-NH1 2.85Å; D603-R628 IonicContact OD2-NH2 2.71Å; D603-R628 PolarHBondContact OD2-NH2 3.33Å
604	A	91	Very high	91.5	Very high	53 Å²	53	57.3 Å²	57.3	44%	0.438	30%	0.297	S	S	.	.	H	α-helix	trans	-64.1	-47.6	177.4	0	0	0	0	0	111.2	W606 R607 D608	A604-W606 PolarHBondContact O-N 2.96Å; A604-R607 PolarHBondContact O-N 3.46Å; A604-R607 VanDerWaalsContact O-N 3.14Å; A604-D608 WeakPolarHBondContact O-CB 3.45Å; A604-D608 PolarHBondContact O-N 3.3Å
605	A	91.4	Very high	91	Very high	38 Å²	38	59.7 Å²	59.7	31%	0.314	32%	0.318	S	S	.	.	H	α-helix	trans	-62.4	-42.6	-173.1	0	0	0	0	0	113.5	L609 P623	A605-L609 WeakPolarHBondContact O-CB 3.48Å; A605-L609 PolarHBondContact O-N 3.23Å; A605-L609 VanDerWaalsContact O-N 3.13Å; A605-P623 HydrophobicContact CB-CB 4.01Å; A605-P623 HydrophobicContact CB-CG 4.21Å
606	W	93.1	Very high	90.3	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66.6	-39.8	175.7	-169.1	-85.2	0	0	0	112	I579 P580 L581 F601 D603 A604 F610 V625 R628 V629	I579-W606 HydrophobicContact CG2-CH2 4.04Å; I579-W606 HydrophobicContact CG2-CZ2 3.74Å; P580-W606 PolarHBondContact O-NE1 3.25Å; L581-W606 HydrophobicContact CD2-CZ2 4.46Å; F601-W606 AromaticContact CD1-CD2 3.8Å; F601-W606 HydrophobicContact CD1-CD2 3.8Å; F601-W606 AromaticContact CD1-CE2 3.65Å; F601-W606 AromaticContact CD1-CE3 3.97Å; F601-W606 HydrophobicContact CD1-CE3 3.97Å; F601-W606 HydrophobicContact CD1-CG 4.47Å; F601-W606 AromaticContact CD1-CH2 3.89Å; F601-W606 HydrophobicContact CD1-CH2 3.89Å; F601-W606 AromaticContact CD1-CZ2 3.73Å; F601-W606 HydrophobicContact CD1-CZ2 3.73Å; F601-W606 AromaticContact CD1-CZ3 4Å; F601-W606 HydrophobicContact CD1-CZ3 4Å; F601-W606 HydrophobicContact CE1-CE3 4.35Å; F601-W606 AromaticContact CE1-CH2 3.74Å; F601-W606 HydrophobicContact CE1-CH2 3.74Å; F601-W606 AromaticContact CE1-CZ2 3.97Å; F601-W606 HydrophobicContact CE1-CZ2 3.97Å; F601-W606 AromaticContact CE1-CZ3 3.94Å; F601-W606 HydrophobicContact CE1-CZ3 3.94Å; D603-W606 WeakPolarHBondContact OD1-CB 3.47Å; D603-W606 PolarHBondContact OD1-N 3.22Å; A604-W606 PolarHBondContact O-N 2.96Å; W606-F610 AromaticContact CD1-CD2 3.99Å; W606-F610 AromaticContact CD2-CD2 3.64Å; W606-F610 HydrophobicContact CD2-CD2 3.64Å; W606-F610 AromaticContact CD2-CE2 3.83Å; W606-F610 HydrophobicContact CD2-CE2 3.83Å; W606-F610 AromaticContact CE2-CD2 3.34Å; W606-F610 AromaticContact CE2-CE2 3.62Å; W606-F610 HydrophobicContact CE3-CD2 4.18Å; W606-F610 AromaticContact CE3-CE2 3.89Å; W606-F610 HydrophobicContact CE3-CE2 3.89Å; W606-F610 HydrophobicContact CG-CD2 4.03Å; W606-F610 HydrophobicContact CH2-CD2 4.22Å; W606-F610 AromaticContact CH2-CE2 3.61Å; W606-F610 HydrophobicContact CH2-CE2 3.61Å; W606-F610 HydrophobicContact CH2-CZ 4.36Å; W606-F610 AromaticContact CZ2-CD2 3.66Å; W606-F610 HydrophobicContact CZ2-CD2 3.66Å; W606-F610 AromaticContact CZ2-CE2 3.51Å; W606-F610 HydrophobicContact CZ2-CE2 3.51Å; W606-F610 HydrophobicContact CZ2-CZ 4.38Å; W606-F610 HydrophobicContact CZ3-CD2 4.46Å; W606-F610 AromaticContact CZ3-CE2 3.81Å; W606-F610 HydrophobicContact CZ3-CE2 3.81Å; W606-F610 AromaticContact NE1-CD2 3.56Å; W606-F610 PolarHBondContact O-N 2.75Å; W606-V625 HydrophobicContact CH2-CG1 4.09Å; W606-V625 HydrophobicContact CZ3-CB 4.37Å; W606-V625 HydrophobicContact CZ3-CG1 4.05Å; W606-V625 HydrophobicContact CZ3-CG2 4.2Å; W606-R628 HydrophobicContact CZ3-CB 4.29Å; W606-V629 HydrophobicContact CH2-CG2 4.33Å
607	R	90.8	Very high	89.2	Confident	96 Å²	96	58.8 Å²	58.8	36%	0.362	33%	0.331	S	S	.	.	H	α-helix	trans	-68.7	-46.8	178.8	-70	-172.2	-69.8	114.4	-0.4	111.7	Q602 D603 A604 L609 F610 H611	Q602-R607 PolarHBondContact O-NE 2.83Å; D603-R607 WeakPolarHBondContact O-CB 3.47Å; D603-R607 VanDerWaalsContact O-CG 3.32Å; D603-R607 WeakPolarHBondContact O-CG 3.44Å; D603-R607 PolarHBondContact O-N 2.85Å; D603-R607 PolarHBondContact O-NE 2.96Å; D603-R607 VanDerWaalsContact O-NE 3.11Å; A604-R607 PolarHBondContact O-N 3.46Å; A604-R607 VanDerWaalsContact O-N 3.14Å; R607-L609 VanDerWaalsContact C-N 3.25Å; R607-L609 PolarHBondContact O-N 2.68Å; R607-F610 PolarHBondContact O-N 2.62Å; R607-H611 WeakPolarHBondContact O-CA 3.2Å; R607-H611 WeakPolarHBondContact O-CB 3.22Å; R607-H611 PolarHBondContact O-N 3.23Å
608	D	89.1	Confident	87.6	Confident	91 Å²	91	64.9 Å²	64.9	49%	0.487	36%	0.362	S	S	.	.	H	α-helix	trans	-68.5	-23	-178.9	-70.9	-36	0	0	0	113.1	A604 K612	A604-D608 WeakPolarHBondContact O-CB 3.45Å; A604-D608 PolarHBondContact O-N 3.3Å; D608-K612 WeakPolarHBondContact O-CD 3.45Å; D608-K612 WeakPolarHBondContact O-CE 3.36Å; D608-K612 PolarHBondContact O-NZ 2.81Å
609	L	90	Very high	86	Confident	18 Å²	18	65.2 Å²	65.2	9%	0.094	37%	0.367	C	S	.	.	H	α-helix	trans	-77.3	-61.8	166.5	179.9	58.4	0	0	0	111.2	W491 Y495 A605 R607 P616 P623 V625	W491-L609 HydrophobicContact CH2-CD1 4.21Å; W491-L609 WeakPolarHBondContact CH2-O 3.29Å; W491-L609 HydrophobicContact CZ3-CD1 4.45Å; Y495-L609 HydrophobicContact CE1-CD2 3.96Å; A605-L609 WeakPolarHBondContact O-CB 3.48Å; A605-L609 PolarHBondContact O-N 3.23Å; A605-L609 VanDerWaalsContact O-N 3.13Å; R607-L609 VanDerWaalsContact C-N 3.25Å; R607-L609 PolarHBondContact O-N 2.68Å; L609-P616 HydrophobicContact CD1-CG 4.24Å; L609-P623 HydrophobicContact CD2-CG 4.07Å; L609-V625 HydrophobicContact CD2-CG2 4.01Å
610	F	91.9	Very high	83.8	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-93.6	-6.8	-163.1	-67.2	-64.9	0	0	0	116.2	Q492 Y495 L496 L581 G582 W606 R607 V625	Q492-F610 HydrophobicContact CB-CD1 3.87Å; Q492-F610 HydrophobicContact CB-CE1 4.39Å; Q492-F610 HydrophobicContact CG-CD1 4.09Å; Y495-F610 HydrophobicContact CD1-CE1 4.11Å; Y495-F610 HydrophobicContact CD1-CZ 4.27Å; Y495-F610 HydrophobicContact CE1-CZ 4.43Å; L496-F610 HydrophobicContact CG-CZ 4.39Å; L581-F610 HydrophobicContact CD2-CB 4.45Å; L581-F610 HydrophobicContact CD2-CD1 3.65Å; L581-F610 HydrophobicContact CD2-CD2 4.4Å; L581-F610 HydrophobicContact CD2-CE1 3.83Å; L581-F610 HydrophobicContact CD2-CG 3.94Å; L581-F610 HydrophobicContact CD2-CZ 4.28Å; G582-F610 VanDerWaalsContact CA-O 3.26Å; G582-F610 WeakPolarHBondContact CA-O 3.38Å; G582-F610 PolarHBondContact N-O 2.78Å; W606-F610 AromaticContact CD1-CD2 3.99Å; W606-F610 AromaticContact CD2-CD2 3.64Å; W606-F610 HydrophobicContact CD2-CD2 3.64Å; W606-F610 AromaticContact CD2-CE2 3.83Å; W606-F610 HydrophobicContact CD2-CE2 3.83Å; W606-F610 AromaticContact CE2-CD2 3.34Å; W606-F610 AromaticContact CE2-CE2 3.62Å; W606-F610 HydrophobicContact CE3-CD2 4.18Å; W606-F610 AromaticContact CE3-CE2 3.89Å; W606-F610 HydrophobicContact CE3-CE2 3.89Å; W606-F610 HydrophobicContact CG-CD2 4.03Å; W606-F610 HydrophobicContact CH2-CD2 4.22Å; W606-F610 AromaticContact CH2-CE2 3.61Å; W606-F610 HydrophobicContact CH2-CE2 3.61Å; W606-F610 HydrophobicContact CH2-CZ 4.36Å; W606-F610 AromaticContact CZ2-CD2 3.66Å; W606-F610 HydrophobicContact CZ2-CD2 3.66Å; W606-F610 AromaticContact CZ2-CE2 3.51Å; W606-F610 HydrophobicContact CZ2-CE2 3.51Å; W606-F610 HydrophobicContact CZ2-CZ 4.38Å; W606-F610 HydrophobicContact CZ3-CD2 4.46Å; W606-F610 AromaticContact CZ3-CE2 3.81Å; W606-F610 HydrophobicContact CZ3-CE2 3.81Å; W606-F610 AromaticContact NE1-CD2 3.56Å; W606-F610 PolarHBondContact O-N 2.75Å; R607-F610 PolarHBondContact O-N 2.62Å; F610-V625 HydrophobicContact CE2-CG1 4.48Å; F610-V625 HydrophobicContact CE2-CG2 4Å; F610-V625 HydrophobicContact CZ-CG1 4.22Å; F610-V625 HydrophobicContact CZ-CG2 4.07Å
611	H	88.3	Confident	82.1	Confident	75 Å²	75	78.4 Å²	78.4	35%	0.347	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-8.7	175.5	-67.8	37.9	0	0	0	113.9	G582 R607	G582-H611 PolarHBondContact O-CE1 2.86Å; R607-H611 WeakPolarHBondContact O-CA 3.2Å; R607-H611 WeakPolarHBondContact O-CB 3.22Å; R607-H611 PolarHBondContact O-N 3.23Å
612	K	84.8	Confident	80.6	Confident	110 Å²	110	81.3 Å²	81.3	48%	0.478	44%	0.44	S	S	.	.			trans	-74.1	137.2	172	-68.5	172.6	-176.3	144.3	0	109.6	Q492 D608	Q492-K612 PolarHBondContact NE2-O 2.9Å; D608-K612 WeakPolarHBondContact O-CD 3.45Å; D608-K612 WeakPolarHBondContact O-CE 3.36Å; D608-K612 PolarHBondContact O-NZ 2.81Å
613	T	79.6	Confident	79.9	Confident	121 Å²	121	80.7 Å²	80.7	74%	0.742	44%	0.439	S	S	*	.	S	Bend	trans	-75.1	-30.8	176.8	45	0	0	0	0	112.5	W491	W491-T613 PolarHBondContact NE1-O 3.21Å
614	E	83.8	Confident	79.8	Confident	157 Å²	157	83.4 Å²	83.4	73%	0.734	45%	0.454	S	S	*	.	S	Bend	trans	-102.2	149.1	-179.2	-65.1	173.9	-172	0	0	111	W491	W491-E614 WeakPolarHBondContact CZ2-O 3.21Å; W491-E614 VanDerWaalsContact NE1-C 3.28Å
615	A	82.1	Confident	79.9	Confident	56 Å²	56	81 Å²	81	46%	0.463	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-71.4	142	-177.4	0	0	0	0	0	111.9	W491 V617	W491-A615 HydrophobicContact CB-CB 4.36Å; W491-A615 HydrophobicContact CD2-CB 3.7Å; W491-A615 HydrophobicContact CE3-CB 4.02Å; W491-A615 HydrophobicContact CG-CB 3.84Å; A615-V617 PolarHBondContact O-N 3.13Å
616	P	80	Confident	80.1	Confident	48 Å²	48	80.1 Å²	80.1	31%	0.312	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-66.4	118.4	177	26.8	-34.2	0	0	0	111.2	W491 L609 I618 V619	W491-P616 VanDerWaalsContact CH2-CD 3.42Å; W491-P616 HydrophobicContact CH2-CG 4.33Å; W491-P616 HydrophobicContact CZ3-CG 4.34Å; L609-P616 HydrophobicContact CD1-CG 4.24Å; P616-I618 PolarHBondContact O-N 2.9Å; P616-V619 HydrophobicContact CG-CG2 4.07Å
617	V	72.2	Confident	80.3	Confident	147 Å²	147	82.9 Å²	82.9	89%	0.891	44%	0.444	S	S	*	.	S	Bend	trans	-65.1	-26.7	179.9	-177.8	0	0	0	0	112.5	A615	A615-V617 PolarHBondContact O-N 3.13Å
618	I	63.5	Low	80.5	Confident	130 Å²	130	80.3 Å²	80.3	67%	0.667	43%	0.434	S	S	*	.	S	Bend	trans	-133.4	120.3	171.9	-55.2	178.1	0	0	0	107.2	P616 Q620	P616-I618 PolarHBondContact O-N 2.9Å; I618-Q620 HydrophobicContact CG2-CB 4.23Å; I618-Q620 PolarHBondContact O-N 2.93Å
619	V	60	Low	80.9	Confident	75 Å²	75	76 Å²	76	46%	0.455	41%	0.411	S	S	.	.			trans	-87	80.6	173.4	-175.4	0	0	0	0	108.3	P616	P616-V619 HydrophobicContact CG-CG2 4.07Å
620	Q	50.4	Low	81.2	Confident	167 Å²	167	76.6 Å²	76.6	78%	0.78	42%	0.416	S	S	*	.			trans	-97.2	120	172.9	-153.8	165.1	1.9	0	0	108	I618	I618-Q620 HydrophobicContact CG2-CB 4.23Å; I618-Q620 PolarHBondContact O-N 2.93Å
621	E	58.7	Low	81.5	Confident	189 Å²	189	81 Å²	81	88%	0.883	44%	0.436	S	S	*	.	S	Bend	trans	52.8	64.5	-174.5	-62.3	-175.6	-176.3	0	0	114.4
622	S	65.3	Low	81.9	Confident	60 Å²	60	77.4 Å²	77.4	42%	0.42	42%	0.419	S	S	.	.			trans	-61.4	134.9	161.5	50.3	0	0	0	0	110.4
623	P	79.9	Confident	82.4	Confident	21 Å²	21	72.7 Å²	72.7	14%	0.136	40%	0.4	C	S	.	.			trans	-58.6	158.8	167.2	26.3	-34.1	0	0	0	110.6	A605 L609 V625	A605-P623 HydrophobicContact CB-CB 4.01Å; A605-P623 HydrophobicContact CB-CG 4.21Å; L609-P623 HydrophobicContact CD2-CG 4.07Å; P623-V625 HydrophobicContact CG-CG2 4.21Å; P623-V625 PolarHBondContact O-N 3.26Å
624	D	90.1	Very high	83.1	Confident	99 Å²	99	73.3 Å²	73.3	53%	0.529	39%	0.394	S	S	.	.			trans	-70.9	81	173.1	-171	-13.1	0	0	0	110.6	V626 S627 R628	D624-V626 VanDerWaalsContact C-N 3.29Å; D624-V626 PolarHBondContact O-N 2.87Å; D624-V626 PolarHBondContact OD1-N 3.38Å; D624-S627 VanDerWaalsContact OD1-CB 3.25Å; D624-S627 WeakPolarHBondContact OD1-CB 3.47Å; D624-S627 PolarHBondContact OD1-N 2.83Å; D624-S627 WeakPolarHBondContact OD2-CB 3.42Å; D624-R628 WeakPolarHBondContact O-CB 3.35Å; D624-R628 WeakPolarHBondContact O-CD 3.49Å; D624-R628 WeakPolarHBondContact O-CG 3.26Å; D624-R628 PolarHBondContact O-N 2.87Å; D624-R628 VanDerWaalsContact O-N 3.1Å
625	V	94	Very high	83.6	Confident	4 Å²	4	66.8 Å²	66.8	2%	0.024	37%	0.369	C	S	.	.	H	α-helix	trans	-63.1	-37.8	-178.5	174.1	0	0	0	0	110.9	L496 L499 W606 L609 F610 P623 V629	L496-V625 HydrophobicContact CD1-CG1 3.53Å; L496-V625 HydrophobicContact CG-CG1 4.28Å; L499-V625 HydrophobicContact CD1-CB 4.09Å; L499-V625 HydrophobicContact CD1-CG1 4.27Å; W606-V625 HydrophobicContact CH2-CG1 4.09Å; W606-V625 HydrophobicContact CZ3-CB 4.37Å; W606-V625 HydrophobicContact CZ3-CG1 4.05Å; W606-V625 HydrophobicContact CZ3-CG2 4.2Å; L609-V625 HydrophobicContact CD2-CG2 4.01Å; F610-V625 HydrophobicContact CE2-CG1 4.48Å; F610-V625 HydrophobicContact CE2-CG2 4Å; F610-V625 HydrophobicContact CZ-CG1 4.22Å; F610-V625 HydrophobicContact CZ-CG2 4.07Å; P623-V625 HydrophobicContact CG-CG2 4.21Å; P623-V625 PolarHBondContact O-N 3.26Å; V625-V629 WeakPolarHBondContact O-CB 3.27Å; V625-V629 VanDerWaalsContact O-CG2 3.3Å; V625-V629 WeakPolarHBondContact O-CG2 3.45Å; V625-V629 PolarHBondContact O-N 2.8Å
626	V	95.6	Very high	84.2	Confident	18 Å²	18	64.1 Å²	64.1	11%	0.109	35%	0.347	C	S	.	.	H	α-helix	trans	-71	-50.1	-175.7	-176.6	0	0	0	0	110	L499 L500 H503 L505 D624 R628 V629 T630	L499-V626 HydrophobicContact CB-CG2 4.11Å; L500-V626 HydrophobicContact CD2-CG1 4.32Å; L500-V626 HydrophobicContact CD2-CG2 4.35Å; H503-V626 HydrophobicContact CB-CG1 3.99Å; L505-V626 HydrophobicContact CD1-CG1 4.36Å; D624-V626 VanDerWaalsContact C-N 3.29Å; D624-V626 PolarHBondContact O-N 2.87Å; D624-V626 PolarHBondContact OD1-N 3.38Å; V626-R628 VanDerWaalsContact C-N 3.35Å; V626-R628 PolarHBondContact O-N 2.65Å; V626-V629 PolarHBondContact O-N 2.85Å; V626-T630 WeakPolarHBondContact O-CB 3.39Å; V626-T630 PolarHBondContact O-N 3.09Å; V626-T630 PolarHBondContact O-OG1 3.18Å; V626-T630 VanDerWaalsContact O-OG1 3.13Å
627	S	95.8	Very high	84.8	Confident	58 Å²	58	66.2 Å²	66.2	41%	0.406	36%	0.356	S	S	.	.	H	α-helix	trans	-61.3	-42.3	176.7	-173.2	0	0	0	0	111.8	D624 V629 T630 Q631	D624-S627 VanDerWaalsContact OD1-CB 3.25Å; D624-S627 WeakPolarHBondContact OD1-CB 3.47Å; D624-S627 PolarHBondContact OD1-N 2.83Å; D624-S627 WeakPolarHBondContact OD2-CB 3.42Å; S627-V629 VanDerWaalsContact C-N 3.34Å; S627-V629 PolarHBondContact O-N 2.91Å; S627-T630 PolarHBondContact O-N 2.91Å; S627-Q631 WeakPolarHBondContact O-CB 3.4Å; S627-Q631 PolarHBondContact O-N 2.83Å
628	R	96.5	Very high	85.7	Confident	42 Å²	42	60.4 Å²	60.4	16%	0.158	33%	0.325	C	S	.	.	H	α-helix	trans	-59.4	-41.3	175.4	-73.5	170.9	178.4	-137.4	7.5	112.8	L600 D603 W606 D624 V626 Y632	L600-R628 HydrophobicContact CB-CB 4.46Å; L600-R628 HydrophobicContact CB-CG 4.48Å; L600-R628 HydrophobicContact CD2-CB 4.28Å; L600-R628 HydrophobicContact CD2-CG 3.89Å; L600-R628 WeakPolarHBondContact O-CD 3.5Å; L600-R628 PolarHBondContact O-NH1 2.81Å; D603-R628 VanDerWaalsContact CG-NH1 3.26Å; D603-R628 IonicContact OD1-CZ 3.81Å; D603-R628 IonicContact OD1-NH1 2.69Å; D603-R628 PolarHBondContact OD1-NH1 3.16Å; D603-R628 IonicContact OD1-NH2 2.74Å; D603-R628 IonicContact OD2-CZ 3.7Å; D603-R628 IonicContact OD2-NH1 2.67Å; D603-R628 PolarHBondContact OD2-NH1 2.85Å; D603-R628 IonicContact OD2-NH2 2.71Å; D603-R628 PolarHBondContact OD2-NH2 3.33Å; W606-R628 HydrophobicContact CZ3-CB 4.29Å; D624-R628 WeakPolarHBondContact O-CB 3.35Å; D624-R628 WeakPolarHBondContact O-CD 3.49Å; D624-R628 WeakPolarHBondContact O-CG 3.26Å; D624-R628 PolarHBondContact O-N 2.87Å; D624-R628 VanDerWaalsContact O-N 3.1Å; V626-R628 VanDerWaalsContact C-N 3.35Å; V626-R628 PolarHBondContact O-N 2.65Å; R628-Y632 PolarHBondContact O-N 2.9Å
629	V	97.3	Very high	87	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-68.5	-54	175.6	169.8	0	0	0	0	110.4	I484 L496 L500 I579 W606 V625 V626 S627 Q631 Y632 M633	I484-V629 HydrophobicContact CD1-CG1 4.21Å; L496-V629 HydrophobicContact CD1-CG2 4.38Å; L500-V629 HydrophobicContact CD1-CG1 4.04Å; L500-V629 HydrophobicContact CD2-CB 4.03Å; L500-V629 HydrophobicContact CD2-CG1 3.97Å; L500-V629 HydrophobicContact CD2-CG2 4.38Å; I579-V629 HydrophobicContact CD1-CG1 3.96Å; I579-V629 HydrophobicContact CD1-CG2 4.12Å; I579-V629 HydrophobicContact CG2-CG2 4.45Å; W606-V629 HydrophobicContact CH2-CG2 4.33Å; V625-V629 WeakPolarHBondContact O-CB 3.27Å; V625-V629 VanDerWaalsContact O-CG2 3.3Å; V625-V629 WeakPolarHBondContact O-CG2 3.45Å; V625-V629 PolarHBondContact O-N 2.8Å; V626-V629 PolarHBondContact O-N 2.85Å; S627-V629 VanDerWaalsContact C-N 3.34Å; S627-V629 PolarHBondContact O-N 2.91Å; V629-Q631 PolarHBondContact O-N 2.8Å; V629-Y632 CarbonylContact O-C 3.54Å; V629-Y632 WeakPolarHBondContact O-CA 3.09Å; V629-Y632 WeakPolarHBondContact O-CB 3.5Å; V629-Y632 PolarHBondContact O-N 3.37Å; V629-M633 HydrophobicContact CG1-CG 4.09Å; V629-M633 HydrophobicContact CG1-SD 4.45Å; V629-M633 WeakPolarHBondContact O-CG 3.49Å; V629-M633 PolarHBondContact O-N 2.9Å
630	T	96.6	Very high	88.6	Confident	32 Å²	32	55.2 Å²	55.2	20%	0.196	30%	0.303	C	S	.	.	H	α-helix	trans	-57.1	-45.2	-178.6	-61.2	0	0	0	0	112.1	V626 S627 Y632 M633 E634	V626-T630 WeakPolarHBondContact O-CB 3.39Å; V626-T630 PolarHBondContact O-N 3.09Å; V626-T630 PolarHBondContact O-OG1 3.18Å; V626-T630 VanDerWaalsContact O-OG1 3.13Å; S627-T630 PolarHBondContact O-N 2.91Å; T630-Y632 VanDerWaalsContact C-N 3.25Å; T630-Y632 PolarHBondContact O-N 2.88Å; T630-M633 WeakPolarHBondContact O-CB 3.33Å; T630-M633 PolarHBondContact O-N 3.36Å; T630-M633 VanDerWaalsContact O-N 3.08Å; T630-E634 HydrophobicContact CG2-CG 4.32Å; T630-E634 VanDerWaalsContact CG2-OE1 3.3Å; T630-E634 WeakPolarHBondContact CG2-OE1 3.42Å; T630-E634 WeakPolarHBondContact O-CG 3.44Å; T630-E634 PolarHBondContact O-N 3.06Å
631	Q	96.3	Very high	90.7	Very high	91 Å²	91	51.5 Å²	51.5	43%	0.425	29%	0.285	S	S	.	.	H	α-helix	trans	-58.6	-35.9	175.9	-172.9	178.7	14.5	0	0	112.5	L600 S627 V629 G635 F884	L600-Q631 VanDerWaalsContact CD2-OE1 3.29Å; S627-Q631 WeakPolarHBondContact O-CB 3.4Å; S627-Q631 PolarHBondContact O-N 2.83Å; V629-Q631 PolarHBondContact O-N 2.8Å; Q631-G635 PolarHBondContact O-N 2.75Å; Q631-F884 HydrophobicContact CG-CE1 4.46Å; Q631-F884 HydrophobicContact CG-CZ 4.48Å; Q631-F884 VanDerWaalsContact O-CE1 3.3Å; Q631-F884 WeakPolarHBondContact O-CE1 3.39Å
632	Y	97.3	Very high	92.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-74.1	-41.2	173.7	-174.7	-140.1	0	0	0	112.1	L577 I578 I579 Y597 F601 R628 V629 T630 E634 A636 G882 F884	L577-Y632 HydrophobicContact CB-CD1 4.19Å; L577-Y632 HydrophobicContact CB-CE1 3.59Å; L577-Y632 HydrophobicContact CD2-CE1 4.25Å; L577-Y632 HydrophobicContact CD2-CE2 3.89Å; L577-Y632 HydrophobicContact CG-CE1 4.41Å; I578-Y632 PolarHBondContact N-OH 3.39Å; I579-Y632 HydrophobicContact CG1-CD1 4.15Å; I579-Y632 HydrophobicContact CG1-CE1 4.34Å; Y597-Y632 HydrophobicContact CD2-CD2 4.25Å; Y597-Y632 HydrophobicContact CD2-CE1 4.15Å; Y597-Y632 AromaticContact CD2-CE2 3.66Å; Y597-Y632 HydrophobicContact CD2-CE2 3.66Å; Y597-Y632 AromaticContact CD2-CZ 3.62Å; Y597-Y632 AromaticContact CE2-CE1 3.75Å; Y597-Y632 HydrophobicContact CE2-CE1 3.75Å; Y597-Y632 HydrophobicContact CE2-CE2 4.08Å; Y597-Y632 AromaticContact CE2-CZ 3.53Å; F601-Y632 AromaticContact CE2-CD1 3.48Å; F601-Y632 HydrophobicContact CE2-CD1 3.48Å; F601-Y632 VanDerWaalsContact CE2-CD1 3.48Å; F601-Y632 HydrophobicContact CE2-CD2 4.37Å; F601-Y632 HydrophobicContact CE2-CE1 4.01Å; F601-Y632 AromaticContact CE2-CG 3.71Å; F601-Y632 HydrophobicContact CE2-CG 3.71Å; F601-Y632 AromaticContact CZ-CD1 3.67Å; F601-Y632 HydrophobicContact CZ-CD1 3.67Å; F601-Y632 HydrophobicContact CZ-CE1 4.48Å; F601-Y632 HydrophobicContact CZ-CG 4.01Å; R628-Y632 PolarHBondContact O-N 2.9Å; V629-Y632 CarbonylContact O-C 3.54Å; V629-Y632 WeakPolarHBondContact O-CA 3.09Å; V629-Y632 WeakPolarHBondContact O-CB 3.5Å; V629-Y632 PolarHBondContact O-N 3.37Å; T630-Y632 VanDerWaalsContact C-N 3.25Å; T630-Y632 PolarHBondContact O-N 2.88Å; Y632-E634 VanDerWaalsContact C-N 3.34Å; Y632-E634 PolarHBondContact O-N 2.88Å; Y632-A636 HydrophobicContact CD2-CB 3.57Å; Y632-A636 HydrophobicContact CE2-CB 3.5Å; Y632-A636 VanDerWaalsContact CE2-CB 3.5Å; Y632-A636 WeakPolarHBondContact O-CB 3.28Å; Y632-A636 PolarHBondContact O-N 2.79Å; Y632-A636 VanDerWaalsContact O-N 3.14Å; Y632-G882 PolarHBondContact OH-O 2.94Å; Y632-F884 HydrophobicContact CD2-CD2 4.22Å; Y632-F884 AromaticContact CD2-CE2 3.58Å; Y632-F884 HydrophobicContact CD2-CE2 3.58Å; Y632-F884 AromaticContact CD2-CZ 3.93Å; Y632-F884 HydrophobicContact CD2-CZ 3.93Å; Y632-F884 HydrophobicContact CE2-CE2 4.33Å; Y632-F884 HydrophobicContact CG-CE2 4.41Å
633	M	95.8	Very high	93.8	Very high	12 Å²	12	40.5 Å²	40.5	6%	0.059	23%	0.229	C	C	.	.	H	α-helix	trans	-57.6	-45.9	174.2	-60	-48	-66.3	0	0	111.7	S482 I484 K542 A544 L577 V629 T630	S482-M633 VanDerWaalsContact CB-CE 3.41Å; I484-M633 HydrophobicContact CD1-CE 4.48Å; I484-M633 HydrophobicContact CD1-CG 4.42Å; I484-M633 HydrophobicContact CD1-SD 4.36Å; I484-M633 HydrophobicContact CG1-CE 3.97Å; I484-M633 HydrophobicContact CG1-SD 4.3Å; K542-M633 HydrophobicContact CB-CE 4.47Å; K542-M633 WeakPolarHBondContact CD-O 3.4Å; K542-M633 WeakPolarHBondContact CE-O 3.36Å; K542-M633 PolarHBondContact NZ-O 2.83Å; A544-M633 HydrophobicContact CB-CE 3.74Å; A544-M633 HydrophobicContact CB-SD 3.58Å; A544-M633 VanDerWaalsContact CB-SD 3.58Å; L577-M633 HydrophobicContact CD1-CE 3.87Å; L577-M633 HydrophobicContact CD1-SD 3.72Å; V629-M633 HydrophobicContact CG1-CG 4.09Å; V629-M633 HydrophobicContact CG1-SD 4.45Å; V629-M633 WeakPolarHBondContact O-CG 3.49Å; V629-M633 PolarHBondContact O-N 2.9Å; T630-M633 WeakPolarHBondContact O-CB 3.33Å; T630-M633 PolarHBondContact O-N 3.36Å; T630-M633 VanDerWaalsContact O-N 3.08Å
634	E	94.4	Very high	94.7	Very high	133 Å²	133	39.5 Å²	39.5	62%	0.621	22%	0.222	S	C	*	.	H	α-helix	trans	-76.8	-50.7	-176.6	-68.1	172	176.8	0	0	111.7	K542 T630 Y632 N637	K542-E634 PolarHBondContact NZ-O 2.91Å; T630-E634 HydrophobicContact CG2-CG 4.32Å; T630-E634 VanDerWaalsContact CG2-OE1 3.3Å; T630-E634 WeakPolarHBondContact CG2-OE1 3.42Å; T630-E634 WeakPolarHBondContact O-CG 3.44Å; T630-E634 PolarHBondContact O-N 3.06Å; Y632-E634 VanDerWaalsContact C-N 3.34Å; Y632-E634 PolarHBondContact O-N 2.88Å; E634-N637 PolarHBondContact O-ND2 2.84Å; E634-N637 PolarHBondContact O-OD1 2.81Å
635	G	93.9	Very high	95	Very high	21 Å²	21	34.8 Å²	34.8	22%	0.216	20%	0.197	C	C	.	.	H	α-helix	trans	-80.8	-19.6	-170	0	0	0	0	0	116.4	Q631 N637	Q631-G635 PolarHBondContact O-N 2.75Å; G635-N637 VanDerWaalsContact C-N 3.29Å; G635-N637 PolarHBondContact O-N 2.91Å
636	A	95.1	Very high	95.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.2	C	C	.	.			trans	-80.8	69.5	-176.6	0	0	0	0	0	113.4	R575 L577 Y632 I883	R575-A636 VanDerWaalsContact CD-O 3.27Å; R575-A636 WeakPolarHBondContact CD-O 3.35Å; L577-A636 HydrophobicContact CD1-CB 4.47Å; L577-A636 HydrophobicContact CD2-CB 3.46Å; L577-A636 VanDerWaalsContact CD2-CB 3.46Å; Y632-A636 HydrophobicContact CD2-CB 3.57Å; Y632-A636 HydrophobicContact CE2-CB 3.5Å; Y632-A636 VanDerWaalsContact CE2-CB 3.5Å; Y632-A636 WeakPolarHBondContact O-CB 3.28Å; Y632-A636 PolarHBondContact O-N 2.79Å; Y632-A636 VanDerWaalsContact O-N 3.14Å; A636-I883 CarbonylContact C-O 3.56Å; A636-I883 VanDerWaalsContact CA-O 3.31Å; A636-I883 WeakPolarHBondContact CA-O 3.36Å
637	N	92.3	Very high	95.3	Very high	92 Å²	92	34.7 Å²	34.7	49%	0.492	20%	0.195	S	C	.	.			trans	-93.7	-19.9	-177	-62.2	-49.9	0	0	0	113.5	K542 R575 E634 G635 I883	K542-N637 WeakPolarHBondContact CE-OD1 3.45Å; K542-N637 PolarHBondContact NZ-OD1 2.84Å; R575-N637 PolarHBondContact NE-O 2.74Å; R575-N637 PolarHBondContact NH2-O 2.78Å; E634-N637 PolarHBondContact O-ND2 2.84Å; E634-N637 PolarHBondContact O-OD1 2.81Å; G635-N637 VanDerWaalsContact C-N 3.29Å; G635-N637 PolarHBondContact O-N 2.91Å; N637-I883 PolarHBondContact N-O 2.93Å
638	G	91.6	Very high	95.3	Very high	24 Å²	24	32.8 Å²	32.8	25%	0.247	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	164.3	170.4	0	0	0	0	0	112	R575 G882 I883	R575-G638 PolarHBondContact NE-O 2.97Å; G638-G882 WeakPolarHBondContact O-CA 3.37Å; G638-I883 WeakPolarHBondContact CA-O 3.42Å; G638-I883 PolarHBondContact N-O 3.22Å; G638-I883 PolarHBondContact O-N 3.35Å
639	A	91.4	Very high	95.3	Very high	55 Å²	55	30.8 Å²	30.8	46%	0.455	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	118.5	175.4	0	0	0	0	0	110.2	V881	A639-V881 CarbonylContact C-O 3.33Å; A639-V881 WeakPolarHBondContact CA-O 3.28Å
640	H	93.4	Very high	95.1	Very high	42 Å²	42	30.8 Å²	30.8	19%	0.194	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	119.1	170.3	-174.5	72.9	0	0	0	109.2	Y589 I593 L642 V881 I883	Y589-H640 AromaticContact CE1-NE2 3.56Å; Y589-H640 AromaticContact CZ-NE2 3.82Å; Y589-H640 PolarHBondContact OH-CE1 3.27Å; Y589-H640 PolarHBondContact OH-NE2 3.09Å; Y589-H640 VanDerWaalsContact OH-NE2 3.17Å; I593-H640 HydrophobicContact CD1-CB 4.38Å; H640-L642 PolarHBondContact O-N 2.85Å; H640-L642 VanDerWaalsContact O-N 3.13Å; H640-V881 PolarHBondContact N-O 2.93Å; H640-V881 PolarHBondContact O-N 2.89Å; H640-I883 HydrophobicContact CB-CD1 4.08Å; H640-I883 HydrophobicContact CB-CG1 4.25Å; H640-I883 HydrophobicContact CB-CG2 3.8Å
641	Q	93.8	Very high	94.6	Very high	88 Å²	88	31.3 Å²	31.3	41%	0.411	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	86.8	-176.6	-66.7	-64	-7.7	0	0	110.3	P643 H878	Q641-P643 WeakPolarHBondContact O-CD 3.26Å; Q641-H878 HydrophobicContact CB-CB 3.89Å; Q641-H878 VanDerWaalsContact OE1-CB 3.32Å
642	L	94.6	Very high	93.4	Very high	1 Å²	1	32 Å²	32	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	119.6	177.1	-79.6	-176.3	0	0	0	109.8	V586 Y589 H640 I644 I679 L789 H878 F879 V881	V586-L642 HydrophobicContact CG1-CD1 3.46Å; V586-L642 VanDerWaalsContact CG1-CD1 3.46Å; Y589-L642 HydrophobicContact CD1-CD2 4.03Å; Y589-L642 HydrophobicContact CE1-CD2 3.63Å; H640-L642 PolarHBondContact O-N 2.85Å; H640-L642 VanDerWaalsContact O-N 3.13Å; L642-I644 PolarHBondContact O-N 3.45Å; L642-I679 HydrophobicContact CD1-CD1 4.01Å; L642-L789 HydrophobicContact CD2-CD2 4.28Å; L642-H878 CarbonylContact O-C 3.58Å; L642-H878 VanDerWaalsContact O-CA 3.3Å; L642-H878 WeakPolarHBondContact O-CA 3.41Å; L642-F879 HydrophobicContact CB-CB 4.36Å; L642-F879 PolarHBondContact N-O 3.43Å; L642-F879 PolarHBondContact O-N 2.81Å; L642-V881 HydrophobicContact CB-CG2 4.47Å; L642-V881 HydrophobicContact CD1-CB 4.47Å; L642-V881 HydrophobicContact CD1-CG2 3.54Å; L642-V881 HydrophobicContact CG-CG2 3.95Å
643	P	94.9	Very high	91.5	Very high	18 Å²	18	38.2 Å²	38.2	12%	0.117	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	132.4	-177.4	29.5	-35.5	0	0	0	111.7	Q641 R788	Q641-P643 WeakPolarHBondContact O-CD 3.26Å; P643-R788 WeakPolarHBondContact O-CG 3.35Å
644	I	97.4	Very high	89.2	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-90.4	131	-179.1	-52.7	175.1	0	0	0	109	L556 F559 V560 L642 P677 I679 Q871 W872 V876 K877 F879	L556-I644 HydrophobicContact CD1-CD1 3.91Å; L556-I644 HydrophobicContact CD1-CG1 4.2Å; F559-I644 HydrophobicContact CE1-CD1 4.28Å; V560-I644 HydrophobicContact CG2-CD1 3.76Å; V560-I644 HydrophobicContact CG2-CG2 4.48Å; L642-I644 PolarHBondContact O-N 3.45Å; I644-P677 HydrophobicContact CG2-CB 3.62Å; I644-I679 HydrophobicContact CB-CG2 4.38Å; I644-I679 HydrophobicContact CG1-CG2 3.88Å; I644-Q871 CarbonylContact O-C 3.56Å; I644-Q871 VanDerWaalsContact O-CA 3.28Å; I644-Q871 WeakPolarHBondContact O-CA 3.16Å; I644-W872 HydrophobicContact CB-CB 4.14Å; I644-W872 HydrophobicContact CG2-CB 3.95Å; I644-W872 HydrophobicContact CG2-CG 4.38Å; I644-W872 PolarHBondContact O-N 3.03Å; I644-V876 HydrophobicContact CD1-CG1 4.05Å; I644-K877 PolarHBondContact N-O 2.96Å; I644-F879 HydrophobicContact CD1-CB 4.08Å; I644-F879 HydrophobicContact CG1-CB 4.06Å
645	A	97.4	Very high	86.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	161.4	172.7	0	0	0	0	0	111.6	P677 F678 R788 M802 A869	A645-P677 WeakPolarHBondContact O-CA 3.13Å; A645-F678 HydrophobicContact CB-CD1 3.94Å; A645-F678 HydrophobicContact CB-CD2 4.35Å; A645-F678 HydrophobicContact CB-CE1 3.45Å; A645-F678 VanDerWaalsContact CB-CE1 3.45Å; A645-F678 HydrophobicContact CB-CE2 3.92Å; A645-F678 HydrophobicContact CB-CG 4.37Å; A645-F678 HydrophobicContact CB-CZ 3.44Å; A645-F678 VanDerWaalsContact CB-CZ 3.44Å; A645-F678 PolarHBondContact N-O 2.85Å; A645-F678 WeakPolarHBondContact O-CD1 3.38Å; A645-F678 PolarHBondContact O-N 2.88Å; A645-R788 HydrophobicContact CB-CB 4.1Å; A645-R788 HydrophobicContact CB-CG 3.65Å; A645-M802 HydrophobicContact CB-SD 4.43Å; A645-A869 VanDerWaalsContact CB-O 3.28Å; A645-A869 WeakPolarHBondContact CB-O 3.2Å
646	E	97.3	Very high	84.2	Confident	19 Å²	19	54.7 Å²	54.7	9%	0.089	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.2	-177.5	-177.1	-177.4	101.7	0	0	110.8	F675 L868 A869 W872 S873	E646-F675 HydrophobicContact CG-CD1 4.03Å; E646-L868 CarbonylContact O-C 3.53Å; E646-L868 VanDerWaalsContact O-CA 3.28Å; E646-L868 WeakPolarHBondContact O-CA 3.17Å; E646-A869 HydrophobicContact CB-CB 4.42Å; E646-A869 PolarHBondContact N-O 3.37Å; E646-A869 PolarHBondContact O-N 3.32Å; E646-W872 HydrophobicContact CB-CE3 3.7Å; E646-W872 HydrophobicContact CB-CZ3 4.08Å; E646-W872 HydrophobicContact CG-CE3 3.85Å; E646-W872 HydrophobicContact CG-CZ3 3.74Å; E646-S873 VanDerWaalsContact OE2-CB 3.26Å; E646-S873 WeakPolarHBondContact OE2-CB 3.31Å; E646-S873 PolarHBondContact OE2-OG 3.41Å
647	A	97.9	Very high	81.5	Confident	0 Å²	0	65 Å²	65	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	112.8	170.2	0	0	0	0	0	110.5	F675 I676 F678 I855 Q867 L868	A647-F675 CarbonylContact O-C 3.58Å; A647-F675 WeakPolarHBondContact O-CA 3.42Å; A647-I676 HydrophobicContact CB-CB 4.44Å; A647-I676 PolarHBondContact N-O 2.85Å; A647-I676 PolarHBondContact O-N 3.28Å; A647-F678 HydrophobicContact CB-CD1 3.85Å; A647-F678 HydrophobicContact CB-CE1 3.92Å; A647-I855 HydrophobicContact CB-CD1 3.72Å; A647-Q867 CarbonylContact C-O 3.51Å; A647-Q867 WeakPolarHBondContact CA-O 3.37Å; A647-L868 HydrophobicContact CB-CD2 3.52Å
648	M	97	Very high	78.6	Confident	18 Å²	18	65.2 Å²	65.2	9%	0.089	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	111.4	173.6	-177.5	-160.4	87	0	0	109.3	Q673 K674 F675 F865 F866 Q867	M648-Q673 PolarHBondContact SD-OE1 2.95Å; M648-K674 WeakPolarHBondContact CA-O 3.36Å; M648-F675 HydrophobicContact CB-CD1 3.85Å; M648-F675 HydrophobicContact CB-CE1 3.76Å; M648-F675 HydrophobicContact CB-CZ 4.49Å; M648-F675 HydrophobicContact CG-CD1 3.98Å; M648-F675 HydrophobicContact CG-CE1 3.55Å; M648-F675 HydrophobicContact CG-CE2 4.42Å; M648-F675 HydrophobicContact CG-CZ 3.78Å; M648-F675 HydrophobicContact SD-CE1 3.94Å; M648-F675 HydrophobicContact SD-CZ 3.98Å; M648-F865 HydrophobicContact CE-CE2 3.79Å; M648-F865 HydrophobicContact CE-CZ 4.38Å; M648-F866 CarbonylContact O-C 3.59Å; M648-F866 VanDerWaalsContact O-CA 3.25Å; M648-F866 WeakPolarHBondContact O-CA 3.41Å; M648-Q867 HydrophobicContact CB-CB 4.28Å; M648-Q867 HydrophobicContact CE-CB 3.97Å; M648-Q867 PolarHBondContact N-O 3.28Å; M648-Q867 PolarHBondContact O-N 3.01Å
649	L	95.7	Very high	76.2	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	132.5	174.5	-61	-174.5	0	0	0	110.5	Y651 Q673 K674 I676 V853 I855 W860 V863 F866	L649-Y651 HydrophobicContact CB-CE2 3.83Å; L649-Y651 VanDerWaalsContact CD1-OH 3.22Å; L649-Y651 WeakPolarHBondContact CD1-OH 3.43Å; L649-Q673 CarbonylContact O-C 3.45Å; L649-Q673 VanDerWaalsContact O-CA 3.31Å; L649-Q673 WeakPolarHBondContact O-CA 3.39Å; L649-K674 PolarHBondContact N-O 3.49Å; L649-K674 PolarHBondContact O-N 2.84Å; L649-I676 HydrophobicContact CD1-CD1 3.49Å; L649-I676 VanDerWaalsContact CD1-CD1 3.49Å; L649-I676 HydrophobicContact CG-CD1 3.89Å; L649-V853 HydrophobicContact CD2-CG1 4.37Å; L649-I855 HydrophobicContact CD1-CD1 3.97Å; L649-I855 HydrophobicContact CD2-CD1 4.03Å; L649-I855 HydrophobicContact CG-CD1 4.14Å; L649-W860 HydrophobicContact CD1-CB 3.51Å; L649-W860 HydrophobicContact CD1-CD2 3.73Å; L649-W860 HydrophobicContact CD1-CE3 4.14Å; L649-W860 HydrophobicContact CD1-CG 3.45Å; L649-W860 VanDerWaalsContact CD1-CG 3.45Å; L649-V863 HydrophobicContact CD1-CG2 4.17Å; L649-V863 HydrophobicContact CD2-CG1 4.11Å; L649-V863 HydrophobicContact CD2-CG2 4.3Å; L649-F866 HydrophobicContact CD2-CB 3.47Å; L649-F866 VanDerWaalsContact CD2-CB 3.47Å; L649-F866 HydrophobicContact CD2-CG 4.3Å
650	T	93.3	Very high	73.2	Confident	1 Å²	1	77.2 Å²	77.2	1%	0.006	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	123.6	173.9	-53	0	0	0	0	110.5	Q673 K864 F865	T650-Q673 HydrophobicContact CG2-CG 4.38Å; T650-K864 VanDerWaalsContact O-CB 3.32Å; T650-K864 WeakPolarHBondContact O-CB 3.34Å; T650-K864 PolarHBondContact O-N 2.8Å; T650-F865 HydrophobicContact CG2-CD1 4.31Å; T650-F865 HydrophobicContact CG2-CE1 3.64Å; T650-F865 HydrophobicContact CG2-CZ 3.95Å; T650-F865 PolarHBondContact N-O 3.39Å; T650-F865 VanDerWaalsContact OG1-CZ 3.25Å; T650-F865 WeakPolarHBondContact OG1-CZ 3.38Å
651	Y	86.6	Confident	70.4	Confident	43 Å²	43	83.1 Å²	83.1	17%	0.169	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	145	-177	-61	-89.7	0	0	0	111.7	L649 S671 C672 K674 N861 V863	L649-Y651 HydrophobicContact CB-CE2 3.83Å; L649-Y651 VanDerWaalsContact CD1-OH 3.22Å; L649-Y651 WeakPolarHBondContact CD1-OH 3.43Å; Y651-S671 WeakPolarHBondContact O-CB 3.49Å; Y651-C672 PolarHBondContact N-O 2.98Å; Y651-K674 HydrophobicContact CE2-CB 4.05Å; Y651-N861 VanDerWaalsContact CE1-O 3.29Å; Y651-N861 WeakPolarHBondContact CE1-O 3.46Å; Y651-V863 HydrophobicContact CD1-CG2 4.4Å; Y651-V863 HydrophobicContact CE1-CG2 3.86Å
652	K	70	Confident	67.3	Low	105 Å²	105	85.6 Å²	85.6	46%	0.457	39%	0.391	S	S	.	.			trans	-85.9	115.5	169	-174.3	175.8	-178	175.6	0	109.2	K654 M850 K864	K652-K654 PolarHBondContact O-N 3.31Å; K652-M850 HydrophobicContact CB-CE 4.16Å; K652-M850 HydrophobicContact CB-SD 3.6Å; K652-M850 VanDerWaalsContact CB-SD 3.6Å; K652-M850 HydrophobicContact CD-CE 3.82Å; K652-M850 HydrophobicContact CD-SD 4.22Å; K652-K864 HydrophobicContact CB-CB 4.43Å
653	Q	57.3	Low	64.4	Low	130 Å²	130	93.8 Å²	93.8	61%	0.607	43%	0.426	S	S	*	.			trans	-67.1	94.6	-176.5	-162.7	-177.2	41.1	0	0	111.7	R655	Q653-R655 PolarHBondContact O-N 3.24Å
654	K	48.9	Very low	61.6	Low	111 Å²	111	97.8 Å²	97.8	48%	0.483	46%	0.461	S	S	.	.			trans	-69.3	120.2	166.9	-68.7	177.6	-176.1	169.7	0	108	K652 K656 D862	K652-K654 PolarHBondContact O-N 3.31Å; K654-K656 PolarHBondContact O-N 3.12Å; K654-D862 WeakPolarHBondContact CE-OD1 3.46Å; K654-D862 WeakPolarHBondContact CE-OD2 3.22Å; K654-D862 IonicContact NZ-OD1 4Å; K654-D862 PolarHBondContact NZ-OD1 3.17Å; K654-D862 IonicContact NZ-OD2 2.68Å; K654-D862 PolarHBondContact NZ-OD2 3.22Å
655	R	44.3	Very low	58.6	Low	235 Å²	235	100.2 Å²	100.2	89%	0.887	48%	0.476	S	S	*	.			trans	-69.3	60.6	171.5	-64.5	-175.9	-174	158.1	1.6	111.9	Q653 K657	Q653-R655 PolarHBondContact O-N 3.24Å; R655-K657 PolarHBondContact O-N 3.45Å
656	K	39.2	Very low	55.6	Low	166 Å²	166	102.9 Å²	102.9	72%	0.722	50%	0.495	S	S	*	.			trans	-72.6	118.6	166.5	-78.9	-175.4	172.9	-179	0	107.9	K654 S658	K654-K656 PolarHBondContact O-N 3.12Å; K656-S658 PolarHBondContact O-N 3.37Å
657	K	37.4	Very low	52.7	Low	218 Å²	218	108.1 Å²	108.1	95%	0.948	53%	0.53	S	S	*	.			trans	-70.9	82	165.9	-72.8	-177.3	176	-178.3	0	108.9	R655	R655-K657 PolarHBondContact O-N 3.45Å
658	S	31.4	Very low	49.8	Very low	95 Å²	95	113.4 Å²	113.4	66%	0.664	56%	0.562	S	S	*	*			trans	-130.8	116.2	173.3	-171.5	0	0	0	0	107.9	K656 H660	K656-S658 PolarHBondContact O-N 3.37Å; S658-H660 PolarHBondContact O-N 2.94Å; S658-H660 VanDerWaalsContact O-N 3.12Å
659	F	41.2	Very low	47.2	Very low	219 Å²	219	119.3 Å²	119.3	96%	0.961	59%	0.59	S	S	*	*			trans	-80.8	83.9	176	-78.8	-90.5	0	0	0	109.4
660	H	28.6	Very low	45	Very low	112 Å²	112	126.1 Å²	126.1	52%	0.519	63%	0.626	S	S	.	*			trans	-153.1	166	157.2	-152.6	49.5	0	0	0	112.1	C456 S658	C456-H660 PolarHBondContact O-CD2 3.48Å; C456-H660 PolarHBondContact O-NE2 2.78Å; S658-H660 PolarHBondContact O-N 2.94Å; S658-H660 VanDerWaalsContact O-N 3.12Å
661	F	35	Very low	43.5	Very low	167 Å²	167	127.2 Å²	127.2	73%	0.732	63%	0.634	S	S	*	*			trans	-70.9	133.3	-164.1	-96.6	-115.9	0	0	0	115.9
662	D	27.4	Very low	43.1	Very low	140 Å²	140	127.4 Å²	127.4	75%	0.749	64%	0.641	S	S	*	*				-166.7	104.2	127.3	-112.3	-3.6	0	0	0	107.1
663	F	34	Very low	44	Very low	172 Å²	172	126.5 Å²	126.5	75%	0.754	64%	0.639	S	S	*	*			trans	-129.2	93.3	-168.5	-158.9	-86.2	0	0	0	113.5
664	A	35.6	Very low	45.7	Very low	102 Å²	102	124.4 Å²	124.4	84%	0.843	63%	0.627	S	S	*	*			trans	-145.2	48.4	171.4	0	0	0	0	0	110.9
665	V	35.8	Very low	47.9	Very low	51 Å²	51	124 Å²	124	31%	0.309	63%	0.626	S	S	.	*			trans	-139.4	125	178.2	-168.7	0	0	0	0	109.5	C672	V665-C672 HydrophobicContact CG2-CB 3.88Å
666	S	32.8	Very low	50.4	Low	57 Å²	57	113 Å²	113	40%	0.399	59%	0.585	S	S	.	*			trans	-61.5	145.2	170	180	0	0	0	0	110.3	T668	S666-T668 WeakPolarHBondContact CB-OG1 3.49Å; S666-T668 PolarHBondContact O-N 2.92Å; S666-T668 PolarHBondContact OG-OG1 3.02Å
667	P	36.3	Very low	53.2	Low	129 Å²	129	105.3 Å²	105.3	84%	0.838	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	31.3	176.2	32.8	-38	0	0	0	113.9
668	T	37.4	Very low	56.1	Low	110 Å²	110	94.9 Å²	94.9	68%	0.675	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.7	23.5	-170	61.7	0	0	0	0	114	S666	S666-T668 WeakPolarHBondContact CB-OG1 3.49Å; S666-T668 PolarHBondContact O-N 2.92Å; S666-T668 PolarHBondContact OG-OG1 3.02Å
669	E	42	Very low	59.2	Low	142 Å²	142	90.5 Å²	90.5	66%	0.664	48%	0.475	S	S	*	.	S	Bend	trans	-158.7	145.9	156.1	-120.9	-172.8	-164.7	0	0	112.5	S671	E669-S671 PolarHBondContact O-N 2.94Å
670	D	51	Low	61.7	Low	143 Å²	143	80 Å²	80	77%	0.765	43%	0.429	S	S	*	.	S	Bend	trans	-76.6	17.8	-168.9	-88	-50.9	0	0	0	115.8
671	S	60.3	Low	64.8	Low	24 Å²	24	75.6 Å²	75.6	17%	0.168	41%	0.409	C	S	.	.			trans	-154.2	133.3	175.9	57.5	0	0	0	0	115	Y651 E669	Y651-S671 WeakPolarHBondContact O-CB 3.49Å; E669-S671 PolarHBondContact O-N 2.94Å
672	C	78.3	Confident	67.7	Low	48 Å²	48	67.7 Å²	67.7	32%	0.324	37%	0.374	S	S	.	.			trans	-74.7	134.6	167.5	-178.3	0	0	0	0	110.3	Y651 V665	Y651-C672 PolarHBondContact N-O 2.98Å; V665-C672 HydrophobicContact CG2-CB 3.88Å
673	Q	90.1	Very high	70.9	Confident	86 Å²	86	63.4 Å²	63.4	40%	0.402	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	144.3	172.1	-57.5	-174.6	18.4	0	0	109.8	M648 L649 T650	M648-Q673 PolarHBondContact SD-OE1 2.95Å; L649-Q673 CarbonylContact O-C 3.45Å; L649-Q673 VanDerWaalsContact O-CA 3.31Å; L649-Q673 WeakPolarHBondContact O-CA 3.39Å; T650-Q673 HydrophobicContact CG2-CG 4.38Å
674	K	92.3	Very high	73.6	Confident	86 Å²	86	55.3 Å²	55.3	37%	0.374	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	122.2	175.4	-169.6	165.3	-172.1	160	0	110.7	M648 L649 Y651 I676 W860	M648-K674 WeakPolarHBondContact CA-O 3.36Å; L649-K674 PolarHBondContact N-O 3.49Å; L649-K674 PolarHBondContact O-N 2.84Å; Y651-K674 HydrophobicContact CE2-CB 4.05Å; K674-I676 HydrophobicContact CG-CG1 4.32Å; K674-W860 HydrophobicContact CD-CH2 4.27Å; K674-W860 HydrophobicContact CD-CZ3 3.98Å
675	F	95.4	Very high	75.9	Confident	103 Å²	103	51.1 Å²	51.1	45%	0.452	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	137.9	174.8	-60.7	-92.4	0	0	0	109.7	E646 A647 M648 W872	E646-F675 HydrophobicContact CG-CD1 4.03Å; A647-F675 CarbonylContact O-C 3.58Å; A647-F675 WeakPolarHBondContact O-CA 3.42Å; M648-F675 HydrophobicContact CB-CD1 3.85Å; M648-F675 HydrophobicContact CB-CE1 3.76Å; M648-F675 HydrophobicContact CB-CZ 4.49Å; M648-F675 HydrophobicContact CG-CD1 3.98Å; M648-F675 HydrophobicContact CG-CE1 3.55Å; M648-F675 HydrophobicContact CG-CE2 4.42Å; M648-F675 HydrophobicContact CG-CZ 3.78Å; M648-F675 HydrophobicContact SD-CE1 3.94Å; M648-F675 HydrophobicContact SD-CZ 3.98Å; F675-W872 HydrophobicContact CB-CH2 4.14Å
676	I	97.1	Very high	77.4	Confident	4 Å²	4	51.7 Å²	51.7	2%	0.021	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	121.9	-174.3	-60.1	159.3	0	0	0	108.9	A647 L649 K674 I855 W860	A647-I676 HydrophobicContact CB-CB 4.44Å; A647-I676 PolarHBondContact N-O 2.85Å; A647-I676 PolarHBondContact O-N 3.28Å; L649-I676 HydrophobicContact CD1-CD1 3.49Å; L649-I676 VanDerWaalsContact CD1-CD1 3.49Å; L649-I676 HydrophobicContact CG-CD1 3.89Å; K674-I676 HydrophobicContact CG-CG1 4.32Å; I676-I855 HydrophobicContact CD1-CD1 3.76Å; I676-I855 HydrophobicContact CG2-CG2 4.08Å; I676-W860 HydrophobicContact CD1-CD2 3.9Å; I676-W860 VanDerWaalsContact CD1-CE2 3.42Å; I676-W860 HydrophobicContact CD1-CE3 4.3Å; I676-W860 HydrophobicContact CD1-CH2 3.84Å; I676-W860 HydrophobicContact CD1-CZ2 3.38Å; I676-W860 HydrophobicContact CD1-CZ3 4.28Å; I676-W860 HydrophobicContact CG1-CH2 4.29Å; I676-W860 HydrophobicContact CG1-CZ2 3.98Å; I676-W860 HydrophobicContact CG2-CZ2 4.42Å
677	P	97.7	Very high	78.3	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.019	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	141.3	171.8	29.5	-34	0	0	0	110.9	L556 R557 V560 I644 A645 W872	L556-P677 HydrophobicContact CD2-CB 4.45Å; L556-P677 HydrophobicContact CG-CB 4.41Å; R557-P677 HydrophobicContact CB-CG 4.47Å; R557-P677 HydrophobicContact CG-CG 3.87Å; V560-P677 HydrophobicContact CB-CB 4.34Å; V560-P677 HydrophobicContact CB-CG 4.03Å; V560-P677 HydrophobicContact CG1-CB 4.32Å; V560-P677 HydrophobicContact CG1-CG 4.18Å; V560-P677 HydrophobicContact CG2-CB 3.88Å; V560-P677 HydrophobicContact CG2-CG 4.03Å; I644-P677 HydrophobicContact CG2-CB 3.62Å; A645-P677 WeakPolarHBondContact O-CA 3.13Å; P677-W872 HydrophobicContact CB-CD2 4.28Å; P677-W872 HydrophobicContact CB-CE3 3.8Å; P677-W872 HydrophobicContact CB-CH2 4.33Å; P677-W872 HydrophobicContact CB-CZ3 3.85Å; P677-W872 HydrophobicContact CG-CH2 4.41Å; P677-W872 HydrophobicContact CG-CZ3 4.33Å; P677-W872 VanDerWaalsContact N-CZ3 3.32Å
678	F	97.6	Very high	78.7	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	152	174.8	76.1	-83.8	0	0	0	112.2	A645 A647 V682 R788 M802 I855 D856 L868	A645-F678 HydrophobicContact CB-CD1 3.94Å; A645-F678 HydrophobicContact CB-CD2 4.35Å; A645-F678 HydrophobicContact CB-CE1 3.45Å; A645-F678 VanDerWaalsContact CB-CE1 3.45Å; A645-F678 HydrophobicContact CB-CE2 3.92Å; A645-F678 HydrophobicContact CB-CG 4.37Å; A645-F678 HydrophobicContact CB-CZ 3.44Å; A645-F678 VanDerWaalsContact CB-CZ 3.44Å; A645-F678 PolarHBondContact N-O 2.85Å; A645-F678 WeakPolarHBondContact O-CD1 3.38Å; A645-F678 PolarHBondContact O-N 2.88Å; A647-F678 HydrophobicContact CB-CD1 3.85Å; A647-F678 HydrophobicContact CB-CE1 3.92Å; F678-V682 HydrophobicContact CD1-CG2 4.27Å; F678-V682 HydrophobicContact CD2-CG2 3.97Å; F678-V682 HydrophobicContact CE1-CG2 4.05Å; F678-V682 HydrophobicContact CE2-CG2 3.74Å; F678-V682 HydrophobicContact CG-CG2 4.23Å; F678-V682 HydrophobicContact CZ-CG2 3.78Å; F678-R788 HydrophobicContact CD2-CB 4.25Å; F678-R788 HydrophobicContact CE2-CB 3.85Å; F678-M802 HydrophobicContact CZ-SD 3.94Å; F678-I855 HydrophobicContact CB-CG2 3.64Å; F678-I855 HydrophobicContact CG-CG2 4.18Å; F678-D856 WeakPolarHBondContact CA-OD2 3.25Å; F678-D856 WeakPolarHBondContact CB-OD2 3.23Å; F678-L868 HydrophobicContact CE1-CD2 4.03Å; F678-L868 HydrophobicContact CZ-CD1 4.36Å; F678-L868 HydrophobicContact CZ-CD2 4.27Å
679	I	96.3	Very high	78.5	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.01	27%	0.267	C	S	.	.	S	Bend	trans	-125.1	-21.7	-180	57.6	-177.8	0	0	0	112.9	L552 L556 V586 L642 I644 L789 D856 F879	L552-I679 HydrophobicContact CD2-CD1 3.98Å; L552-I679 HydrophobicContact CG-CD1 4.49Å; L556-I679 HydrophobicContact CD1-CG2 4.07Å; L556-I679 HydrophobicContact CD2-CB 4.41Å; L556-I679 HydrophobicContact CD2-CD1 4.31Å; L556-I679 HydrophobicContact CD2-CG1 4.02Å; L556-I679 HydrophobicContact CD2-CG2 3.91Å; V586-I679 HydrophobicContact CG2-CD1 4.21Å; V586-I679 HydrophobicContact CG2-CG1 3.96Å; L642-I679 HydrophobicContact CD1-CD1 4.01Å; I644-I679 HydrophobicContact CB-CG2 4.38Å; I644-I679 HydrophobicContact CG1-CG2 3.88Å; I679-L789 WeakPolarHBondContact O-CD2 3.13Å; I679-D856 PolarHBondContact N-OD2 2.8Å; I679-F879 HydrophobicContact CD1-CD1 3.86Å; I679-F879 HydrophobicContact CD1-CE1 4.31Å; I679-F879 HydrophobicContact CD1-CG 4.46Å; I679-F879 HydrophobicContact CG2-CB 4.28Å
680	G	94.3	Very high	77.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.268	C	S	.	.	S	Bend	trans	-94.5	-84.8	-177.8	0	0	0	0	0	113.3	S787 R788 D856	G680-S787 WeakPolarHBondContact O-CA 3.25Å; G680-S787 PolarHBondContact O-OG 2.85Å; G680-S787 VanDerWaalsContact O-OG 3.06Å; G680-R788 PolarHBondContact O-N 3.03Å; G680-D856 WeakPolarHBondContact CA-OD1 3.33Å; G680-D856 PolarHBondContact N-OD1 2.87Å; G680-D856 PolarHBondContact N-OD2 3.37Å
681	M	93.8	Very high	76.7	Confident	19 Å²	19	50.5 Å²	50.5	9%	0.094	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	152.4	-170.6	62	175	53.1	0	0	115.3	P585 K683 V786 D856	P585-M681 HydrophobicContact CB-CE 3.59Å; P585-M681 HydrophobicContact CG-CE 3.47Å; P585-M681 VanDerWaalsContact CG-CE 3.47Å; P585-M681 HydrophobicContact CG-SD 3.93Å; M681-K683 HydrophobicContact SD-CD 3.72Å; M681-K683 WeakPolarHBondContact SD-CE 3.44Å; M681-K683 HydrophobicContact SD-CG 4.15Å; M681-V786 CarbonylContact C-O 3.57Å; M681-V786 WeakPolarHBondContact CA-O 3.31Å; M681-V786 WeakPolarHBondContact CB-O 3.38Å; M681-D856 PolarHBondContact N-OD1 2.76Å; M681-D856 PolarHBondContact O-N 2.82Å
682	V	96.6	Very high	75.2	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	129.9	164.5	-177	0	0	0	0	108.8	F678 Q785 V786 V853 L854 I855 F866 L868	F678-V682 HydrophobicContact CD1-CG2 4.27Å; F678-V682 HydrophobicContact CD2-CG2 3.97Å; F678-V682 HydrophobicContact CE1-CG2 4.05Å; F678-V682 HydrophobicContact CE2-CG2 3.74Å; F678-V682 HydrophobicContact CG-CG2 4.23Å; F678-V682 HydrophobicContact CZ-CG2 3.78Å; V682-Q785 CarbonylContact O-C 3.58Å; V682-Q785 VanDerWaalsContact O-CA 3.3Å; V682-Q785 WeakPolarHBondContact O-CA 3.25Å; V682-V786 PolarHBondContact N-O 2.9Å; V682-V786 PolarHBondContact O-N 2.92Å; V682-V853 HydrophobicContact CG1-CG1 3.56Å; V682-L854 CarbonylContact C-O 3.51Å; V682-L854 VanDerWaalsContact CA-O 3.29Å; V682-L854 WeakPolarHBondContact CA-O 3.32Å; V682-I855 HydrophobicContact CG1-CG1 4.12Å; V682-I855 HydrophobicContact CG2-CG1 4.09Å; V682-I855 HydrophobicContact CG2-CG2 4.31Å; V682-F866 HydrophobicContact CG1-CE2 4.1Å; V682-F866 HydrophobicContact CG1-CZ 4.45Å; V682-L868 HydrophobicContact CB-CD1 4.04Å; V682-L868 HydrophobicContact CB-CD2 4.44Å; V682-L868 HydrophobicContact CG1-CD1 4.36Å; V682-L868 HydrophobicContact CG1-CD2 4.35Å; V682-L868 HydrophobicContact CG2-CD1 4.02Å; V682-L868 HydrophobicContact CG2-CD2 3.83Å
683	K	94.2	Very high	72.7	Confident	50 Å²	50	55.9 Å²	55.9	22%	0.217	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	144.9	-179.5	-82.1	176.2	168.9	172.1	0	111.9	M681 L784 Q785 L854	M681-K683 HydrophobicContact SD-CD 3.72Å; M681-K683 WeakPolarHBondContact SD-CE 3.44Å; M681-K683 HydrophobicContact SD-CG 4.15Å; K683-L784 CarbonylContact C-O 3.34Å; K683-L784 WeakPolarHBondContact CA-O 3.2Å; K683-Q785 HydrophobicContact CG-CB 4.06Å; K683-Q785 HydrophobicContact CG-CG 3.92Å; K683-L854 HydrophobicContact CB-CB 4.16Å; K683-L854 HydrophobicContact CB-CD2 4.4Å; K683-L854 HydrophobicContact CD-CD2 4.3Å; K683-L854 PolarHBondContact N-O 3.41Å; K683-L854 PolarHBondContact O-N 3.43Å
684	V	91.8	Very high	69.8	Low	2 Å²	2	57.7 Å²	57.7	1%	0.012	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	137.5	174.7	-161.7	0	0	0	0	109.3	M749 S783 L784 L851 V853 F866	V684-M749 HydrophobicContact CB-CE 4.24Å; V684-M749 HydrophobicContact CG1-CE 3.92Å; V684-M749 HydrophobicContact CG1-SD 3.82Å; V684-S783 WeakPolarHBondContact O-CA 3.36Å; V684-L784 HydrophobicContact CG2-CD2 4.11Å; V684-L784 PolarHBondContact N-O 2.9Å; V684-L784 PolarHBondContact O-N 3.38Å; V684-L851 HydrophobicContact CG1-CD2 4.46Å; V684-V853 HydrophobicContact CG2-CG1 4.41Å; V684-V853 HydrophobicContact CG2-CG2 4.45Å; V684-F866 HydrophobicContact CG2-CE1 3.58Å; V684-F866 HydrophobicContact CG2-CZ 3.52Å
685	G	82.6	Confident	66.6	Low	15 Å²	15	57.3 Å²	57.3	16%	0.155	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	112.1	-145.6	173.3	0	0	0	0	0	114.8	V687 M749	G685-V687 VanDerWaalsContact C-N 3.33Å; G685-V687 PolarHBondContact O-N 3.43Å; G685-M749 WeakPolarHBondContact CA-SD 3.46Å
686	I	67.7	Low	63.4	Low	62 Å²	62	60.4 Å²	60.4	32%	0.318	38%	0.383	S	S	.	.			trans	-70.9	95	174	-57.8	-178.6	0	0	0	107.6	E688 A746 R782	I686-E688 HydrophobicContact CG2-CG 4.17Å; I686-E688 PolarHBondContact O-N 3.37Å; I686-A746 HydrophobicContact CD1-CB 3.65Å; I686-R782 HydrophobicContact CD1-CG 4.3Å; I686-R782 PolarHBondContact N-O 2.91Å; I686-R782 VanDerWaalsContact N-O 3.08Å
687	V	51.7	Low	60.2	Low	53 Å²	53	65.4 Å²	65.4	32%	0.321	42%	0.419	S	S	.	.			trans	-75.3	81.7	166.1	-175.6	0	0	0	0	107.2	G685 Q689 L854	G685-V687 VanDerWaalsContact C-N 3.33Å; G685-V687 PolarHBondContact O-N 3.43Å; V687-Q689 PolarHBondContact O-N 2.93Å; V687-L854 HydrophobicContact CG1-CD2 4.36Å
688	E	44.5	Very low	56.9	Low	95 Å²	95	73 Å²	73	44%	0.444	46%	0.459	S	S	.	.			trans	-60.3	119.2	158.5	-92.1	162.5	167.5	0	0	108	I686 T690 R782	I686-E688 HydrophobicContact CG2-CG 4.17Å; I686-E688 PolarHBondContact O-N 3.37Å; E688-T690 HydrophobicContact CB-CG2 4.01Å; E688-T690 PolarHBondContact O-N 2.8Å; E688-R782 IonicContact OE1-CZ 2.7Å; E688-R782 IonicContact OE1-NH1 3.59Å; E688-R782 IonicContact OE1-NH2 3.74Å; E688-R782 PolarHBondContact OE1-NH2 3.42Å; E688-R782 IonicContact OE2-CZ 2.68Å; E688-R782 VanDerWaalsContact OE2-CZ 3.3Å; E688-R782 IonicContact OE2-NH1 2.65Å; E688-R782 PolarHBondContact OE2-NH1 3.41Å; E688-R782 IonicContact OE2-NH2 2.62Å; E688-R782 PolarHBondContact OE2-NH2 2.94Å
689	Q	33.2	Very low	53.7	Low	183 Å²	183	80.8 Å²	80.8	86%	0.855	50%	0.5	S	S	*	.			trans	-70.4	84.9	159.7	-73	176.6	-31.7	0	0	106.6	V687 S691	V687-Q689 PolarHBondContact O-N 2.93Å; Q689-S691 VanDerWaalsContact C-N 3.31Å; Q689-S691 PolarHBondContact O-N 2.8Å
690	T	30.5	Very low	50.4	Low	111 Å²	111	84.5 Å²	84.5	68%	0.681	53%	0.532	S	S	*	.			trans	-68.7	89.1	179.1	52.6	0	0	0	0	109.8	E688 A692	E688-T690 HydrophobicContact CB-CG2 4.01Å; E688-T690 PolarHBondContact O-N 2.8Å; T690-A692 PolarHBondContact O-N 3.38Å
691	S	25.8	Very low	47.1	Very low	115 Å²	115	89 Å²	89	80%	0.804	57%	0.569	S	S	*	*			trans	-49.7	123.7	151.3	-60.5	0	0	0	0	107.5	Q689 A693	Q689-S691 VanDerWaalsContact C-N 3.31Å; Q689-S691 PolarHBondContact O-N 2.8Å; S691-A693 PolarHBondContact O-N 2.8Å; S691-A693 VanDerWaalsContact O-N 3.08Å
692	A	28.5	Very low	44.1	Very low	99 Å²	99	93.6 Å²	93.6	82%	0.818	60%	0.6	S	S	*	*			trans	-75.1	104.1	-168.2	0	0	0	0	0	111.1	T690	T690-A692 PolarHBondContact O-N 3.38Å
693	A	26.1	Very low	40.8	Very low	86 Å²	86	101.1 Å²	101.1	71%	0.711	64%	0.639	S	S	*	*			trans	-114.6	114.5	169.7	0	0	0	0	0	109.9	S691	S691-A693 PolarHBondContact O-N 2.8Å; S691-A693 VanDerWaalsContact O-N 3.08Å
694	S	27.6	Very low	37.3	Very low	124 Å²	124	104.6 Å²	104.6	87%	0.867	67%	0.67	S	S	*	*			trans	24	117.2	156.2	57.7	0	0	0	0	119.2
695	G	26	Very low	34.2	Very low	78 Å²	78	109.9 Å²	109.9	80%	0.804	71%	0.707	S	S	*	*			trans	-157.6	41.4	166.3	0	0	0	0	0	110.9
696	D	27.6	Very low	31.5	Very low	168 Å²	168	114.5 Å²	114.5	90%	0.898	74%	0.737	S	S	*	*			trans	-74	145.4	177.8	-155.1	-1.5	0	0	0	110.2
697	S	30.4	Very low	29.5	Very low	109 Å²	109	119.7 Å²	119.7	76%	0.762	77%	0.765	S	S	*	*			trans	-154.7	50.3	-161.7	-176	0	0	0	0	114.6
698	D	28.9	Very low	28.3	Very low	163 Å²	163	124.5 Å²	124.5	87%	0.872	79%	0.788	S	S	*	*			trans	-125.4	123.9	154.5	-93.4	-42.9	0	0	0	109.1
699	D	29.3	Very low	27.3	Very low	162 Å²	162	125.7 Å²	125.7	87%	0.866	81%	0.806	S	S	*	*				-175.8	163.5	113.1	-161.1	8.7	0	0	0	110.2
700	A	27.5	Very low	26.9	Very low	81 Å²	81	122.1 Å²	122.1	67%	0.669	80%	0.802	S	S	*	*			trans	-80.9	155.8	173.1	0	0	0	0	0	112.5
701	A	25.8	Very low	26.8	Very low	95 Å²	95	123 Å²	123	79%	0.785	81%	0.807	S	S	*	*			trans	-74.1	150.6	170.8	0	0	0	0	0	111.3
702	P	30.7	Very low	27.6	Very low	114 Å²	114	123 Å²	123	74%	0.74	81%	0.805	S	S	*	*				-145.6	137.8	97.3	35.7	-20	0	0	0	117.2
703	L	26.1	Very low	28.5	Very low	158 Å²	158	122.7 Å²	122.7	83%	0.827	79%	0.794	S	S	*	*			trans	54.4	124.2	137.9	-60.1	174	0	0	0	122.3
704	S	21.6	Very low	28.5	Very low	123 Å²	123	127.4 Å²	127.4	86%	0.86	80%	0.801	S	S	*	*			trans	72.7	156.9	156	84.4	0	0	0	0	116.7
705	S	25.2	Very low	28.6	Very low	113 Å²	113	126.3 Å²	126.3	79%	0.79	79%	0.789	S	S	*	*			cis	-143	171.5	4.2	60.4	0	0	0	0	112
706	S	26.6	Very low	28.7	Very low	113 Å²	113	127.9 Å²	127.9	79%	0.79	79%	0.788	S	S	*	*			trans	-76.2	156.4	-177.4	-43.9	0	0	0	0	114
707	L	26.7	Very low	29.5	Very low	171 Å²	171	126 Å²	126	90%	0.895	79%	0.785	S	S	*	*				-171.5	-173.3	128.6	-101.7	164.9	0	0	0	113
708	L	25.6	Very low	29.5	Very low	154 Å²	154	125 Å²	125	81%	0.806	78%	0.784	S	S	*	*			trans	-126.6	176.3	-155	-67.4	166.1	0	0	0	114.5
709	S	23.3	Very low	29.6	Very low	119 Å²	119	127.4 Å²	127.4	83%	0.832	79%	0.787	S	S	*	*			trans	77.5	155.1	164.3	-95.1	0	0	0	0	117.9
710	S	24.6	Very low	29.8	Very low	108 Å²	108	129.4 Å²	129.4	76%	0.755	79%	0.787	S	S	*	*			cis	-156.6	151.1	-0.5	44.9	0	0	0	0	113.5
711	T	29.8	Very low	29.8	Very low	130 Å²	130	135.1 Å²	135.1	80%	0.798	80%	0.8	S	S	*	*			trans	-95.5	-173.2	158.8	54.5	0	0	0	0	108.9
712	P	41	Very low	30.1	Very low	115 Å²	115	135.2 Å²	135.2	75%	0.747	80%	0.801	S	S	*	*			cis	-137.9	-125.1	15.4	31.3	-1.3	0	0	0	115.8
713	P	48.6	Very low	30.1	Very low	92 Å²	92	135.5 Å²	135.5	60%	0.597	81%	0.806	S	S	*	*				-133.4	-179.5	-110.6	44	-25.8	0	0	0	117.2	V715	P713-V715 HydrophobicContact CG-CG2 4.4Å
714	Q	26.6	Very low	30.8	Very low	185 Å²	185	134 Å²	134	86%	0.864	81%	0.805	S	S	*	*			trans	-137	158.3	154.3	-87.9	-58	-28	0	0	111.6
715	V	27.8	Very low	31.3	Very low	102 Å²	102	134.8 Å²	134.8	62%	0.618	81%	0.805	S	S	*	*			trans	-139.2	119.7	-143.3	-173.8	0	0	0	0	115.8	P713	P713-V715 HydrophobicContact CG-CG2 4.4Å
716	S	29.2	Very low	31.9	Very low	110 Å²	110	134.9 Å²	134.9	77%	0.769	80%	0.804	S	S	*	*			trans	65.5	175.6	148.9	-65.8	0	0	0	0	118.6
717	P	43.8	Very low	32.3	Very low	129 Å²	129	135.2 Å²	135.2	84%	0.838	80%	0.803	S	S	*	*			cis	-120.9	-177.5	1.3	41.9	-27.1	0	0	0	115.9
718	A	31.6	Very low	32.6	Very low	89 Å²	89	133.1 Å²	133.1	74%	0.736	80%	0.8	S	S	*	*			trans	-127.3	166	-175	0	0	0	0	0	112.2
719	F	31.3	Very low	32.8	Very low	213 Å²	213	131 Å²	131	93%	0.934	80%	0.798	S	S	*	*			trans	-127.4	156	158.3	-90.3	-85.1	0	0	0	110.5
720	K	32.8	Very low	33.4	Very low	203 Å²	203	131.6 Å²	131.6	88%	0.883	80%	0.798	S	S	*	*			trans	-115.8	149.8	-179.5	-59.5	174.3	179.6	175.4	0	109.8
721	E	28.1	Very low	33.5	Very low	201 Å²	201	132.1 Å²	132.1	94%	0.939	80%	0.802	S	S	*	*			trans	-154.5	169.5	132.6	-131.6	170.2	-172.8	0	0	110.9
722	A	32	Very low	33.7	Very low	98 Å²	98	133.7 Å²	133.7	81%	0.81	80%	0.804	S	S	*	*			trans	-155.4	142.7	-170.7	0	0	0	0	0	113.6
723	S	30.2	Very low	32.9	Very low	120 Å²	120	135.7 Å²	135.7	84%	0.839	81%	0.808	S	S	*	*			trans	-161.7	158.2	157.5	55.1	0	0	0	0	110.9
724	P	40.5	Very low	31.9	Very low	125 Å²	125	137.3 Å²	137.3	81%	0.812	82%	0.817	S	S	*	*			trans	-111.6	150.4	-169.9	38.9	-30.7	0	0	0	114.9
725	T	32.8	Very low	31.8	Very low	140 Å²	140	133.4 Å²	133.4	86%	0.859	81%	0.81	S	S	*	*			trans	-139.2	148.3	166.2	42.4	0	0	0	0	111.7
726	P	35.9	Very low	31.9	Very low	116 Å²	116	138 Å²	138	75%	0.753	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-86.4	159.9	-173.3	34.9	-36.5	0	0	0	113.8
727	P	36.1	Very low	31.8	Very low	120 Å²	120	138.6 Å²	138.6	78%	0.779	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-78.1	142.8	176	32.3	-34.8	0	0	0	112.5
728	P	33.1	Very low	31	Very low	127 Å²	127	137 Å²	137	83%	0.825	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-80.7	142.6	172.2	32.1	-33.6	0	0	0	112.6
729	S	29.2	Very low	31.1	Very low	109 Å²	109	141.7 Å²	141.7	76%	0.762	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-71.7	157.5	173.1	-67	0	0	0	0	112.5
730	P	36.7	Very low	30.8	Very low	131 Å²	131	135.8 Å²	135.8	85%	0.851	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-76.6	138.2	-167.6	29.9	-36.1	0	0	0	114.1
731	S	26.6	Very low	30.9	Very low	120 Å²	120	133.9 Å²	133.9	84%	0.839	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-103	135.1	169.6	-65.2	0	0	0	0	110.7
732	I	34.5	Very low	30.7	Very low	162 Å²	162	128.2 Å²	128.2	83%	0.831	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-82.9	126.1	177.7	-53.3	167.8	0	0	0	109
733	N	24.3	Very low	30.7	Very low	157 Å²	157	129.4 Å²	129.4	84%	0.84	81%	0.81	S	S	*	*			trans	-172.1	157.5	139.2	-97.6	-25	0	0	0	113.4
734	T	26.6	Very low	30.8	Very low	126 Å²	126	129 Å²	129	77%	0.773	81%	0.807	S	S	*	*			trans	-81.7	131.4	-171.9	47.6	0	0	0	0	114.4
735	S	25.5	Very low	30.6	Very low	103 Å²	103	132 Å²	132	72%	0.72	81%	0.81	S	S	*	*				167.8	128.9	118.4	-77.3	0	0	0	0	115.1
736	F	28.6	Very low	31.5	Very low	200 Å²	200	127 Å²	127	88%	0.877	78%	0.783	S	S	*	*			trans	62.8	150.4	153.2	-85.9	-89.8	0	0	0	122.5
737	C	28	Very low	32.8	Very low	122 Å²	122	129.8 Å²	129.8	82%	0.824	79%	0.786	S	S	*	*			trans	60.2	109	163.4	-63.7	0	0	0	0	119
738	A	25.6	Very low	34.6	Very low	95 Å²	95	126.4 Å²	126.4	79%	0.785	76%	0.761	S	S	*	*			trans	-143.5	91.3	165.1	0	0	0	0	0	111.4
739	L	33.8	Very low	36.9	Very low	188 Å²	188	122.5 Å²	122.5	98%	0.984	73%	0.732	S	S	*	*			trans	-95.7	100.7	156	-109.1	163.9	0	0	0	106.1
740	S	24.9	Very low	39.7	Very low	88 Å²	88	118 Å²	118	62%	0.615	70%	0.703	S	S	*	*			trans	-144.1	106.6	-174.5	-54.3	0	0	0	0	111.3	S742	S740-S742 VanDerWaalsContact C-N 3.3Å; S740-S742 PolarHBondContact O-N 2.84Å
741	T	35	Very low	42.3	Very low	163 Å²	163	111.8 Å²	111.8	100%	1	66%	0.663	S	S	*	*			trans	-76.8	77.3	172.1	18.8	0	0	0	0	110.8
742	S	25.6	Very low	45.5	Very low	83 Å²	83	109 Å²	109	58%	0.58	64%	0.637	S	S	*	*	S	Bend	trans	-139.8	105.3	174.5	59.7	0	0	0	0	111.6	S740 S744	S740-S742 VanDerWaalsContact C-N 3.3Å; S740-S742 PolarHBondContact O-N 2.84Å; S742-S744 PolarHBondContact O-N 3.18Å
743	S	31.9	Very low	48.4	Very low	122 Å²	122	101.3 Å²	101.3	85%	0.853	60%	0.597	S	S	*	*			trans	31	62.3	163.8	64.6	0	0	0	0	115.8	Q745	S743-Q745 PolarHBondContact O-N 2.86Å
744	S	32.2	Very low	51.8	Low	113 Å²	113	94.6 Å²	94.6	79%	0.79	56%	0.562	S	S	*	*			trans	-65.3	121.5	-179.1	46.6	0	0	0	0	110.8	S742 A746	S742-S744 PolarHBondContact O-N 3.18Å; S744-A746 PolarHBondContact O-N 2.91Å; S744-A746 VanDerWaalsContact O-N 3.09Å
745	Q	35.9	Very low	55	Low	187 Å²	187	89.7 Å²	89.7	87%	0.874	53%	0.529	S	S	*	.			trans	-62.2	115.8	165.6	-69.2	-170.1	1.7	0	0	107.5	S743 E747	S743-Q745 PolarHBondContact O-N 2.86Å; Q745-E747 PolarHBondContact O-N 2.93Å
746	A	50.8	Low	58.3	Low	35 Å²	35	87 Å²	87	29%	0.289	50%	0.503	S	S	.	.			trans	-58.8	97.8	-177.2	0	0	0	0	0	111.4	I686 S744 L748	I686-A746 HydrophobicContact CD1-CB 3.65Å; S744-A746 PolarHBondContact O-N 2.91Å; S744-A746 VanDerWaalsContact O-N 3.09Å; A746-L748 PolarHBondContact O-N 3.37Å
747	E	62.9	Low	61.2	Low	174 Å²	174	79.9 Å²	79.9	81%	0.813	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-68.9	116.8	-179	-170.4	175.5	-172.5	0	0	109.5	Q745 M749	Q745-E747 PolarHBondContact O-N 2.93Å; E747-M749 PolarHBondContact O-N 2.93Å
748	L	74.7	Confident	63.8	Low	49 Å²	49	74.5 Å²	74.5	26%	0.257	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-85.3	117.5	-175.4	-57	172.8	0	0	0	110	A746 G750 N780 F781 R782 K809	A746-L748 PolarHBondContact O-N 3.37Å; L748-G750 PolarHBondContact O-N 3.03Å; L748-N780 HydrophobicContact CB-CB 3.83Å; L748-N780 HydrophobicContact CD1-CB 4.36Å; L748-F781 WeakPolarHBondContact CA-O 3.49Å; L748-R782 HydrophobicContact CD2-CB 4.29Å; L748-K809 HydrophobicContact CD1-CB 3.78Å; L748-K809 HydrophobicContact CD1-CD 4.07Å; L748-K809 HydrophobicContact CD1-CG 4.07Å; L748-K809 HydrophobicContact CD2-CB 3.66Å; L748-K809 HydrophobicContact CD2-CD 4.1Å; L748-K809 HydrophobicContact CD2-CG 4.43Å; L748-K809 HydrophobicContact CG-CB 4.35Å; L748-K809 HydrophobicContact CG-CD 4.45Å
749	M	81.7	Confident	65.9	Low	45 Å²	45	74.7 Å²	74.7	22%	0.222	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	120	177.2	-59.7	-177.8	-61.7	0	0	110.7	V684 G685 E747 L751 N780 F781	V684-M749 HydrophobicContact CB-CE 4.24Å; V684-M749 HydrophobicContact CG1-CE 3.92Å; V684-M749 HydrophobicContact CG1-SD 3.82Å; G685-M749 WeakPolarHBondContact CA-SD 3.46Å; E747-M749 PolarHBondContact O-N 2.93Å; M749-L751 HydrophobicContact CB-CD2 4.01Å; M749-L751 HydrophobicContact CB-CG 4Å; M749-L751 HydrophobicContact CE-CD1 3.87Å; M749-L751 HydrophobicContact CE-CG 4.4Å; M749-L751 PolarHBondContact O-N 2.86Å; M749-L751 VanDerWaalsContact O-N 3.16Å; M749-L751 HydrophobicContact SD-CD2 4.42Å; M749-N780 CarbonylContact O-C 3.59Å; M749-N780 VanDerWaalsContact O-CA 3.31Å; M749-N780 WeakPolarHBondContact O-CA 3.46Å; M749-F781 HydrophobicContact CE-CB 4.26Å; M749-F781 PolarHBondContact N-O 3.34Å; M749-F781 PolarHBondContact O-N 3.33Å
750	G	87.4	Confident	67.3	Low	15 Å²	15	70.7 Å²	70.7	16%	0.155	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	102.4	163.6	0	0	0	0	0	109.9	L748 K845	L748-G750 PolarHBondContact O-N 3.03Å; G750-K845 WeakPolarHBondContact O-CB 3.32Å; G750-K845 WeakPolarHBondContact O-CG 3.42Å; G750-K845 PolarHBondContact O-N 3.5Å
751	L	91.9	Very high	68.6	Low	1 Å²	1	74.8 Å²	74.8	1%	0.005	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	153.7	174.5	-51.3	177.3	0	0	0	111.7	M749 V753 F781 L784 A843 K845 L851	M749-L751 HydrophobicContact CB-CD2 4.01Å; M749-L751 HydrophobicContact CB-CG 4Å; M749-L751 HydrophobicContact CE-CD1 3.87Å; M749-L751 HydrophobicContact CE-CG 4.4Å; M749-L751 PolarHBondContact O-N 2.86Å; M749-L751 VanDerWaalsContact O-N 3.16Å; M749-L751 HydrophobicContact SD-CD2 4.42Å; L751-V753 HydrophobicContact CB-CG2 4.23Å; L751-F781 HydrophobicContact CB-CD2 3.66Å; L751-F781 HydrophobicContact CB-CE2 3.61Å; L751-F781 HydrophobicContact CB-CG 4.49Å; L751-F781 HydrophobicContact CB-CZ 4.37Å; L751-F781 HydrophobicContact CD1-CB 4.22Å; L751-F781 HydrophobicContact CD1-CD1 4.38Å; L751-F781 HydrophobicContact CD1-CD2 3.96Å; L751-F781 HydrophobicContact CD1-CE2 4.4Å; L751-F781 HydrophobicContact CD1-CG 3.96Å; L751-F781 HydrophobicContact CG-CD2 3.86Å; L751-F781 HydrophobicContact CG-CE2 4.3Å; L751-F781 HydrophobicContact CG-CG 4.31Å; L751-L784 HydrophobicContact CD1-CB 4.48Å; L751-L784 HydrophobicContact CD1-CD1 4.43Å; L751-A843 CarbonylContact C-O 3.55Å; L751-A843 WeakPolarHBondContact CA-O 3.42Å; L751-K845 WeakPolarHBondContact O-CE 3.43Å; L751-L851 HydrophobicContact CD2-CD1 4.47Å; L751-L851 HydrophobicContact CD2-CD2 3.59Å
752	Q	93.1	Very high	69.3	Low	61 Å²	61	78.8 Å²	78.8	29%	0.285	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	127.4	155.5	172.3	173.8	-22.4	0	0	107.6	D754 T776 L777 K778 C842 A843	Q752-D754 VanDerWaalsContact NE2-CG 3.32Å; Q752-D754 PolarHBondContact NE2-OD1 2.66Å; Q752-D754 PolarHBondContact NE2-OD2 2.85Å; Q752-T776 HydrophobicContact CG-CG2 4.37Å; Q752-L777 WeakPolarHBondContact CA-O 3.33Å; Q752-K778 HydrophobicContact CB-CG 4.23Å; Q752-K778 HydrophobicContact CG-CG 4.1Å; Q752-C842 WeakPolarHBondContact O-CA 3.45Å; Q752-A843 PolarHBondContact N-O 3.25Å; Q752-A843 PolarHBondContact O-N 2.9Å
753	V	94.9	Very high	70.2	Confident	0 Å²	0	83.6 Å²	83.6	0%	0	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	108.6	177.9	-172.5	0	0	0	0	108.2	L751 T776 L777 F781 L784 M804 L840 I841 C842	L751-V753 HydrophobicContact CB-CG2 4.23Å; V753-T776 CarbonylContact O-C 3.49Å; V753-T776 WeakPolarHBondContact O-CA 3.49Å; V753-L777 HydrophobicContact CB-CB 4.32Å; V753-L777 PolarHBondContact N-O 3.27Å; V753-L777 PolarHBondContact O-N 2.99Å; V753-F781 HydrophobicContact CG2-CE1 4.13Å; V753-F781 HydrophobicContact CG2-CE2 4.34Å; V753-F781 HydrophobicContact CG2-CZ 3.66Å; V753-L784 HydrophobicContact CB-CD1 4.49Å; V753-L784 HydrophobicContact CG1-CD1 4.19Å; V753-L784 HydrophobicContact CG2-CD1 3.53Å; V753-M804 HydrophobicContact CG1-CE 4.47Å; V753-M804 HydrophobicContact CG1-SD 3.99Å; V753-L840 HydrophobicContact CG1-CD1 3.65Å; V753-L840 HydrophobicContact CG1-CD2 4.23Å; V753-L840 HydrophobicContact CG1-CG 3.81Å; V753-I841 CarbonylContact C-O 3.54Å; V753-I841 WeakPolarHBondContact CA-O 3.36Å; V753-C842 HydrophobicContact CG2-CB 4.36Å
754	D	95.8	Very high	70.7	Confident	17 Å²	17	87.3 Å²	87.3	9%	0.091	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	125.6	176.2	-73.7	-2	0	0	0	108.5	Q752 W756 K774 N775 T776 L840 I841	Q752-D754 VanDerWaalsContact NE2-CG 3.32Å; Q752-D754 PolarHBondContact NE2-OD1 2.66Å; Q752-D754 PolarHBondContact NE2-OD2 2.85Å; D754-W756 HydrophobicContact CB-CZ3 4.39Å; D754-K774 VanDerWaalsContact CB-CE 3.49Å; D754-K774 WeakPolarHBondContact OD2-CE 3.39Å; D754-K774 IonicContact OD2-NZ 3.98Å; D754-K774 PolarHBondContact OD2-NZ 3.06Å; D754-N775 CarbonylContact C-O 3.5Å; D754-N775 WeakPolarHBondContact CA-O 3.38Å; D754-T776 WeakPolarHBondContact OD1-CB 3.35Å; D754-T776 VanDerWaalsContact OD1-CG2 3.25Å; D754-T776 WeakPolarHBondContact OD1-CG2 3.48Å; D754-T776 PolarHBondContact OD1-OG1 3.27Å; D754-L840 CarbonylContact O-C 3.49Å; D754-L840 WeakPolarHBondContact O-CA 3.38Å; D754-I841 PolarHBondContact N-O 2.83Å; D754-I841 PolarHBondContact O-N 2.87Å
755	Y	95.6	Very high	71.1	Confident	22 Å²	22	89.7 Å²	89.7	9%	0.086	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	154.9	-174.1	72.2	-81.4	0	0	0	113.1	V757 N775 L777 M804 I834 I837 R839	Y755-V757 HydrophobicContact CD2-CG2 3.97Å; Y755-V757 HydrophobicContact CE2-CG2 3.73Å; Y755-N775 HydrophobicContact CD1-CB 3.86Å; Y755-N775 HydrophobicContact CD2-CB 4.19Å; Y755-N775 HydrophobicContact CE1-CB 3.36Å; Y755-N775 HydrophobicContact CE2-CB 3.74Å; Y755-N775 HydrophobicContact CG-CB 4.24Å; Y755-N775 PolarHBondContact N-O 3.05Å; Y755-N775 PolarHBondContact O-N 2.78Å; Y755-L777 HydrophobicContact CE1-CD1 4.38Å; Y755-L777 HydrophobicContact CE1-CD2 4.27Å; Y755-L777 HydrophobicContact CE1-CG 3.92Å; Y755-M804 HydrophobicContact CD1-CE 4.46Å; Y755-I834 HydrophobicContact CE2-CG2 3.77Å; Y755-I837 HydrophobicContact CD2-CD1 4.21Å; Y755-I837 HydrophobicContact CD2-CG1 4.1Å; Y755-R839 WeakPolarHBondContact CA-O 3.3Å
756	W	94.3	Very high	71.3	Confident	47 Å²	47	89.4 Å²	89.4	18%	0.178	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	138.6	179.5	-68.1	-102.5	0	0	0	109.3	D754 K774 I837 S838 R839 I841	D754-W756 HydrophobicContact CB-CZ3 4.39Å; W756-K774 HydrophobicContact CD2-CG 4.4Å; W756-K774 HydrophobicContact CH2-CD 4.13Å; W756-K774 HydrophobicContact CH2-CG 4.25Å; W756-K774 HydrophobicContact CZ2-CB 4.25Å; W756-K774 HydrophobicContact CZ2-CD 3.64Å; W756-K774 HydrophobicContact CZ2-CG 3.7Å; W756-I837 CarbonylContact O-C 3.56Å; W756-I837 WeakPolarHBondContact O-CA 3.48Å; W756-S838 PolarHBondContact O-N 2.7Å; W756-S838 PolarHBondContact O-OG 2.93Å; W756-R839 HydrophobicContact CB-CB 4.44Å; W756-R839 HydrophobicContact CE3-CB 4.04Å; W756-R839 HydrophobicContact CE3-CG 4.06Å; W756-R839 HydrophobicContact CZ3-CG 4.34Å; W756-R839 PolarHBondContact N-O 2.8Å; W756-I841 HydrophobicContact CH2-CD1 4.03Å; W756-I841 HydrophobicContact CZ3-CD1 4.03Å; W756-I841 HydrophobicContact CZ3-CG1 4.13Å
757	V	89.8	Confident	71	Confident	50 Å²	50	96.5 Å²	96.5	30%	0.303	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	137.6	179.7	-175.9	0	0	0	0	108.8	Y755 G836	Y755-V757 HydrophobicContact CD2-CG2 3.97Å; Y755-V757 HydrophobicContact CE2-CG2 3.73Å; V757-G836 CarbonylContact C-O 3.47Å; V757-G836 WeakPolarHBondContact CA-O 3.11Å
758	A	82.8	Confident	70.3	Confident	10 Å²	10	98.5 Å²	98.5	8%	0.083	47%	0.472	C	S	.	.			trans	-64.7	138.4	175.2	0	0	0	0	0	111.2	T760 T801 G836	A758-T760 PolarHBondContact O-N 3.31Å; A758-T801 HydrophobicContact CB-CG2 3.69Å; A758-G836 PolarHBondContact N-O 2.85Å
759	P	69.1	Low	68.9	Low	99 Å²	99	105.9 Å²	105.9	64%	0.643	50%	0.497	S	S	*	.			trans	-65.8	115.5	177.3	27	-34.5	0	0	0	111
760	T	62.2	Low	66.9	Low	104 Å²	104	110.7 Å²	110.7	64%	0.638	52%	0.523	S	S	*	.			trans	-85.7	122.1	175.9	50.3	0	0	0	0	110.6	A758 R762	A758-T760 PolarHBondContact O-N 3.31Å; T760-R762 PolarHBondContact O-N 2.94Å
761	E	52.3	Low	65	Low	173 Å²	173	115.4 Å²	115.4	81%	0.808	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-19.7	-175.3	-59	-172.6	143	0	0	113.9	K763	E761-K763 PolarHBondContact O-N 3.15Å; E761-K763 VanDerWaalsContact O-N 3.09Å
762	R	49.8	Very low	63.4	Low	248 Å²	248	119.6 Å²	119.6	94%	0.936	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	7.9	-176.5	-61.9	-170.9	-179.9	-170.3	1.1	115.4	T760	T760-R762 PolarHBondContact O-N 2.94Å
763	K	45.8	Very low	62.4	Low	184 Å²	184	119.8 Å²	119.8	80%	0.8	59%	0.591	S	S	*	*			trans	-129.2	66.5	172.9	-80.4	-161.6	170.5	-171.9	0	113.1	E761 D765	E761-K763 PolarHBondContact O-N 3.15Å; E761-K763 VanDerWaalsContact O-N 3.09Å; K763-D765 PolarHBondContact O-N 2.76Å
764	K	42.3	Very low	62.2	Low	200 Å²	200	124.9 Å²	124.9	87%	0.87	61%	0.614	S	S	*	*			trans	-87.3	44.6	171	-158.9	-177.3	179.8	179.5	0	112.6
765	D	40.6	Very low	62.1	Low	163 Å²	163	126.9 Å²	126.9	87%	0.872	62%	0.624	S	S	*	*			trans	-161.1	76.5	171	-106.1	-29.8	0	0	0	111.9	K763	K763-D765 PolarHBondContact O-N 2.76Å
766	M	39.3	Very low	61.9	Low	181 Å²	181	128.9 Å²	128.9	89%	0.892	64%	0.639	S	S	*	*	S	Bend	trans	-163.7	147.1	144.2	-132.1	162.6	63.7	0	0	109.3
767	E	45.3	Very low	61.8	Low	183 Å²	183	128.2 Å²	128.2	86%	0.855	64%	0.639	S	S	*	*			trans	-68	148.7	-163.9	-62.1	180	97.9	0	0	115.2	R769	E767-R769 PolarHBondContact O-N 3.31Å
768	K	47.9	Very low	61.7	Low	216 Å²	216	131.7 Å²	131.7	94%	0.939	65%	0.65	S	S	*	*			trans	8.6	88.7	161.6	-67	178.2	179.2	174.2	0	115.6
769	R	45.4	Very low	61.6	Low	205 Å²	205	133.2 Å²	133.2	77%	0.774	66%	0.659	S	S	*	*			trans	-125	137.6	159.1	-172.2	174.3	-64.9	-163.7	-0.4	108.6	E767	E767-R769 PolarHBondContact O-N 3.31Å
770	D	40.1	Very low	62.4	Low	146 Å²	146	132 Å²	132	78%	0.781	65%	0.647	S	S	*	*			trans	-59.2	145.9	-167.1	-53.4	-76.1	0	0	0	113.7	S772	D770-S772 PolarHBondContact O-N 2.84Å
771	S	47.3	Very low	63.6	Low	114 Å²	114	127 Å²	127	80%	0.797	62%	0.616	S	S	*	*	S	Bend	trans	-61.5	132.2	179.4	41	0	0	0	0	111.2
772	S	57.3	Low	65.3	Low	89 Å²	89	121.6 Å²	121.6	62%	0.622	59%	0.589	S	S	*	*	S	Bend	trans	68	62.5	-174.7	77.4	0	0	0	0	115.6	D770 K774	D770-S772 PolarHBondContact O-N 2.84Å; S772-K774 PolarHBondContact O-N 2.87Å
773	S	73.8	Confident	67.2	Low	64 Å²	64	111.1 Å²	111.1	45%	0.448	55%	0.553	S	S	.	*			trans	-59.3	104.5	172.6	59	0	0	0	0	112.4	N775	S773-N775 PolarHBondContact O-ND2 3.24Å
774	K	89.9	Confident	69.5	Low	108 Å²	108	102.4 Å²	102.4	47%	0.47	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	128.9	172.5	-176.3	-175.5	-179.8	-175.7	0	110.1	D754 W756 S772	D754-K774 VanDerWaalsContact CB-CE 3.49Å; D754-K774 WeakPolarHBondContact OD2-CE 3.39Å; D754-K774 IonicContact OD2-NZ 3.98Å; D754-K774 PolarHBondContact OD2-NZ 3.06Å; W756-K774 HydrophobicContact CD2-CG 4.4Å; W756-K774 HydrophobicContact CH2-CD 4.13Å; W756-K774 HydrophobicContact CH2-CG 4.25Å; W756-K774 HydrophobicContact CZ2-CB 4.25Å; W756-K774 HydrophobicContact CZ2-CD 3.64Å; W756-K774 HydrophobicContact CZ2-CG 3.7Å; S772-K774 PolarHBondContact O-N 2.87Å
775	N	93.4	Very high	71.9	Confident	59 Å²	59	95.6 Å²	95.6	32%	0.316	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	154.6	173.7	-68.6	-88.1	0	0	0	110.4	D754 Y755 S773	D754-N775 CarbonylContact C-O 3.5Å; D754-N775 WeakPolarHBondContact CA-O 3.38Å; Y755-N775 HydrophobicContact CD1-CB 3.86Å; Y755-N775 HydrophobicContact CD2-CB 4.19Å; Y755-N775 HydrophobicContact CE1-CB 3.36Å; Y755-N775 HydrophobicContact CE2-CB 3.74Å; Y755-N775 HydrophobicContact CG-CB 4.24Å; Y755-N775 PolarHBondContact N-O 3.05Å; Y755-N775 PolarHBondContact O-N 2.78Å; S773-N775 PolarHBondContact O-ND2 3.24Å
776	T	92.4	Very high	74.6	Confident	64 Å²	64	87.9 Å²	87.9	39%	0.393	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	121.6	-176.7	-73.1	0	0	0	0	111.4	Q752 V753 D754 K778	Q752-T776 HydrophobicContact CG-CG2 4.37Å; V753-T776 CarbonylContact O-C 3.49Å; V753-T776 WeakPolarHBondContact O-CA 3.49Å; D754-T776 WeakPolarHBondContact OD1-CB 3.35Å; D754-T776 VanDerWaalsContact OD1-CG2 3.25Å; D754-T776 WeakPolarHBondContact OD1-CG2 3.48Å; D754-T776 PolarHBondContact OD1-OG1 3.27Å; T776-K778 HydrophobicContact CG2-CD 3.84Å; T776-K778 HydrophobicContact CG2-CG 3.8Å
777	L	90.6	Very high	77.3	Confident	33 Å²	33	80 Å²	80	17%	0.173	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	131.7	168.8	-53.8	-179.9	0	0	0	110.3	Q752 V753 Y755 F781 M804 V806 I834	Q752-L777 WeakPolarHBondContact CA-O 3.33Å; V753-L777 HydrophobicContact CB-CB 4.32Å; V753-L777 PolarHBondContact N-O 3.27Å; V753-L777 PolarHBondContact O-N 2.99Å; Y755-L777 HydrophobicContact CE1-CD1 4.38Å; Y755-L777 HydrophobicContact CE1-CD2 4.27Å; Y755-L777 HydrophobicContact CE1-CG 3.92Å; L777-F781 HydrophobicContact CB-CZ 4.13Å; L777-M804 HydrophobicContact CD1-CE 3.8Å; L777-V806 HydrophobicContact CD1-CG2 4.12Å; L777-I834 HydrophobicContact CD1-CD1 4.17Å
778	K	87.4	Confident	79.6	Confident	123 Å²	123	72.2 Å²	72.2	54%	0.535	37%	0.371	S	S	.	.			trans	-132	39.7	-179.7	-77.3	175.6	171.9	176	0	112.4	Q752 T776 K845	Q752-K778 HydrophobicContact CB-CG 4.23Å; Q752-K778 HydrophobicContact CG-CG 4.1Å; T776-K778 HydrophobicContact CG2-CD 3.84Å; T776-K778 HydrophobicContact CG2-CG 3.8Å; K778-K845 WeakPolarHBondContact O-CE 3.49Å; K778-K845 PolarHBondContact O-NZ 2.93Å
779	C	82.3	Confident	81.7	Confident	41 Å²	41	63 Å²	63	28%	0.277	33%	0.332	S	S	.	.	S	Bend	trans	-86.7	-175.4	176.3	46.1	0	0	0	0	112.6	F781 T808 K845	C779-F781 HydrophobicContact CB-CE2 4.39Å; C779-F781 WeakPolarHBondContact O-CD2 3.22Å; C779-F781 WeakPolarHBondContact O-CE2 3.18Å; C779-F781 WeakPolarHBondContact SG-CE2 3.49Å; C779-F781 WeakPolarHBondContact SG-CZ 3.47Å; C779-T808 HydrophobicContact CB-CG2 4.01Å; C779-K845 WeakPolarHBondContact O-CE 3.44Å; C779-K845 PolarHBondContact O-NZ 2.84Å
780	N	85.8	Confident	83.4	Confident	73 Å²	73	55 Å²	55	39%	0.39	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	123.3	169.1	-70.2	20.6	0	0	0	107.8	L748 M749 K845	L748-N780 HydrophobicContact CB-CB 3.83Å; L748-N780 HydrophobicContact CD1-CB 4.36Å; M749-N780 CarbonylContact O-C 3.59Å; M749-N780 VanDerWaalsContact O-CA 3.31Å; M749-N780 WeakPolarHBondContact O-CA 3.46Å; N780-K845 PolarHBondContact OD1-NZ 2.84Å
781	F	85.8	Confident	84.9	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	138.8	-164.7	-63.4	-112.1	0	0	0	110.3	L748 M749 L751 V753 L777 C779 L784 V806	L748-F781 WeakPolarHBondContact CA-O 3.49Å; M749-F781 HydrophobicContact CE-CB 4.26Å; M749-F781 PolarHBondContact N-O 3.34Å; M749-F781 PolarHBondContact O-N 3.33Å; L751-F781 HydrophobicContact CB-CD2 3.66Å; L751-F781 HydrophobicContact CB-CE2 3.61Å; L751-F781 HydrophobicContact CB-CG 4.49Å; L751-F781 HydrophobicContact CB-CZ 4.37Å; L751-F781 HydrophobicContact CD1-CB 4.22Å; L751-F781 HydrophobicContact CD1-CD1 4.38Å; L751-F781 HydrophobicContact CD1-CD2 3.96Å; L751-F781 HydrophobicContact CD1-CE2 4.4Å; L751-F781 HydrophobicContact CD1-CG 3.96Å; L751-F781 HydrophobicContact CG-CD2 3.86Å; L751-F781 HydrophobicContact CG-CE2 4.3Å; L751-F781 HydrophobicContact CG-CG 4.31Å; V753-F781 HydrophobicContact CG2-CE1 4.13Å; V753-F781 HydrophobicContact CG2-CE2 4.34Å; V753-F781 HydrophobicContact CG2-CZ 3.66Å; L777-F781 HydrophobicContact CB-CZ 4.13Å; C779-F781 HydrophobicContact CB-CE2 4.39Å; C779-F781 WeakPolarHBondContact O-CD2 3.22Å; C779-F781 WeakPolarHBondContact O-CE2 3.18Å; C779-F781 WeakPolarHBondContact SG-CE2 3.49Å; C779-F781 WeakPolarHBondContact SG-CZ 3.47Å; F781-L784 HydrophobicContact CD1-CB 4.22Å; F781-L784 HydrophobicContact CD1-CD1 4.35Å; F781-L784 HydrophobicContact CE1-CD1 4.02Å; F781-V806 HydrophobicContact CD1-CG1 3.69Å; F781-V806 HydrophobicContact CE1-CB 4.37Å; F781-V806 HydrophobicContact CE1-CG1 3.52Å; F781-V806 HydrophobicContact CE1-CG2 3.98Å
782	R	88.4	Confident	85.6	Confident	60 Å²	60	48.8 Å²	48.8	23%	0.226	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	-45.3	164.3	-174.5	-176.6	-170.5	-91.2	2.6	109.7	I686 E688 L748 V807	I686-R782 HydrophobicContact CD1-CG 4.3Å; I686-R782 PolarHBondContact N-O 2.91Å; I686-R782 VanDerWaalsContact N-O 3.08Å; E688-R782 IonicContact OE1-CZ 2.7Å; E688-R782 IonicContact OE1-NH1 3.59Å; E688-R782 IonicContact OE1-NH2 3.74Å; E688-R782 PolarHBondContact OE1-NH2 3.42Å; E688-R782 IonicContact OE2-CZ 2.68Å; E688-R782 VanDerWaalsContact OE2-CZ 3.3Å; E688-R782 IonicContact OE2-NH1 2.65Å; E688-R782 PolarHBondContact OE2-NH1 3.41Å; E688-R782 IonicContact OE2-NH2 2.62Å; E688-R782 PolarHBondContact OE2-NH2 2.94Å; L748-R782 HydrophobicContact CD2-CB 4.29Å; R782-V807 HydrophobicContact CB-CB 4.36Å; R782-V807 HydrophobicContact CB-CG1 4.11Å; R782-V807 PolarHBondContact N-O 3.38Å
783	S	90	Very high	85.6	Confident	28 Å²	28	48.7 Å²	48.7	20%	0.196	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	154.1	172.6	54.7	0	0	0	0	110.8	V684 V807	V684-S783 WeakPolarHBondContact O-CA 3.36Å; S783-V807 PolarHBondContact O-N 3.26Å
784	L	93.7	Very high	84.5	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	132.2	166.1	174.8	150.3	0	0	0	107.3	K683 V684 L751 V753 F781 V786 M804 F866	K683-L784 CarbonylContact C-O 3.34Å; K683-L784 WeakPolarHBondContact CA-O 3.2Å; V684-L784 HydrophobicContact CG2-CD2 4.11Å; V684-L784 PolarHBondContact N-O 2.9Å; V684-L784 PolarHBondContact O-N 3.38Å; L751-L784 HydrophobicContact CD1-CB 4.48Å; L751-L784 HydrophobicContact CD1-CD1 4.43Å; V753-L784 HydrophobicContact CB-CD1 4.49Å; V753-L784 HydrophobicContact CG1-CD1 4.19Å; V753-L784 HydrophobicContact CG2-CD1 3.53Å; F781-L784 HydrophobicContact CD1-CB 4.22Å; F781-L784 HydrophobicContact CD1-CD1 4.35Å; F781-L784 HydrophobicContact CE1-CD1 4.02Å; L784-V786 HydrophobicContact CD2-CG2 3.99Å; L784-M804 HydrophobicContact CD1-SD 3.81Å; L784-M804 HydrophobicContact CG-CG 4.41Å; L784-M804 HydrophobicContact CG-SD 4.2Å; L784-F866 HydrophobicContact CD2-CZ 4.42Å
785	Q	94.3	Very high	82.8	Confident	57 Å²	57	51.8 Å²	51.8	27%	0.266	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	134.7	174.5	176.7	177.9	-46.3	0	0	108.7	V682 K683 M804 T805	V682-Q785 CarbonylContact O-C 3.58Å; V682-Q785 VanDerWaalsContact O-CA 3.3Å; V682-Q785 WeakPolarHBondContact O-CA 3.25Å; K683-Q785 HydrophobicContact CG-CB 4.06Å; K683-Q785 HydrophobicContact CG-CG 3.92Å; Q785-M804 CarbonylContact O-C 3.57Å; Q785-M804 VanDerWaalsContact O-CA 3.28Å; Q785-M804 WeakPolarHBondContact O-CA 3.45Å; Q785-T805 PolarHBondContact N-O 3.23Å; Q785-T805 PolarHBondContact O-N 2.98Å
786	V	96.2	Very high	81	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	133.9	167.9	-175	0	0	0	0	107.4	M681 V682 L784 M802 S803 M804 L840 L868	M681-V786 CarbonylContact C-O 3.57Å; M681-V786 WeakPolarHBondContact CA-O 3.31Å; M681-V786 WeakPolarHBondContact CB-O 3.38Å; V682-V786 PolarHBondContact N-O 2.9Å; V682-V786 PolarHBondContact O-N 2.92Å; L784-V786 HydrophobicContact CD2-CG2 3.99Å; V786-M802 HydrophobicContact CG1-CB 3.84Å; V786-M802 HydrophobicContact CG1-CG 4.31Å; V786-M802 HydrophobicContact CG1-SD 3.86Å; V786-S803 CarbonylContact C-O 3.53Å; V786-S803 VanDerWaalsContact CA-O 3.29Å; V786-S803 WeakPolarHBondContact CA-O 3.45Å; V786-M804 HydrophobicContact CG2-CB 4.17Å; V786-M804 HydrophobicContact CG2-CG 4Å; V786-L840 HydrophobicContact CG2-CD1 3.96Å; V786-L868 HydrophobicContact CB-CD1 3.7Å; V786-L868 HydrophobicContact CG1-CD1 3.77Å; V786-L868 HydrophobicContact CG2-CD1 3.74Å
787	S	95.3	Very high	79.4	Confident	16 Å²	16	55 Å²	55	11%	0.112	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	141.6	175.1	-165.5	0	0	0	0	110.6	G680 L789 M802 S803	G680-S787 WeakPolarHBondContact O-CA 3.25Å; G680-S787 PolarHBondContact O-OG 2.85Å; G680-S787 VanDerWaalsContact O-OG 3.06Å; S787-L789 PolarHBondContact OG-N 2.89Å; S787-M802 WeakPolarHBondContact O-CA 3.36Å; S787-M802 WeakPolarHBondContact O-CB 3.41Å; S787-S803 PolarHBondContact N-O 2.88Å; S787-S803 PolarHBondContact O-N 2.83Å; S787-S803 VanDerWaalsContact O-N 3.11Å
788	R	94.2	Very high	78.2	Confident	19 Å²	19	59.4 Å²	59.4	7%	0.072	37%	0.371	C	S	.	.			trans	-96.8	-19.4	169.6	-175	54.8	-173.3	103.1	-18.1	113.4	P643 A645 F678 G680 T801 A870	P643-R788 WeakPolarHBondContact O-CG 3.35Å; A645-R788 HydrophobicContact CB-CB 4.1Å; A645-R788 HydrophobicContact CB-CG 3.65Å; F678-R788 HydrophobicContact CD2-CB 4.25Å; F678-R788 HydrophobicContact CE2-CB 3.85Å; G680-R788 PolarHBondContact O-N 3.03Å; R788-T801 PolarHBondContact NH1-O 2.87Å; R788-A870 PolarHBondContact NE-O 2.79Å; R788-A870 PolarHBondContact NH2-O 2.94Å; R788-A870 VanDerWaalsContact NH2-O 3.14Å
789	L	91.4	Very high	77.7	Confident	22 Å²	22	57.6 Å²	57.6	12%	0.115	36%	0.364	C	S	.	.	S	Bend	trans	-55.6	128.7	175.9	-62.2	167.9	0	0	0	110	P585 V586 Y589 L642 I679 S787	P585-L789 HydrophobicContact CB-CD1 4.39Å; V586-L789 HydrophobicContact CB-CD2 4.45Å; V586-L789 HydrophobicContact CG1-CD2 4.41Å; V586-L789 HydrophobicContact CG2-CD2 4.15Å; Y589-L789 HydrophobicContact CD1-CD2 3.88Å; Y589-L789 HydrophobicContact CD2-CB 4.23Å; Y589-L789 HydrophobicContact CG-CB 4.23Å; Y589-L789 HydrophobicContact CG-CD2 3.93Å; Y589-L789 HydrophobicContact CG-CG 4.46Å; L642-L789 HydrophobicContact CD2-CD2 4.28Å; I679-L789 WeakPolarHBondContact O-CD2 3.13Å; S787-L789 PolarHBondContact OG-N 2.89Å
790	P	82.6	Confident	77.8	Confident	39 Å²	39	57.7 Å²	57.7	25%	0.253	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-58.2	153.8	175.4	-25.4	34.3	0	0	0	112.8	Y589 G792	Y589-P790 WeakPolarHBondContact CD2-O 3.46Å; Y589-P790 HydrophobicContact CE2-CB 4.14Å; Y589-P790 HydrophobicContact CE2-CG 4.4Å; Y589-P790 WeakPolarHBondContact CE2-O 3.3Å; P790-G792 PolarHBondContact O-N 2.93Å
791	P	71.3	Confident	78.1	Confident	78 Å²	78	55.8 Å²	55.8	51%	0.506	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-62.5	130.8	164.4	27.3	-32	0	0	0	109.6	A794	P791-A794 HydrophobicContact CG-CB 3.99Å; P791-A794 PolarHBondContact O-N 2.82Å
792	G	62.5	Low	78.5	Confident	51 Å²	51	56 Å²	56	53%	0.526	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	136.4	-178	0	0	0	0	0	112.1	P790 A794	P790-G792 PolarHBondContact O-N 2.93Å; G792-A794 VanDerWaalsContact C-N 3.34Å; G792-A794 PolarHBondContact O-N 2.89Å
793	G	57	Low	78.7	Confident	86 Å²	86	54.6 Å²	54.6	89%	0.887	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.6	4.1	177.9	0	0	0	0	0	116.2
794	A	50.6	Low	78.9	Confident	62 Å²	62	53.2 Å²	53.2	51%	0.512	35%	0.346	S	S	.	.			trans	-90.4	137.1	174.5	0	0	0	0	0	112.4	P791 G792	P791-A794 HydrophobicContact CG-CB 3.99Å; P791-A794 PolarHBondContact O-N 2.82Å; G792-A794 VanDerWaalsContact C-N 3.34Å; G792-A794 PolarHBondContact O-N 2.89Å
795	E	53.7	Low	78.9	Confident	176 Å²	176	55 Å²	55	82%	0.822	36%	0.358	S	S	*	.			trans	-51.5	140.2	164.3	-85.5	-71.7	123	0	0	111.1	S797	E795-S797 PolarHBondContact O-N 2.82Å
796	P	55.6	Low	78.8	Confident	115 Å²	115	52.5 Å²	52.5	75%	0.747	35%	0.346	S	S	*	.			trans	-66.9	103.5	-176.3	27.4	-34.3	0	0	0	111.3
797	S	58.7	Low	78.4	Confident	74 Å²	74	53.6 Å²	53.6	52%	0.517	35%	0.353	S	S	.	.			trans	-58.9	131.8	175.3	62.4	0	0	0	0	110.6	E795 Q799	E795-S797 PolarHBondContact O-N 2.82Å; S797-Q799 PolarHBondContact O-N 2.94Å; S797-Q799 PolarHBondContact OG-O 3.08Å
798	P	64.5	Low	77.9	Confident	127 Å²	127	54.3 Å²	54.3	83%	0.825	36%	0.356	S	S	*	.	S	Bend	trans	-67.7	-9.5	-172	26.2	-35.7	0	0	0	114.6
799	Q	77.1	Confident	76.7	Confident	84 Å²	84	57.6 Å²	57.6	39%	0.393	37%	0.371	S	S	.	.	S	Bend	trans	-105.3	137.9	174.7	-63.6	-170.1	13.5	0	0	111.4	S797 T801	S797-Q799 PolarHBondContact O-N 2.94Å; S797-Q799 PolarHBondContact OG-O 3.08Å; Q799-T801 PolarHBondContact O-N 2.89Å
800	P	84.3	Confident	75.1	Confident	44 Å²	44	61.7 Å²	61.7	29%	0.286	39%	0.39	S	S	.	.			trans	-70.3	125.9	177.9	29.5	-34.8	0	0	0	110.9	A870 Q871	P800-A870 HydrophobicContact CB-CB 4.1Å; P800-A870 VanDerWaalsContact O-CB 3.3Å; P800-A870 WeakPolarHBondContact O-CB 3.27Å; P800-Q871 HydrophobicContact CB-CB 3.87Å; P800-Q871 HydrophobicContact CB-CG 4.48Å; P800-Q871 HydrophobicContact CG-CB 3.96Å
801	T	92	Very high	73.6	Confident	33 Å²	33	69.1 Å²	69.1	20%	0.202	42%	0.418	C	S	.	.			trans	-138.3	159.4	-179.1	58.5	0	0	0	0	112.5	A758 R788 Q799 I837	A758-T801 HydrophobicContact CB-CG2 3.69Å; R788-T801 PolarHBondContact NH1-O 2.87Å; Q799-T801 PolarHBondContact O-N 2.89Å; T801-I837 CarbonylContact C-O 3.55Å; T801-I837 WeakPolarHBondContact CA-O 3.18Å
802	M	94.4	Very high	72.5	Confident	5 Å²	5	69.5 Å²	69.5	3%	0.025	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	161	173.1	-65.3	174.8	-66	0	0	109.7	A645 F678 V786 S787 G836 I837 L868 A870	A645-M802 HydrophobicContact CB-SD 4.43Å; F678-M802 HydrophobicContact CZ-SD 3.94Å; V786-M802 HydrophobicContact CG1-CB 3.84Å; V786-M802 HydrophobicContact CG1-CG 4.31Å; V786-M802 HydrophobicContact CG1-SD 3.86Å; S787-M802 WeakPolarHBondContact O-CA 3.36Å; S787-M802 WeakPolarHBondContact O-CB 3.41Å; M802-G836 PolarHBondContact O-N 2.86Å; M802-I837 HydrophobicContact CB-CB 4.42Å; M802-I837 HydrophobicContact CE-CG2 4.27Å; M802-I837 PolarHBondContact N-O 2.84Å; M802-I837 WeakPolarHBondContact O-CB 3.46Å; M802-I837 PolarHBondContact O-N 3.21Å; M802-L868 HydrophobicContact CE-CB 3.94Å; M802-L868 HydrophobicContact SD-CB 4.14Å; M802-A870 HydrophobicContact CE-CB 4.04Å; M802-A870 HydrophobicContact CG-CB 3.87Å; M802-A870 HydrophobicContact SD-CB 4.38Å
803	S	93.8	Very high	71.6	Confident	29 Å²	29	76.2 Å²	76.2	20%	0.203	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	143.5	166.5	62.1	0	0	0	0	110.7	V786 S787 I834	V786-S803 CarbonylContact C-O 3.53Å; V786-S803 VanDerWaalsContact CA-O 3.29Å; V786-S803 WeakPolarHBondContact CA-O 3.45Å; S787-S803 PolarHBondContact N-O 2.88Å; S787-S803 PolarHBondContact O-N 2.83Å; S787-S803 VanDerWaalsContact O-N 3.11Å; S803-I834 CarbonylContact C-O 3.49Å; S803-I834 WeakPolarHBondContact CA-O 3.32Å
804	M	94.7	Very high	70.9	Confident	0 Å²	0	81.1 Å²	81.1	0%	0	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	124	176.8	179	-178.6	55.7	0	0	110.4	V753 Y755 L777 L784 Q785 V786 V806 V833 I834 I837 L840	V753-M804 HydrophobicContact CG1-CE 4.47Å; V753-M804 HydrophobicContact CG1-SD 3.99Å; Y755-M804 HydrophobicContact CD1-CE 4.46Å; L777-M804 HydrophobicContact CD1-CE 3.8Å; L784-M804 HydrophobicContact CD1-SD 3.81Å; L784-M804 HydrophobicContact CG-CG 4.41Å; L784-M804 HydrophobicContact CG-SD 4.2Å; Q785-M804 CarbonylContact O-C 3.57Å; Q785-M804 VanDerWaalsContact O-CA 3.28Å; Q785-M804 WeakPolarHBondContact O-CA 3.45Å; V786-M804 HydrophobicContact CG2-CB 4.17Å; V786-M804 HydrophobicContact CG2-CG 4Å; M804-V806 HydrophobicContact CE-CG2 3.87Å; M804-V806 HydrophobicContact CG-CG2 3.85Å; M804-V806 HydrophobicContact SD-CG2 3.79Å; M804-V833 CarbonylContact O-C 3.52Å; M804-V833 WeakPolarHBondContact O-CA 3.37Å; M804-I834 HydrophobicContact CE-CB 4.46Å; M804-I834 HydrophobicContact CE-CD1 3.92Å; M804-I834 PolarHBondContact N-O 2.95Å; M804-I834 PolarHBondContact O-N 2.89Å; M804-I837 HydrophobicContact CB-CD1 3.43Å; M804-I837 VanDerWaalsContact CB-CD1 3.43Å; M804-I837 HydrophobicContact CE-CD1 4.14Å; M804-L840 HydrophobicContact CE-CD1 4.39Å; M804-L840 HydrophobicContact CG-CD1 4.48Å; M804-L840 HydrophobicContact SD-CD1 3.48Å; M804-L840 WeakPolarHBondContact SD-CD1 3.36Å
805	T	93.4	Very high	70.4	Confident	39 Å²	39	83.8 Å²	83.8	24%	0.239	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	126.9	169.2	-52.8	0	0	0	0	109.6	Q785 Q832 V833	Q785-T805 PolarHBondContact N-O 3.23Å; Q785-T805 PolarHBondContact O-N 2.98Å; T805-Q832 CarbonylContact C-O 3.57Å; T805-Q832 WeakPolarHBondContact CA-O 3.46Å; T805-V833 HydrophobicContact CG2-CG2 4.33Å
806	V	91.1	Very high	70	Confident	3 Å²	3	84 Å²	84	2%	0.018	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123.3	-177.6	168	0	0	0	0	109.1	L777 F781 M804 T808 S831 Q832	L777-V806 HydrophobicContact CD1-CG2 4.12Å; F781-V806 HydrophobicContact CD1-CG1 3.69Å; F781-V806 HydrophobicContact CE1-CB 4.37Å; F781-V806 HydrophobicContact CE1-CG1 3.52Å; F781-V806 HydrophobicContact CE1-CG2 3.98Å; M804-V806 HydrophobicContact CE-CG2 3.87Å; M804-V806 HydrophobicContact CG-CG2 3.85Å; M804-V806 HydrophobicContact SD-CG2 3.79Å; V806-T808 HydrophobicContact CG1-CG2 3.88Å; V806-S831 CarbonylContact O-C 3.55Å; V806-S831 WeakPolarHBondContact O-CA 3.31Å; V806-Q832 PolarHBondContact N-O 3.41Å; V806-Q832 PolarHBondContact O-N 2.91Å
807	V	89.1	Confident	69.5	Low	24 Å²	24	87.5 Å²	87.5	15%	0.145	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	117.4	172.8	-174.7	0	0	0	0	109.7	R782 S783	R782-V807 HydrophobicContact CB-CB 4.36Å; R782-V807 HydrophobicContact CB-CG1 4.11Å; R782-V807 PolarHBondContact N-O 3.38Å; S783-V807 PolarHBondContact O-N 3.26Å
808	T	84.4	Confident	68.8	Low	31 Å²	31	91.9 Å²	91.9	19%	0.19	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	146.6	176.1	60.1	0	0	0	0	111.4	C779 V806 S829 K830	C779-T808 HydrophobicContact CB-CG2 4.01Å; V806-T808 HydrophobicContact CG1-CG2 3.88Å; T808-S829 CarbonylContact O-C 3.49Å; T808-S829 WeakPolarHBondContact O-CA 3.33Å; T808-K830 PolarHBondContact N-O 3.49Å; T808-K830 PolarHBondContact O-N 2.82Å; T808-K830 PolarHBondContact OG1-O 2.99Å
809	K	68.5	Low	67.5	Low	87 Å²	87	95.3 Å²	95.3	38%	0.378	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	111.6	171.3	170.7	161.9	176.4	167.1	0	108.4	L748 K811 V827	L748-K809 HydrophobicContact CD1-CB 3.78Å; L748-K809 HydrophobicContact CD1-CD 4.07Å; L748-K809 HydrophobicContact CD1-CG 4.07Å; L748-K809 HydrophobicContact CD2-CB 3.66Å; L748-K809 HydrophobicContact CD2-CD 4.1Å; L748-K809 HydrophobicContact CD2-CG 4.43Å; L748-K809 HydrophobicContact CG-CB 4.35Å; L748-K809 HydrophobicContact CG-CD 4.45Å; K809-K811 PolarHBondContact O-N 2.9Å; K809-V827 HydrophobicContact CD-CG1 3.61Å; K809-V827 VanDerWaalsContact CE-CG1 3.46Å; K809-V827 HydrophobicContact CG-CG1 3.6Å
810	E	56.8	Low	66.1	Low	108 Å²	108	101.1 Å²	101.1	51%	0.505	49%	0.49	S	S	.	.			trans	-72.5	126.7	-177.3	-172.8	169.1	153.7	0	0	111.2	N812	E810-N812 VanDerWaalsContact C-N 3.34Å; E810-N812 PolarHBondContact O-N 2.83Å; E810-N812 VanDerWaalsContact O-N 3.1Å
811	K	52.5	Low	63.9	Low	195 Å²	195	109.1 Å²	109.1	85%	0.848	52%	0.52	S	S	*	.			trans	-75	93.5	158	-84.8	-167.7	174	-174.7	0	107.9	K809 K813	K809-K811 PolarHBondContact O-N 2.9Å; K811-K813 PolarHBondContact O-N 3.17Å
812	N	47.6	Very low	61.6	Low	86 Å²	86	113.4 Å²	113.4	46%	0.46	55%	0.551	S	S	.	*			trans	-43.2	104.8	169.1	-107.7	-101.2	0	0	0	109.3	E810 K814	E810-N812 VanDerWaalsContact C-N 3.34Å; E810-N812 PolarHBondContact O-N 2.83Å; E810-N812 VanDerWaalsContact O-N 3.1Å; N812-K814 VanDerWaalsContact C-N 3.26Å; N812-K814 PolarHBondContact O-N 3.35Å
813	K	44.8	Very low	58.8	Low	192 Å²	192	122.5 Å²	122.5	84%	0.835	59%	0.591	S	S	*	*			trans	-72.7	85.7	173.7	-77	-173.3	179.7	179	0	108.1	K811 V815	K811-K813 PolarHBondContact O-N 3.17Å; K813-V815 VanDerWaalsContact C-N 3.29Å; K813-V815 PolarHBondContact O-N 2.69Å
814	K	42.1	Very low	56.2	Low	189 Å²	189	128.7 Å²	128.7	82%	0.822	62%	0.622	S	S	*	*			trans	-60.4	94.5	165.8	-77.4	-170.7	175.8	-177.3	0	108.7	N812 M816	N812-K814 VanDerWaalsContact C-N 3.26Å; N812-K814 PolarHBondContact O-N 3.35Å; K814-M816 PolarHBondContact O-N 2.68Å
815	V	39	Very low	53.6	Low	119 Å²	119	136.4 Å²	136.4	72%	0.721	66%	0.655	S	S	*	*			trans	-54.7	128.2	158.5	180	0	0	0	0	106.4	K813 F817	K813-V815 VanDerWaalsContact C-N 3.29Å; K813-V815 PolarHBondContact O-N 2.69Å; V815-F817 VanDerWaalsContact C-N 3.35Å; V815-F817 HydrophobicContact CG1-CD2 4.2Å; V815-F817 PolarHBondContact O-N 3.06Å
816	M	45.2	Very low	51.2	Low	180 Å²	180	143.2 Å²	143.2	89%	0.887	68%	0.684	S	S	*	*	S	Bend	trans	-75.9	86.9	-174.4	-68.2	-153.4	-136	0	0	111.3	K814	K814-M816 PolarHBondContact O-N 2.68Å
817	F	45	Very low	49.1	Very low	189 Å²	189	146.9 Å²	146.9	83%	0.829	71%	0.706	S	S	*	*			trans	-118	126.9	152.8	-82.8	-85.1	0	0	0	109.1	V815 Q819	V815-F817 VanDerWaalsContact C-N 3.35Å; V815-F817 HydrophobicContact CG1-CD2 4.2Å; V815-F817 PolarHBondContact O-N 3.06Å; F817-Q819 PolarHBondContact O-N 3.18Å
818	L	44.2	Very low	47.2	Very low	165 Å²	165	152.7 Å²	152.7	86%	0.864	73%	0.732	S	S	*	*			trans	-68.9	124.4	176.2	-84.7	69.9	0	0	0	109.1
819	Q	37.3	Very low	46	Very low	200 Å²	200	153.7 Å²	153.7	94%	0.935	74%	0.74	S	S	*	*				-155.8	154	128.6	-110.9	168.4	32.1	0	0	112	F817	F817-Q819 PolarHBondContact O-N 3.18Å
820	K	48.3	Very low	46.2	Very low	205 Å²	205	156 Å²	156	89%	0.891	75%	0.75	S	S	*	*			trans	-104.5	108.1	-164.6	175	-173.4	177.4	-177.7	0	110.1
821	K	37.3	Very low	47.5	Very low	213 Å²	213	154.1 Å²	154.1	93%	0.926	75%	0.749	S	S	*	*			trans	-154.2	146.1	157.2	-112.9	170.7	-173.6	179.4	0	111.3
822	S	44.1	Very low	49.1	Very low	122 Å²	122	149.5 Å²	149.5	85%	0.853	73%	0.731	S	S	*	*			trans	-93.9	125	-175.8	48.9	0	0	0	0	111.5
823	K	35.3	Very low	51.2	Low	197 Å²	197	149.3 Å²	149.3	86%	0.857	73%	0.732	S	S	*	*			trans	-153.5	138.8	153.2	-164.9	177.1	-175.7	-175.8	0	106.4	K825	K823-K825 PolarHBondContact O-N 3.18Å
824	D	38.7	Very low	53.4	Low	159 Å²	159	141 Å²	141	85%	0.85	70%	0.697	S	S	*	*			trans	-59.7	124.1	171.1	-80.3	-65.3	0	0	0	109.4
825	K	39.9	Very low	55.8	Low	161 Å²	161	137.9 Å²	137.9	70%	0.7	69%	0.685	S	S	*	*			trans	-94.1	109.6	163.4	-87	-156.2	167.3	-151.3	0	106.6	K823	K823-K825 PolarHBondContact O-N 3.18Å
826	E	44	Very low	58.2	Low	183 Å²	183	133 Å²	133	86%	0.855	66%	0.659	S	S	*	*			trans	-53.7	153.9	165	-71.3	-174.1	99.2	0	0	110.9	E828	E826-E828 VanDerWaalsContact C-N 3.26Å; E826-E828 PolarHBondContact O-N 2.93Å
827	V	46.8	Very low	60.5	Low	79 Å²	79	124.4 Å²	124.4	48%	0.479	62%	0.617	S	S	.	*			trans	-79.7	82.2	-178.5	-179.5	0	0	0	0	109	K809 S829	K809-V827 HydrophobicContact CD-CG1 3.61Å; K809-V827 VanDerWaalsContact CE-CG1 3.46Å; K809-V827 HydrophobicContact CG-CG1 3.6Å; V827-S829 PolarHBondContact O-N 3.47Å; V827-S829 PolarHBondContact O-OG 2.88Å
828	E	48.8	Very low	62.8	Low	147 Å²	147	117.5 Å²	117.5	69%	0.687	59%	0.592	S	S	*	*			trans	-50.5	107.9	173.7	-156.4	168.5	-166.6	0	0	109.5	E826	E826-E828 VanDerWaalsContact C-N 3.26Å; E826-E828 PolarHBondContact O-N 2.93Å
829	S	60.3	Low	65.2	Low	52 Å²	52	114.8 Å²	114.8	36%	0.364	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.1	98.9	-169.2	-68.7	0	0	0	0	108.9	T808 V827 S831	T808-S829 CarbonylContact O-C 3.49Å; T808-S829 WeakPolarHBondContact O-CA 3.33Å; V827-S829 PolarHBondContact O-N 3.47Å; V827-S829 PolarHBondContact O-OG 2.88Å; S829-S831 PolarHBondContact O-N 2.87Å
830	K	72.5	Confident	68	Low	134 Å²	134	105.2 Å²	105.2	58%	0.583	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	107.4	-174.9	-170.5	166.2	-174.3	166.8	0	110.6	T808	T808-K830 PolarHBondContact N-O 3.49Å; T808-K830 PolarHBondContact O-N 2.82Å; T808-K830 PolarHBondContact OG1-O 2.99Å
831	S	82.9	Confident	70.3	Confident	69 Å²	69	97.5 Å²	97.5	48%	0.483	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	144.1	166.6	-167.5	0	0	0	0	110.1	V806 S829	V806-S831 CarbonylContact O-C 3.55Å; V806-S831 WeakPolarHBondContact O-CA 3.31Å; S829-S831 PolarHBondContact O-N 2.87Å
832	Q	87.8	Confident	73.1	Confident	99 Å²	99	87.3 Å²	87.3	46%	0.463	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	132.4	173	179.8	178.1	-2.5	0	0	109.2	T805 V806 I834	T805-Q832 CarbonylContact C-O 3.57Å; T805-Q832 WeakPolarHBondContact CA-O 3.46Å; V806-Q832 PolarHBondContact N-O 3.41Å; V806-Q832 PolarHBondContact O-N 2.91Å; Q832-I834 HydrophobicContact CG-CG1 4.1Å
833	V	90.3	Very high	75.4	Confident	82 Å²	82	83 Å²	83	50%	0.497	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	141.2	168	-175	0	0	0	0	108.9	M804 T805 E835	M804-V833 CarbonylContact O-C 3.52Å; M804-V833 WeakPolarHBondContact O-CA 3.37Å; T805-V833 HydrophobicContact CG2-CG2 4.33Å; V833-E835 HydrophobicContact CG1-CG 4.07Å
834	I	91.4	Very high	78	Confident	18 Å²	18	74.2 Å²	74.2	9%	0.092	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	119	175.1	-54.4	-174.4	0	0	0	107.7	Y755 L777 S803 M804 Q832 I837	Y755-I834 HydrophobicContact CE2-CG2 3.77Å; L777-I834 HydrophobicContact CD1-CD1 4.17Å; S803-I834 CarbonylContact C-O 3.49Å; S803-I834 WeakPolarHBondContact CA-O 3.32Å; M804-I834 HydrophobicContact CE-CB 4.46Å; M804-I834 HydrophobicContact CE-CD1 3.92Å; M804-I834 PolarHBondContact N-O 2.95Å; M804-I834 PolarHBondContact O-N 2.89Å; Q832-I834 HydrophobicContact CG-CG1 4.1Å; I834-I837 HydrophobicContact CB-CD1 4.22Å; I834-I837 HydrophobicContact CG2-CD1 4.02Å; I834-I837 HydrophobicContact CG2-CG1 4.23Å; I834-I837 WeakPolarHBondContact O-CD1 3.18Å
835	E	91.4	Very high	80.3	Confident	122 Å²	122	70.4 Å²	70.4	57%	0.57	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	175.8	-176.1	-57.6	-169.3	145.4	0	0	112.3	V833 I837	V833-E835 HydrophobicContact CG1-CG 4.07Å; E835-I837 VanDerWaalsContact C-N 3.29Å; E835-I837 PolarHBondContact O-N 2.8Å
836	G	90.8	Very high	82.2	Confident	17 Å²	17	68.9 Å²	68.9	18%	0.175	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	72.4	15.9	175.3	0	0	0	0	0	114.8	V757 A758 M802 S838	V757-G836 CarbonylContact C-O 3.47Å; V757-G836 WeakPolarHBondContact CA-O 3.11Å; A758-G836 PolarHBondContact N-O 2.85Å; M802-G836 PolarHBondContact O-N 2.86Å; G836-S838 PolarHBondContact O-N 3.31Å
837	I	92.8	Very high	83.6	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	118.4	-172.6	-60.7	174.3	0	0	0	110.1	Y755 W756 T801 M802 M804 I834 E835 R839 L840	Y755-I837 HydrophobicContact CD2-CD1 4.21Å; Y755-I837 HydrophobicContact CD2-CG1 4.1Å; W756-I837 CarbonylContact O-C 3.56Å; W756-I837 WeakPolarHBondContact O-CA 3.48Å; T801-I837 CarbonylContact C-O 3.55Å; T801-I837 WeakPolarHBondContact CA-O 3.18Å; M802-I837 HydrophobicContact CB-CB 4.42Å; M802-I837 HydrophobicContact CE-CG2 4.27Å; M802-I837 PolarHBondContact N-O 2.84Å; M802-I837 WeakPolarHBondContact O-CB 3.46Å; M802-I837 PolarHBondContact O-N 3.21Å; M804-I837 HydrophobicContact CB-CD1 3.43Å; M804-I837 VanDerWaalsContact CB-CD1 3.43Å; M804-I837 HydrophobicContact CE-CD1 4.14Å; I834-I837 HydrophobicContact CB-CD1 4.22Å; I834-I837 HydrophobicContact CG2-CD1 4.02Å; I834-I837 HydrophobicContact CG2-CG1 4.23Å; I834-I837 WeakPolarHBondContact O-CD1 3.18Å; E835-I837 VanDerWaalsContact C-N 3.29Å; E835-I837 PolarHBondContact O-N 2.8Å; I837-R839 WeakPolarHBondContact CG2-O 3.23Å; I837-L840 HydrophobicContact CG2-CB 4.2Å
838	S	93.3	Very high	85	Confident	43 Å²	43	73.1 Å²	73.1	30%	0.301	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-36.9	177.8	56.7	0	0	0	0	112.6	W756 G836 A870	W756-S838 PolarHBondContact O-N 2.7Å; W756-S838 PolarHBondContact O-OG 2.93Å; G836-S838 PolarHBondContact O-N 3.31Å; S838-A870 WeakPolarHBondContact O-CB 3.48Å; S838-A870 PolarHBondContact O-N 3.31Å
839	R	95.1	Very high	86.6	Confident	108 Å²	108	69.4 Å²	69.4	41%	0.408	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	145.5	178.2	-173.8	179.3	-179.9	179.3	1.9	110.8	Y755 W756 I837 Q867 L868	Y755-R839 WeakPolarHBondContact CA-O 3.3Å; W756-R839 HydrophobicContact CB-CB 4.44Å; W756-R839 HydrophobicContact CE3-CB 4.04Å; W756-R839 HydrophobicContact CE3-CG 4.06Å; W756-R839 HydrophobicContact CZ3-CG 4.34Å; W756-R839 PolarHBondContact N-O 2.8Å; I837-R839 WeakPolarHBondContact CG2-O 3.23Å; R839-Q867 VanDerWaalsContact CZ-OE1 3.31Å; R839-Q867 VanDerWaalsContact NE-OE1 3.09Å; R839-L868 WeakPolarHBondContact CA-O 3.29Å
840	L	96.5	Very high	87.9	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	144.7	175.5	177.1	149.2	0	0	0	110.3	V753 D754 V786 M804 I837 C842 F866 Q867 L868	V753-L840 HydrophobicContact CG1-CD1 3.65Å; V753-L840 HydrophobicContact CG1-CD2 4.23Å; V753-L840 HydrophobicContact CG1-CG 3.81Å; D754-L840 CarbonylContact O-C 3.49Å; D754-L840 WeakPolarHBondContact O-CA 3.38Å; V786-L840 HydrophobicContact CG2-CD1 3.96Å; M804-L840 HydrophobicContact CE-CD1 4.39Å; M804-L840 HydrophobicContact CG-CD1 4.48Å; M804-L840 HydrophobicContact SD-CD1 3.48Å; M804-L840 WeakPolarHBondContact SD-CD1 3.36Å; I837-L840 HydrophobicContact CG2-CB 4.2Å; L840-C842 HydrophobicContact CD2-CB 3.94Å; L840-F866 HydrophobicContact CD2-CE2 4Å; L840-Q867 CarbonylContact O-C 3.54Å; L840-Q867 VanDerWaalsContact O-CA 3.26Å; L840-Q867 WeakPolarHBondContact O-CA 3.2Å; L840-L868 HydrophobicContact CB-CB 4.43Å; L840-L868 HydrophobicContact CD2-CD1 4.21Å; L840-L868 HydrophobicContact CD2-CG 4.25Å; L840-L868 PolarHBondContact N-O 2.79Å; L840-L868 PolarHBondContact O-N 2.8Å
841	I	96.6	Very high	88.8	Confident	42 Å²	42	62.9 Å²	62.9	22%	0.215	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	126.2	171.6	-57.3	175.7	0	0	0	107.7	V753 D754 W756 F865 F866 Q867	V753-I841 CarbonylContact C-O 3.54Å; V753-I841 WeakPolarHBondContact CA-O 3.36Å; D754-I841 PolarHBondContact N-O 2.83Å; D754-I841 PolarHBondContact O-N 2.87Å; W756-I841 HydrophobicContact CH2-CD1 4.03Å; W756-I841 HydrophobicContact CZ3-CD1 4.03Å; W756-I841 HydrophobicContact CZ3-CG1 4.13Å; I841-F865 HydrophobicContact CG2-CD2 4.29Å; I841-F866 CarbonylContact C-O 3.42Å; I841-F866 WeakPolarHBondContact CA-O 3.4Å; I841-Q867 HydrophobicContact CG1-CB 4.13Å; I841-Q867 HydrophobicContact CG1-CG 4.1Å
842	C	95.2	Very high	89.2	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	126.5	-178.3	172.8	0	0	0	0	111.3	Q752 V753 L840 F865 F866	Q752-C842 WeakPolarHBondContact O-CA 3.45Å; V753-C842 HydrophobicContact CG2-CB 4.36Å; L840-C842 HydrophobicContact CD2-CB 3.94Å; C842-F865 WeakPolarHBondContact O-CA 3.21Å; C842-F865 WeakPolarHBondContact O-CB 3.47Å; C842-F866 HydrophobicContact CB-CD1 4.1Å; C842-F866 HydrophobicContact CB-CD2 4.4Å; C842-F866 HydrophobicContact CB-CE1 3.53Å; C842-F866 HydrophobicContact CB-CE2 3.87Å; C842-F866 HydrophobicContact CB-CZ 3.41Å; C842-F866 VanDerWaalsContact CB-CZ 3.41Å; C842-F866 PolarHBondContact N-O 3.2Å; C842-F866 PolarHBondContact O-N 2.79Å; C842-F866 VanDerWaalsContact SG-CE1 3.54Å
843	A	93.2	Very high	89.5	Confident	30 Å²	30	60.3 Å²	60.3	25%	0.248	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	157	178	0	0	0	0	0	110.8	L751 Q752 F865	L751-A843 CarbonylContact C-O 3.55Å; L751-A843 WeakPolarHBondContact CA-O 3.42Å; Q752-A843 PolarHBondContact N-O 3.25Å; Q752-A843 PolarHBondContact O-N 2.9Å; A843-F865 HydrophobicContact CB-CB 3.69Å
844	A	90	Very high	89.8	Confident	14 Å²	14	58 Å²	58	12%	0.116	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	142.6	166.7	0	0	0	0	0	110.9	H846 T849 L851	A844-H846 PolarHBondContact O-N 2.93Å; A844-T849 HydrophobicContact CB-CG2 3.91Å; A844-L851 HydrophobicContact CB-CD2 4.07Å
845	K	85.6	Confident	90	Very high	79 Å²	79	57.1 Å²	57.1	34%	0.343	28%	0.28	S	S	.	.	S	Bend	trans	-60.3	-32.8	174.5	-72.7	178.1	-175.7	177.7	0	112.5	G750 L751 K778 C779 N780	G750-K845 WeakPolarHBondContact O-CB 3.32Å; G750-K845 WeakPolarHBondContact O-CG 3.42Å; G750-K845 PolarHBondContact O-N 3.5Å; L751-K845 WeakPolarHBondContact O-CE 3.43Å; K778-K845 WeakPolarHBondContact O-CE 3.49Å; K778-K845 PolarHBondContact O-NZ 2.93Å; C779-K845 WeakPolarHBondContact O-CE 3.44Å; C779-K845 PolarHBondContact O-NZ 2.84Å; N780-K845 PolarHBondContact OD1-NZ 2.84Å
846	H	81.5	Confident	90.2	Very high	129 Å²	129	51.3 Å²	51.3	60%	0.597	25%	0.253	S	S	*	.	S	Bend	trans	-98.9	114.2	177.3	-59.1	-80.8	0	0	0	108.6	A844 Q848 T849	A844-H846 PolarHBondContact O-N 2.93Å; H846-Q848 PolarHBondContact O-N 2.81Å; H846-T849 WeakPolarHBondContact O-CB 3.43Å; H846-T849 PolarHBondContact O-N 2.73Å
847	Q	73.6	Confident	90.2	Very high	178 Å²	178	52 Å²	52	83%	0.832	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-5.9	-174	-62.2	-179.2	-6.6	0	0	115.4
848	Q	75.3	Confident	90.3	Very high	173 Å²	173	53.7 Å²	53.7	81%	0.808	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-23	174.5	-63.1	-174.8	-3.6	0	0	113	H846 M850	H846-Q848 PolarHBondContact O-N 2.81Å; Q848-M850 PolarHBondContact O-N 2.89Å
849	T	83.1	Confident	90.3	Very high	69 Å²	69	55.8 Å²	55.8	42%	0.423	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-73.1	121.5	177.9	-57.8	0	0	0	0	109.7	A844 H846	A844-T849 HydrophobicContact CB-CG2 3.91Å; H846-T849 WeakPolarHBondContact O-CB 3.43Å; H846-T849 PolarHBondContact O-N 2.73Å
850	M	87.4	Confident	90.2	Very high	40 Å²	40	52.4 Å²	52.4	20%	0.197	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-89.3	149.5	167.6	-55.8	-64.9	97.8	0	0	109.8	K652 Q848 V863 K864	K652-M850 HydrophobicContact CB-CE 4.16Å; K652-M850 HydrophobicContact CB-SD 3.6Å; K652-M850 VanDerWaalsContact CB-SD 3.6Å; K652-M850 HydrophobicContact CD-CE 3.82Å; K652-M850 HydrophobicContact CD-SD 4.22Å; Q848-M850 PolarHBondContact O-N 2.89Å; M850-V863 CarbonylContact C-O 3.56Å; M850-V863 WeakPolarHBondContact CA-O 3.42Å; M850-K864 HydrophobicContact CE-CB 4.46Å; M850-K864 HydrophobicContact SD-CB 4.32Å
851	L	90.4	Very high	89.9	Confident	8 Å²	8	56.2 Å²	56.2	4%	0.042	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	150.8	177.1	-57.6	179.6	0	0	0	111	V684 L751 A844 V853 V863 F866	V684-L851 HydrophobicContact CG1-CD2 4.46Å; L751-L851 HydrophobicContact CD2-CD1 4.47Å; L751-L851 HydrophobicContact CD2-CD2 3.59Å; A844-L851 HydrophobicContact CB-CD2 4.07Å; L851-V853 HydrophobicContact CB-CG2 4.01Å; L851-V863 HydrophobicContact CB-CB 4.33Å; L851-V863 PolarHBondContact N-O 2.68Å; L851-V863 PolarHBondContact O-N 3.05Å; L851-F866 HydrophobicContact CD1-CD1 4.1Å; L851-F866 HydrophobicContact CD1-CE1 4.01Å
852	R	91.8	Very high	89.5	Confident	114 Å²	114	57.1 Å²	57.1	43%	0.43	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	117.2	162.6	-178.3	174.5	78.7	134.6	-7.6	107.7	E859 W860 N861	R852-E859 VanDerWaalsContact CD-CD 3.44Å; R852-E859 WeakPolarHBondContact CD-OE1 3.45Å; R852-E859 WeakPolarHBondContact CD-OE2 2.91Å; R852-E859 HydrophobicContact CG-CG 3.75Å; R852-E859 IonicContact CZ-OE2 2.74Å; R852-E859 IonicContact NE-OE2 3.08Å; R852-E859 IonicContact NH1-OE2 3.88Å; R852-E859 PolarHBondContact NH1-OE2 2.93Å; R852-W860 WeakPolarHBondContact CA-O 3.3Å; R852-N861 WeakPolarHBondContact CD-OD1 3.49Å; R852-N861 VanDerWaalsContact CG-OD1 3.28Å; R852-N861 WeakPolarHBondContact CG-OD1 3.35Å
853	V	94.4	Very high	89.4	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	123.1	-172.6	-173	0	0	0	0	108.7	L649 V682 V684 L851 I855 W860 V863 F866	L649-V853 HydrophobicContact CD2-CG1 4.37Å; V682-V853 HydrophobicContact CG1-CG1 3.56Å; V684-V853 HydrophobicContact CG2-CG1 4.41Å; V684-V853 HydrophobicContact CG2-CG2 4.45Å; L851-V853 HydrophobicContact CB-CG2 4.01Å; V853-I855 HydrophobicContact CG1-CD1 4.44Å; V853-I855 HydrophobicContact CG1-CG1 4.05Å; V853-W860 PolarHBondContact N-O 3.08Å; V853-W860 WeakPolarHBondContact O-CB 3.41Å; V853-W860 PolarHBondContact O-N 2.93Å; V853-V863 HydrophobicContact CG2-CB 4.13Å; V853-V863 HydrophobicContact CG2-CG1 4.09Å; V853-V863 HydrophobicContact CG2-CG2 4.18Å; V853-F866 HydrophobicContact CG1-CD1 4.36Å; V853-F866 HydrophobicContact CG1-CE1 4.34Å; V853-F866 HydrophobicContact CG2-CD1 3.71Å; V853-F866 HydrophobicContact CG2-CE1 3.89Å
854	L	95.7	Very high	89.2	Confident	34 Å²	34	60 Å²	60	18%	0.178	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	116.4	177.6	-173.2	84.3	0	0	0	108.7	V682 K683 V687 V858 E859	V682-L854 CarbonylContact C-O 3.51Å; V682-L854 VanDerWaalsContact CA-O 3.29Å; V682-L854 WeakPolarHBondContact CA-O 3.32Å; K683-L854 HydrophobicContact CB-CB 4.16Å; K683-L854 HydrophobicContact CB-CD2 4.4Å; K683-L854 HydrophobicContact CD-CD2 4.3Å; K683-L854 PolarHBondContact N-O 3.41Å; K683-L854 PolarHBondContact O-N 3.43Å; V687-L854 HydrophobicContact CG1-CD2 4.36Å; L854-V858 CarbonylContact C-O 3.53Å; L854-V858 WeakPolarHBondContact CA-O 3.49Å; L854-E859 HydrophobicContact CD1-CB 4.13Å
855	I	96.4	Very high	89.4	Confident	0 Å²	0	62 Å²	62	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	116.4	179.8	-58.7	172.4	0	0	0	108.2	A647 L649 I676 F678 V682 V853 G857 V858	A647-I855 HydrophobicContact CB-CD1 3.72Å; L649-I855 HydrophobicContact CD1-CD1 3.97Å; L649-I855 HydrophobicContact CD2-CD1 4.03Å; L649-I855 HydrophobicContact CG-CD1 4.14Å; I676-I855 HydrophobicContact CD1-CD1 3.76Å; I676-I855 HydrophobicContact CG2-CG2 4.08Å; F678-I855 HydrophobicContact CB-CG2 3.64Å; F678-I855 HydrophobicContact CG-CG2 4.18Å; V682-I855 HydrophobicContact CG1-CG1 4.12Å; V682-I855 HydrophobicContact CG2-CG1 4.09Å; V682-I855 HydrophobicContact CG2-CG2 4.31Å; V853-I855 HydrophobicContact CG1-CD1 4.44Å; V853-I855 HydrophobicContact CG1-CG1 4.05Å; I855-G857 PolarHBondContact O-N 3.49Å; I855-G857 VanDerWaalsContact O-N 3.16Å; I855-V858 PolarHBondContact N-O 2.71Å; I855-V858 PolarHBondContact O-N 2.8Å
856	D	95.5	Very high	89.9	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	43.6	47.1	-175.7	-75.9	-7.6	0	0	0	112.9	Q549 H550 S553 F678 I679 G680 M681 V858	Q549-D856 CarbonylContact C-O 3.5Å; Q549-D856 HydrophobicContact CG-CB 4.38Å; Q549-D856 VanDerWaalsContact O-O 3.13Å; H550-D856 VanDerWaalsContact CA-O 3.3Å; H550-D856 WeakPolarHBondContact CA-O 3.27Å; H550-D856 PolarHBondContact N-O 2.97Å; S553-D856 WeakPolarHBondContact OG-CB 3.08Å; F678-D856 WeakPolarHBondContact CA-OD2 3.25Å; F678-D856 WeakPolarHBondContact CB-OD2 3.23Å; I679-D856 PolarHBondContact N-OD2 2.8Å; G680-D856 WeakPolarHBondContact CA-OD1 3.33Å; G680-D856 PolarHBondContact N-OD1 2.87Å; G680-D856 PolarHBondContact N-OD2 3.37Å; M681-D856 PolarHBondContact N-OD1 2.76Å; M681-D856 PolarHBondContact O-N 2.82Å; D856-V858 VanDerWaalsContact C-N 3.26Å; D856-V858 PolarHBondContact O-N 3.43Å
857	G	91.7	Very high	90.7	Very high	32 Å²	32	53.5 Å²	53.5	33%	0.33	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	-5.7	178.7	0	0	0	0	0	115.7	I855	I855-G857 PolarHBondContact O-N 3.49Å; I855-G857 VanDerWaalsContact O-N 3.16Å
858	V	93.7	Very high	91.8	Very high	35 Å²	35	45 Å²	45	21%	0.212	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	128	173.9	179.1	0	0	0	0	110.1	H550 R557 L854 I855 D856 W860	H550-V858 HydrophobicContact CB-CG2 3.88Å; R557-V858 VanDerWaalsContact NH2-CG2 3.31Å; L854-V858 CarbonylContact C-O 3.53Å; L854-V858 WeakPolarHBondContact CA-O 3.49Å; I855-V858 PolarHBondContact N-O 2.71Å; I855-V858 PolarHBondContact O-N 2.8Å; D856-V858 VanDerWaalsContact C-N 3.26Å; D856-V858 PolarHBondContact O-N 3.43Å; V858-W860 HydrophobicContact CG1-CZ2 4.04Å; V858-W860 VanDerWaalsContact O-CD1 3.3Å
859	E	93.6	Very high	92.8	Very high	87 Å²	87	37.9 Å²	37.9	41%	0.407	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	131.9	-179.4	-170.7	176.6	108.9	0	0	112.2	R852 L854 N861	R852-E859 VanDerWaalsContact CD-CD 3.44Å; R852-E859 WeakPolarHBondContact CD-OE1 3.45Å; R852-E859 WeakPolarHBondContact CD-OE2 2.91Å; R852-E859 HydrophobicContact CG-CG 3.75Å; R852-E859 IonicContact CZ-OE2 2.74Å; R852-E859 IonicContact NE-OE2 3.08Å; R852-E859 IonicContact NH1-OE2 3.88Å; R852-E859 PolarHBondContact NH1-OE2 2.93Å; L854-E859 HydrophobicContact CD1-CB 4.13Å; E859-N861 PolarHBondContact OE1-ND2 2.73Å
860	W	92.3	Very high	93.4	Very high	36 Å²	36	34.7 Å²	34.7	14%	0.136	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	122.6	176.2	-55.1	89.7	0	0	0	109.9	L649 K674 I676 R852 V853 V858 V863	L649-W860 HydrophobicContact CD1-CB 3.51Å; L649-W860 HydrophobicContact CD1-CD2 3.73Å; L649-W860 HydrophobicContact CD1-CE3 4.14Å; L649-W860 HydrophobicContact CD1-CG 3.45Å; L649-W860 VanDerWaalsContact CD1-CG 3.45Å; K674-W860 HydrophobicContact CD-CH2 4.27Å; K674-W860 HydrophobicContact CD-CZ3 3.98Å; I676-W860 HydrophobicContact CD1-CD2 3.9Å; I676-W860 VanDerWaalsContact CD1-CE2 3.42Å; I676-W860 HydrophobicContact CD1-CE3 4.3Å; I676-W860 HydrophobicContact CD1-CH2 3.84Å; I676-W860 HydrophobicContact CD1-CZ2 3.38Å; I676-W860 HydrophobicContact CD1-CZ3 4.28Å; I676-W860 HydrophobicContact CG1-CH2 4.29Å; I676-W860 HydrophobicContact CG1-CZ2 3.98Å; I676-W860 HydrophobicContact CG2-CZ2 4.42Å; R852-W860 WeakPolarHBondContact CA-O 3.3Å; V853-W860 PolarHBondContact N-O 3.08Å; V853-W860 WeakPolarHBondContact O-CB 3.41Å; V853-W860 PolarHBondContact O-N 2.93Å; V858-W860 HydrophobicContact CG1-CZ2 4.04Å; V858-W860 VanDerWaalsContact O-CD1 3.3Å; W860-V863 HydrophobicContact CB-CG2 4.24Å
861	N	90.8	Very high	93.7	Very high	81 Å²	81	36.6 Å²	36.6	43%	0.433	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	165.9	-174.9	-78.5	-64.8	0	0	0	112	Y651 R852 E859 V863	Y651-N861 VanDerWaalsContact CE1-O 3.29Å; Y651-N861 WeakPolarHBondContact CE1-O 3.46Å; R852-N861 WeakPolarHBondContact CD-OD1 3.49Å; R852-N861 VanDerWaalsContact CG-OD1 3.28Å; R852-N861 WeakPolarHBondContact CG-OD1 3.35Å; E859-N861 PolarHBondContact OE1-ND2 2.73Å; N861-V863 PolarHBondContact O-N 3.4Å
862	D	89.2	Confident	93.9	Very high	60 Å²	60	37.3 Å²	37.3	32%	0.321	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	59.5	25.4	-179.7	-83.8	-29.6	0	0	0	115.3	K654	K654-D862 WeakPolarHBondContact CE-OD1 3.46Å; K654-D862 WeakPolarHBondContact CE-OD2 3.22Å; K654-D862 IonicContact NZ-OD1 4Å; K654-D862 PolarHBondContact NZ-OD1 3.17Å; K654-D862 IonicContact NZ-OD2 2.68Å; K654-D862 PolarHBondContact NZ-OD2 3.22Å
863	V	91.4	Very high	93.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	121.3	178.3	178.4	0	0	0	0	110.4	L649 Y651 M850 L851 V853 W860 N861 F865 F866	L649-V863 HydrophobicContact CD1-CG2 4.17Å; L649-V863 HydrophobicContact CD2-CG1 4.11Å; L649-V863 HydrophobicContact CD2-CG2 4.3Å; Y651-V863 HydrophobicContact CD1-CG2 4.4Å; Y651-V863 HydrophobicContact CE1-CG2 3.86Å; M850-V863 CarbonylContact C-O 3.56Å; M850-V863 WeakPolarHBondContact CA-O 3.42Å; L851-V863 HydrophobicContact CB-CB 4.33Å; L851-V863 PolarHBondContact N-O 2.68Å; L851-V863 PolarHBondContact O-N 3.05Å; V853-V863 HydrophobicContact CG2-CB 4.13Å; V853-V863 HydrophobicContact CG2-CG1 4.09Å; V853-V863 HydrophobicContact CG2-CG2 4.18Å; W860-V863 HydrophobicContact CB-CG2 4.24Å; N861-V863 PolarHBondContact O-N 3.4Å; V863-F865 WeakPolarHBondContact CG1-O 3.45Å; V863-F866 HydrophobicContact CG1-CB 4.36Å
864	K	90.9	Very high	93.7	Very high	91 Å²	91	37.1 Å²	37.1	40%	0.396	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	-46.2	177	-177.2	-169.1	174.6	-173.4	0	111.4	T650 K652 M850	T650-K864 VanDerWaalsContact O-CB 3.32Å; T650-K864 WeakPolarHBondContact O-CB 3.34Å; T650-K864 PolarHBondContact O-N 2.8Å; K652-K864 HydrophobicContact CB-CB 4.43Å; M850-K864 HydrophobicContact CE-CB 4.46Å; M850-K864 HydrophobicContact SD-CB 4.32Å
865	F	93.6	Very high	93.6	Very high	57 Å²	57	38.5 Å²	38.5	25%	0.25	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	166.9	171.7	69.8	-89.7	0	0	0	108.8	M648 T650 I841 C842 A843 V863	M648-F865 HydrophobicContact CE-CE2 3.79Å; M648-F865 HydrophobicContact CE-CZ 4.38Å; T650-F865 HydrophobicContact CG2-CD1 4.31Å; T650-F865 HydrophobicContact CG2-CE1 3.64Å; T650-F865 HydrophobicContact CG2-CZ 3.95Å; T650-F865 PolarHBondContact N-O 3.39Å; T650-F865 VanDerWaalsContact OG1-CZ 3.25Å; T650-F865 WeakPolarHBondContact OG1-CZ 3.38Å; I841-F865 HydrophobicContact CG2-CD2 4.29Å; C842-F865 WeakPolarHBondContact O-CA 3.21Å; C842-F865 WeakPolarHBondContact O-CB 3.47Å; A843-F865 HydrophobicContact CB-CB 3.69Å; V863-F865 WeakPolarHBondContact CG1-O 3.45Å
866	F	96.4	Very high	93.6	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	154.5	171.5	64.7	-86.3	0	0	0	112.2	M648 L649 V682 V684 L784 L840 I841 C842 L851 V853 V863 L868	M648-F866 CarbonylContact O-C 3.59Å; M648-F866 VanDerWaalsContact O-CA 3.25Å; M648-F866 WeakPolarHBondContact O-CA 3.41Å; L649-F866 HydrophobicContact CD2-CB 3.47Å; L649-F866 VanDerWaalsContact CD2-CB 3.47Å; L649-F866 HydrophobicContact CD2-CG 4.3Å; V682-F866 HydrophobicContact CG1-CE2 4.1Å; V682-F866 HydrophobicContact CG1-CZ 4.45Å; V684-F866 HydrophobicContact CG2-CE1 3.58Å; V684-F866 HydrophobicContact CG2-CZ 3.52Å; L784-F866 HydrophobicContact CD2-CZ 4.42Å; L840-F866 HydrophobicContact CD2-CE2 4Å; I841-F866 CarbonylContact C-O 3.42Å; I841-F866 WeakPolarHBondContact CA-O 3.4Å; C842-F866 HydrophobicContact CB-CD1 4.1Å; C842-F866 HydrophobicContact CB-CD2 4.4Å; C842-F866 HydrophobicContact CB-CE1 3.53Å; C842-F866 HydrophobicContact CB-CE2 3.87Å; C842-F866 HydrophobicContact CB-CZ 3.41Å; C842-F866 VanDerWaalsContact CB-CZ 3.41Å; C842-F866 PolarHBondContact N-O 3.2Å; C842-F866 PolarHBondContact O-N 2.79Å; C842-F866 VanDerWaalsContact SG-CE1 3.54Å; L851-F866 HydrophobicContact CD1-CD1 4.1Å; L851-F866 HydrophobicContact CD1-CE1 4.01Å; V853-F866 HydrophobicContact CG1-CD1 4.36Å; V853-F866 HydrophobicContact CG1-CE1 4.34Å; V853-F866 HydrophobicContact CG2-CD1 3.71Å; V853-F866 HydrophobicContact CG2-CE1 3.89Å; V863-F866 HydrophobicContact CG1-CB 4.36Å; F866-L868 HydrophobicContact CD2-CD2 3.83Å; F866-L868 HydrophobicContact CD2-CG 3.92Å; F866-L868 HydrophobicContact CE2-CD1 4.08Å; F866-L868 HydrophobicContact CE2-CD2 4.15Å; F866-L868 HydrophobicContact CE2-CG 3.95Å
867	Q	97.1	Very high	93.5	Very high	29 Å²	29	41.1 Å²	41.1	14%	0.136	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	141.8	169.2	169.9	176.9	-72	0	0	109.4	A647 M648 R839 L840 I841	A647-Q867 CarbonylContact C-O 3.51Å; A647-Q867 WeakPolarHBondContact CA-O 3.37Å; M648-Q867 HydrophobicContact CB-CB 4.28Å; M648-Q867 HydrophobicContact CE-CB 3.97Å; M648-Q867 PolarHBondContact N-O 3.28Å; M648-Q867 PolarHBondContact O-N 3.01Å; R839-Q867 VanDerWaalsContact CZ-OE1 3.31Å; R839-Q867 VanDerWaalsContact NE-OE1 3.09Å; L840-Q867 CarbonylContact O-C 3.54Å; L840-Q867 VanDerWaalsContact O-CA 3.26Å; L840-Q867 WeakPolarHBondContact O-CA 3.2Å; I841-Q867 HydrophobicContact CG1-CB 4.13Å; I841-Q867 HydrophobicContact CG1-CG 4.1Å
868	L	97.9	Very high	93.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	140.4	168.1	-50.8	-178.8	0	0	0	109.8	E646 A647 F678 V682 V786 M802 R839 L840 F866	E646-L868 CarbonylContact O-C 3.53Å; E646-L868 VanDerWaalsContact O-CA 3.28Å; E646-L868 WeakPolarHBondContact O-CA 3.17Å; A647-L868 HydrophobicContact CB-CD2 3.52Å; F678-L868 HydrophobicContact CE1-CD2 4.03Å; F678-L868 HydrophobicContact CZ-CD1 4.36Å; F678-L868 HydrophobicContact CZ-CD2 4.27Å; V682-L868 HydrophobicContact CB-CD1 4.04Å; V682-L868 HydrophobicContact CB-CD2 4.44Å; V682-L868 HydrophobicContact CG1-CD1 4.36Å; V682-L868 HydrophobicContact CG1-CD2 4.35Å; V682-L868 HydrophobicContact CG2-CD1 4.02Å; V682-L868 HydrophobicContact CG2-CD2 3.83Å; V786-L868 HydrophobicContact CB-CD1 3.7Å; V786-L868 HydrophobicContact CG1-CD1 3.77Å; V786-L868 HydrophobicContact CG2-CD1 3.74Å; M802-L868 HydrophobicContact CE-CB 3.94Å; M802-L868 HydrophobicContact SD-CB 4.14Å; R839-L868 WeakPolarHBondContact CA-O 3.29Å; L840-L868 HydrophobicContact CB-CB 4.43Å; L840-L868 HydrophobicContact CD2-CD1 4.21Å; L840-L868 HydrophobicContact CD2-CG 4.25Å; L840-L868 PolarHBondContact N-O 2.79Å; L840-L868 PolarHBondContact O-N 2.8Å; F866-L868 HydrophobicContact CD2-CD2 3.83Å; F866-L868 HydrophobicContact CD2-CG 3.92Å; F866-L868 HydrophobicContact CE2-CD1 4.08Å; F866-L868 HydrophobicContact CE2-CD2 4.15Å; F866-L868 HydrophobicContact CE2-CG 3.95Å
869	A	96.4	Very high	93.9	Very high	23 Å²	23	41.6 Å²	41.6	19%	0.19	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	139.5	167	0	0	0	0	0	109.6	A645 E646 Q871	A645-A869 VanDerWaalsContact CB-O 3.28Å; A645-A869 WeakPolarHBondContact CB-O 3.2Å; E646-A869 HydrophobicContact CB-CB 4.42Å; E646-A869 PolarHBondContact N-O 3.37Å; E646-A869 PolarHBondContact O-N 3.32Å; A869-Q871 PolarHBondContact O-N 2.99Å
870	A	94.4	Very high	94	Very high	2 Å²	2	37.6 Å²	37.6	2%	0.017	19%	0.191	C	C	.	.	S	Bend	trans	-70	-0.5	-173.2	0	0	0	0	0	115	R788 P800 M802 S838	R788-A870 PolarHBondContact NE-O 2.79Å; R788-A870 PolarHBondContact NH2-O 2.94Å; R788-A870 VanDerWaalsContact NH2-O 3.14Å; P800-A870 HydrophobicContact CB-CB 4.1Å; P800-A870 VanDerWaalsContact O-CB 3.3Å; P800-A870 WeakPolarHBondContact O-CB 3.27Å; M802-A870 HydrophobicContact CE-CB 4.04Å; M802-A870 HydrophobicContact CG-CB 3.87Å; M802-A870 HydrophobicContact SD-CB 4.38Å; S838-A870 WeakPolarHBondContact O-CB 3.48Å; S838-A870 PolarHBondContact O-N 3.31Å
871	Q	94.5	Very high	94.2	Very high	80 Å²	80	35.9 Å²	35.9	37%	0.374	18%	0.184	S	C	.	.	S	Bend	trans	-145.8	140.4	178.7	-165.7	173.8	27.5	0	0	109.8	I644 P800 A869 K877	I644-Q871 CarbonylContact O-C 3.56Å; I644-Q871 VanDerWaalsContact O-CA 3.28Å; I644-Q871 WeakPolarHBondContact O-CA 3.16Å; P800-Q871 HydrophobicContact CB-CB 3.87Å; P800-Q871 HydrophobicContact CB-CG 4.48Å; P800-Q871 HydrophobicContact CG-CB 3.96Å; A869-Q871 PolarHBondContact O-N 2.99Å; Q871-K877 HydrophobicContact CG-CD 3.88Å
872	W	95.1	Very high	94.4	Very high	23 Å²	23	32 Å²	32	9%	0.087	16%	0.164	C	C	.	.			trans	-65.8	149.5	171.9	-172.5	-107.7	0	0	0	112.1	V560 I644 E646 F675 P677 S874 K877	V560-W872 HydrophobicContact CG1-CD2 4.19Å; V560-W872 VanDerWaalsContact CG1-CE2 3.42Å; V560-W872 HydrophobicContact CG1-CH2 4.49Å; V560-W872 HydrophobicContact CG1-CZ2 3.59Å; V560-W872 VanDerWaalsContact CG1-NE1 3.32Å; I644-W872 HydrophobicContact CB-CB 4.14Å; I644-W872 HydrophobicContact CG2-CB 3.95Å; I644-W872 HydrophobicContact CG2-CG 4.38Å; I644-W872 PolarHBondContact O-N 3.03Å; E646-W872 HydrophobicContact CB-CE3 3.7Å; E646-W872 HydrophobicContact CB-CZ3 4.08Å; E646-W872 HydrophobicContact CG-CE3 3.85Å; E646-W872 HydrophobicContact CG-CZ3 3.74Å; F675-W872 HydrophobicContact CB-CH2 4.14Å; P677-W872 HydrophobicContact CB-CD2 4.28Å; P677-W872 HydrophobicContact CB-CE3 3.8Å; P677-W872 HydrophobicContact CB-CH2 4.33Å; P677-W872 HydrophobicContact CB-CZ3 3.85Å; P677-W872 HydrophobicContact CG-CH2 4.41Å; P677-W872 HydrophobicContact CG-CZ3 4.33Å; P677-W872 VanDerWaalsContact N-CZ3 3.32Å; W872-S874 PolarHBondContact NE1-OG 3.48Å; W872-S874 VanDerWaalsContact NE1-OG 3.09Å; W872-K877 WeakPolarHBondContact O-CD 3.37Å; W872-K877 PolarHBondContact O-NZ 2.98Å
873	S	89.4	Confident	94.7	Very high	79 Å²	79	30 Å²	30	55%	0.552	15%	0.153	S	C	*	.	S	Bend	trans	-73	-48.5	-174.5	35.6	0	0	0	0	113.9	E646 K877	E646-S873 VanDerWaalsContact OE2-CB 3.26Å; E646-S873 WeakPolarHBondContact OE2-CB 3.31Å; E646-S873 PolarHBondContact OE2-OG 3.41Å; S873-K877 PolarHBondContact O-NZ 3.46Å
874	S	92.4	Very high	94.8	Very high	30 Å²	30	30.6 Å²	30.6	21%	0.21	16%	0.155	C	C	.	.	S	Bend	trans	-67.4	177.2	179.7	84.1	0	0	0	0	113.1	S564 W872 V876 K877	S564-S874 WeakPolarHBondContact OG-CB 3.27Å; S564-S874 PolarHBondContact OG-OG 3.39Å; W872-S874 PolarHBondContact NE1-OG 3.48Å; W872-S874 VanDerWaalsContact NE1-OG 3.09Å; S874-V876 PolarHBondContact O-N 3.01Å; S874-V876 VanDerWaalsContact O-N 3.13Å; S874-V876 PolarHBondContact OG-N 3.46Å; S874-K877 VanDerWaalsContact O-CD 3.24Å; S874-K877 WeakPolarHBondContact O-CD 3.44Å; S874-K877 WeakPolarHBondContact O-CE 3.5Å; S874-K877 PolarHBondContact O-NZ 3.11Å
875	H	92.7	Very high	94	Very high	63 Å²	63	27 Å²	27	29%	0.292	15%	0.145	S	C	.	.	S	Bend	trans	-64.5	-14	177.7	75.2	-98.4	0	0	0	113.8	L563 K566 K877	L563-H875 PolarHBondContact O-CE1 3.17Å; L563-H875 PolarHBondContact O-NE2 3.02Å; K566-H875 PolarHBondContact O-CE1 3.37Å; H875-K877 PolarHBondContact O-N 3.39Å
876	V	95.9	Very high	92.5	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.169	C	C	.	.			trans	-75.9	72.8	178.5	-170	0	0	0	0	109.9	F559 V560 L563 L571 I644 S874	F559-V876 HydrophobicContact CD1-CG1 4Å; F559-V876 HydrophobicContact CE1-CG1 3.46Å; F559-V876 VanDerWaalsContact CE1-CG1 3.46Å; F559-V876 HydrophobicContact CZ-CG1 4.24Å; V560-V876 HydrophobicContact CG2-CG1 4.04Å; L563-V876 HydrophobicContact CB-CG2 4.13Å; L571-V876 HydrophobicContact CD2-CB 4.44Å; L571-V876 HydrophobicContact CD2-CG1 3.86Å; L571-V876 HydrophobicContact CD2-CG2 4.25Å; I644-V876 HydrophobicContact CD1-CG1 4.05Å; S874-V876 PolarHBondContact O-N 3.01Å; S874-V876 VanDerWaalsContact O-N 3.13Å; S874-V876 PolarHBondContact OG-N 3.46Å
877	K	94.9	Very high	89.9	Confident	55 Å²	55	36.8 Å²	36.8	24%	0.239	20%	0.198	C	C	.	.			trans	-79.3	-22.6	-175.8	-57.1	-47.2	-168.4	-167.6	0	114.2	I644 Q871 W872 S873 S874 H875	I644-K877 PolarHBondContact N-O 2.96Å; Q871-K877 HydrophobicContact CG-CD 3.88Å; W872-K877 WeakPolarHBondContact O-CD 3.37Å; W872-K877 PolarHBondContact O-NZ 2.98Å; S873-K877 PolarHBondContact O-NZ 3.46Å; S874-K877 VanDerWaalsContact O-CD 3.24Å; S874-K877 WeakPolarHBondContact O-CD 3.44Å; S874-K877 WeakPolarHBondContact O-CE 3.5Å; S874-K877 PolarHBondContact O-NZ 3.11Å; H875-K877 PolarHBondContact O-N 3.39Å
878	H	95.5	Very high	87.1	Confident	77 Å²	77	45.2 Å²	45.2	36%	0.356	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	151.2	-171.7	-55.8	102.3	0	0	0	111.9	Q641 L642	Q641-H878 HydrophobicContact CB-CB 3.89Å; Q641-H878 VanDerWaalsContact OE1-CB 3.32Å; L642-H878 CarbonylContact O-C 3.58Å; L642-H878 VanDerWaalsContact O-CA 3.3Å; L642-H878 WeakPolarHBondContact O-CA 3.41Å
879	F	97.2	Very high	83.9	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	114.3	173.3	-173.3	-111.1	0	0	0	108.5	L552 L556 F559 F576 L642 I644 I679 V881	L552-F879 HydrophobicContact CD1-CE1 3.95Å; L552-F879 HydrophobicContact CD1-CZ 4.06Å; L556-F879 HydrophobicContact CD1-CB 4.06Å; L556-F879 HydrophobicContact CD1-CD2 3.56Å; L556-F879 HydrophobicContact CD1-CE2 4.12Å; L556-F879 HydrophobicContact CD1-CG 3.85Å; F559-F879 HydrophobicContact CB-CE2 4.22Å; F559-F879 AromaticContact CD1-CD2 3.64Å; F559-F879 HydrophobicContact CD1-CD2 3.64Å; F559-F879 HydrophobicContact CD1-CE2 4.12Å; F559-F879 AromaticContact CE1-CD2 3.84Å; F559-F879 HydrophobicContact CE1-CD2 3.84Å; F559-F879 HydrophobicContact CG-CD2 4.04Å; F559-F879 HydrophobicContact CG-CE2 4.06Å; F559-F879 HydrophobicContact CZ-CD2 4.4Å; F576-F879 HydrophobicContact CB-CE1 3.72Å; F576-F879 HydrophobicContact CB-CE2 4.49Å; F576-F879 HydrophobicContact CB-CZ 3.63Å; F576-F879 HydrophobicContact CD1-CE2 4.16Å; F576-F879 AromaticContact CD1-CZ 3.71Å; F576-F879 HydrophobicContact CD1-CZ 3.71Å; F576-F879 HydrophobicContact CD2-CD2 4.11Å; F576-F879 HydrophobicContact CD2-CE1 4.11Å; F576-F879 AromaticContact CD2-CE2 3.48Å; F576-F879 HydrophobicContact CD2-CE2 3.48Å; F576-F879 VanDerWaalsContact CD2-CE2 3.48Å; F576-F879 AromaticContact CD2-CZ 3.49Å; F576-F879 HydrophobicContact CD2-CZ 3.49Å; F576-F879 VanDerWaalsContact CD2-CZ 3.49Å; F576-F879 HydrophobicContact CE1-CE2 4.27Å; F576-F879 HydrophobicContact CE1-CZ 4.24Å; F576-F879 HydrophobicContact CE2-CD2 4.26Å; F576-F879 AromaticContact CE2-CE2 3.63Å; F576-F879 HydrophobicContact CE2-CE2 3.63Å; F576-F879 HydrophobicContact CE2-CZ 4.07Å; F576-F879 AromaticContact CG-CE1 3.9Å; F576-F879 HydrophobicContact CG-CE1 3.9Å; F576-F879 AromaticContact CG-CE2 3.77Å; F576-F879 HydrophobicContact CG-CE2 3.77Å; F576-F879 AromaticContact CG-CZ 3.29Å; F576-F879 HydrophobicContact CG-CZ 3.29Å; F576-F879 HydrophobicContact CZ-CE2 4.03Å; F576-F879 HydrophobicContact CZ-CZ 4.41Å; L642-F879 HydrophobicContact CB-CB 4.36Å; L642-F879 PolarHBondContact N-O 3.43Å; L642-F879 PolarHBondContact O-N 2.81Å; I644-F879 HydrophobicContact CD1-CB 4.08Å; I644-F879 HydrophobicContact CG1-CB 4.06Å; I679-F879 HydrophobicContact CD1-CD1 3.86Å; I679-F879 HydrophobicContact CD1-CE1 4.31Å; I679-F879 HydrophobicContact CD1-CG 4.46Å; I679-F879 HydrophobicContact CG2-CB 4.28Å; F879-V881 HydrophobicContact CD1-CG2 3.58Å; F879-V881 HydrophobicContact CE1-CG2 3.91Å; F879-V881 PolarHBondContact O-N 2.87Å
880	P	96.1	Very high	80.8	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.019	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	93.7	-170.2	30.4	-34.6	0	0	0	111	F559 M574 F576	F559-P880 HydrophobicContact CE2-CG 4.27Å; F559-P880 VanDerWaalsContact CZ-CD 3.42Å; F559-P880 HydrophobicContact CZ-CG 4.13Å; M574-P880 VanDerWaalsContact O-CG 3.28Å; M574-P880 WeakPolarHBondContact O-CG 3.45Å; F576-P880 HydrophobicContact CD2-CG 4.11Å; F576-P880 HydrophobicContact CE2-CG 4.27Å; F576-P880 PolarHBondContact N-O 3.03Å
881	V	96.7	Very high	77.9	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	131.1	178.5	177.8	0	0	0	0	110.6	F576 I578 L590 A639 H640 L642 F879	F576-V881 CarbonylContact O-C 3.57Å; F576-V881 WeakPolarHBondContact O-CA 3.45Å; I578-V881 HydrophobicContact CD1-CG1 4.06Å; I578-V881 HydrophobicContact CD1-CG2 3.87Å; I578-V881 HydrophobicContact CG1-CG1 4.43Å; L590-V881 HydrophobicContact CD1-CG1 3.9Å; L590-V881 HydrophobicContact CD2-CG1 3.93Å; A639-V881 CarbonylContact C-O 3.33Å; A639-V881 WeakPolarHBondContact CA-O 3.28Å; H640-V881 PolarHBondContact N-O 2.93Å; H640-V881 PolarHBondContact O-N 2.89Å; L642-V881 HydrophobicContact CB-CG2 4.47Å; L642-V881 HydrophobicContact CD1-CB 4.47Å; L642-V881 HydrophobicContact CD1-CG2 3.54Å; L642-V881 HydrophobicContact CG-CG2 3.95Å; F879-V881 HydrophobicContact CD1-CG2 3.58Å; F879-V881 HydrophobicContact CE1-CG2 3.91Å; F879-V881 PolarHBondContact O-N 2.87Å
882	G	95.7	Very high	77.1	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	129.3	174.3	0	0	0	0	0	112.1	R575 F576 Y632 G638	R575-G882 VanDerWaalsContact CG-CA 3.46Å; F576-G882 PolarHBondContact O-N 3.16Å; Y632-G882 PolarHBondContact OH-O 2.94Å; G638-G882 WeakPolarHBondContact O-CA 3.37Å
883	I	95.1	Very high	76.1	Confident	19 Å²	19	68.5 Å²	68.5	10%	0.097	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	158.3	173.9	58.7	164.1	0	0	0	109.1	L590 D594 A636 N637 G638 H640 G885	L590-I883 HydrophobicContact CD2-CG2 4.34Å; D594-I883 WeakPolarHBondContact OD2-CB 3.36Å; A636-I883 CarbonylContact C-O 3.56Å; A636-I883 VanDerWaalsContact CA-O 3.31Å; A636-I883 WeakPolarHBondContact CA-O 3.36Å; N637-I883 PolarHBondContact N-O 2.93Å; G638-I883 WeakPolarHBondContact CA-O 3.42Å; G638-I883 PolarHBondContact N-O 3.22Å; G638-I883 PolarHBondContact O-N 3.35Å; H640-I883 HydrophobicContact CB-CD1 4.08Å; H640-I883 HydrophobicContact CB-CG1 4.25Å; H640-I883 HydrophobicContact CB-CG2 3.8Å; I883-G885 PolarHBondContact O-N 3.13Å; I883-G885 VanDerWaalsContact O-N 3.15Å
884	F	93.6	Very high	75.4	Confident	11 Å²	11	67.9 Å²	67.9	5%	0.048	34%	0.343	C	S	.	.			trans	-63.7	-14.3	171.7	-76.9	-79.6	0	0	0	113.4	D594 R596 L600 Q631 Y632	D594-F884 WeakPolarHBondContact OD2-CB 3.5Å; D594-F884 WeakPolarHBondContact OD2-CD2 3.47Å; D594-F884 PolarHBondContact OD2-N 2.63Å; R596-F884 HydrophobicContact CB-CB 4.05Å; R596-F884 HydrophobicContact CB-CD1 4.21Å; R596-F884 HydrophobicContact CB-CD2 3.45Å; R596-F884 VanDerWaalsContact CB-CD2 3.45Å; R596-F884 HydrophobicContact CB-CE2 3.84Å; R596-F884 HydrophobicContact CB-CG 3.65Å; R596-F884 HydrophobicContact CB-CZ 4.36Å; R596-F884 HydrophobicContact CG-CG 4.45Å; R596-F884 PolarHBondContact NH2-O 2.87Å; L600-F884 HydrophobicContact CD1-CE2 3.74Å; L600-F884 HydrophobicContact CD1-CZ 3.53Å; Q631-F884 HydrophobicContact CG-CE1 4.46Å; Q631-F884 HydrophobicContact CG-CZ 4.48Å; Q631-F884 VanDerWaalsContact O-CE1 3.3Å; Q631-F884 WeakPolarHBondContact O-CE1 3.39Å; Y632-F884 HydrophobicContact CD2-CD2 4.22Å; Y632-F884 AromaticContact CD2-CE2 3.58Å; Y632-F884 HydrophobicContact CD2-CE2 3.58Å; Y632-F884 AromaticContact CD2-CZ 3.93Å; Y632-F884 HydrophobicContact CD2-CZ 3.93Å; Y632-F884 HydrophobicContact CE2-CE2 4.33Å; Y632-F884 HydrophobicContact CG-CE2 4.41Å
885	G	74	Confident	74.4	Confident	17 Å²	17	70.1 Å²	70.1	18%	0.175	35%	0.35	C	S	.	.			trans	73.7	158.3	-175.8	0	0	0	0	0	112.2	I883 T887	I883-G885 PolarHBondContact O-N 3.13Å; I883-G885 VanDerWaalsContact O-N 3.15Å; G885-T887 PolarHBondContact O-N 3.28Å
886	H	60.8	Low	73.2	Confident	162 Å²	162	70.6 Å²	70.6	75%	0.75	35%	0.354	S	S	*	.			trans	-67.9	125.7	160.5	-56.1	-15.9	0	0	0	107.2	K888	H886-K888 PolarHBondContact O-N 3.33Å
887	T	42.1	Very low	71.7	Confident	99 Å²	99	75.3 Å²	75.3	61%	0.607	38%	0.378	S	S	*	.			trans	-54	123.1	160.4	43.8	0	0	0	0	107.4	G885 G889	G885-T887 PolarHBondContact O-N 3.28Å; T887-G889 PolarHBondContact O-N 3Å
888	K	38.3	Very low	70.1	Confident	207 Å²	207	76.7 Å²	76.7	90%	0.9	39%	0.388	S	S	*	.			trans	-57.1	110.6	156.3	-74.8	-172.2	175.1	-173.2	0	105.7	H886	H886-K888 PolarHBondContact O-N 3.33Å
889	G	31.5	Very low	68.1	Low	36 Å²	36	76.7 Å²	76.7	37%	0.371	39%	0.39	S	S	.	.			trans	-59.2	153.3	165.9	0	0	0	0	0	108.9	T887 Y891	T887-G889 PolarHBondContact O-N 3Å; G889-Y891 PolarHBondContact O-N 3.45Å; G889-Y891 VanDerWaalsContact O-N 3.09Å
890	P	31.4	Very low	65.7	Low	141 Å²	141	83.1 Å²	83.1	92%	0.916	42%	0.422	S	S	*	.			trans	-59.5	117.9	176.1	25.7	-33.2	0	0	0	109.6
891	Y	33	Very low	62.9	Low	302 Å²	302	90.4 Å²	90.4	100%	1.184	46%	0.459	S	S	*	.			trans	-138.6	0	171.5	-81.7	-71.6	0	0	0	106.6	G889	G889-Y891 PolarHBondContact O-N 3.45Å; G889-Y891 VanDerWaalsContact O-N 3.09Å

Retrieved 891 of 891 residues in 152.3 ms (Link to these results)

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