A0A077Z3W2_TRITR Loading...

Integrin alpha pat 2 AlphaSync

AlphaFold DB , UniProt , Accession A0A077Z3W2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,131 aa.

						>A0A077Z3W2_TRITR|A0A077Z3W2
MKSDFTLIQQNLLYRMEKCEEGKSLESKKEQTTFQPWPIPSPTLLVGAPRAQTGQPGVRNGGAVYRCEPEDQRCTKIFFDTAGHGRALNGSVLLQIDSKSDQWFGATVVSSKNGDSVLACAPRYTYFYSTFERKEPVGTCYLAQNSFNSFREFSPCRMETRWGYHRLGFCMAGFSAAISDENNKLFIGAPGAWYWQGALIVQGTDREDNVQRTSEGPAPLDDIYLGYSIAAGNFRGGSGNDVAIGAPKGGDLSGMDLLYSKVALFDDHANVLVNITGQQVGSYFGAALAVDDLNNDGLDDLIIGAPLYSLRXNEESEENSVQSEYEVGAVYVYFQNKQHKFPRHTKLVGHKEWSRFGHDVATTGDLNGDGYNDFIVGAPFDGPSKKGAVYIYHGSKKGVNEKFSQVIHAREVDPTLTTFGWSISGGIDVDGNEYPGMISLVRFFNRPVTFQLADIFVGAYKSDRAVLFKYFKSKLFTIHGLNESRPVVSVSGFVKANPDVINLENKFCRLMKSENVPWCVLKVLFPLHKLSRVCRTNFVSIDNQRNQNLIISNADFRLIINLDAKKGLSSRARFLESHSITQLTLDSVSIRKGERWCERRYIYVIDDIRDKLNPIVIQVNYSISDDAFPYQQLRPVKDAYMPGVITGEVNIQKDCGRDNICIPDLRMTAQLNKEAILIGADDRFNVSITIHNGLEDAFEAQFFVIAPIGLDYEGFTRQLPIRTITCSQPKEFNETSYVISCDIGNPLPRATTVRFNLQFSTENVDNIVGGISLHLITNSTNNESASTLSDNEVTIDIPMEVKADFIVTGVSRNETYDYEFSEYRKDIVFDSDAGPLVSHVYEIRNLGPTMLSEVSVDIYWPSFFRDNFKPLLYLTDDIHSEGKVTCDLLQKGHLNPEGLTIMPSTQEQGGNSHRFKRNTLNANMHRYEEKSYLMKALRDAVAMMKDTANDFRNTIGQMRIALQRIKVDCTEMACTQWRCKINDFKRDERVLLKIDARLWINTLIEEVFYDAMISSVAIAEVTKLPYKHPDITLPLRYAVVSTIVNPSDPTRIGRGVPGWLIFVAVLAGLACLILLIMLLWKFGFFKRKRPPRGQALLSKPPEAEYYGYSTYSSTQPGGFVTYGNPQYRQNT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	36.9	Very low	39.3	Very low	96 Å²	96	26.5 Å²	26.5	47%	0.473	14%	0.136	S	C	.	.				0	-41.3	0	-78.3	-176.5	179.8	0	0	111.9	S3 Y227 R355 W421	M1-S3 PolarHBondContact O-N 2.91Å; M1-Y227 WeakPolarHBondContact CA-OH 3.42Å; M1-Y227 WeakPolarHBondContact CB-OH 3.35Å; M1-Y227 PolarHBondContact N-OH 2.65Å; M1-R355 PolarHBondContact SD-NH1 3.46Å; M1-R355 VanDerWaalsContact SD-NH1 3.38Å; M1-W421 WeakPolarHBondContact O-CZ2 3.22Å
2	K	39.4	Very low	38.2	Very low	49 Å²	49	28.1 Å²	28.1	21%	0.213	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-62.5	-9.3	-178.2	-89.1	-167.8	166.4	-159.2	0	118.8	D4 F174 Y227 A286 D359	K2-D4 PolarHBondContact O-N 3Å; K2-F174 HydrophobicContact CB-CE1 4.4Å; K2-F174 HydrophobicContact CB-CZ 4.45Å; K2-Y227 HydrophobicContact CB-CE1 4.47Å; K2-Y227 HydrophobicContact CG-CE1 4.28Å; K2-A286 WeakPolarHBondContact CE-O 3.48Å; K2-D359 WeakPolarHBondContact CE-OD1 3.3Å; K2-D359 IonicContact NZ-OD1 3.99Å; K2-D359 PolarHBondContact NZ-OD1 2.55Å
3	S	36	Very low	37.4	Very low	18 Å²	18	34.2 Å²	34.2	13%	0.126	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-90.1	7.8	-155.5	49.4	0	0	0	0	117.1	M1 W103 A106	M1-S3 PolarHBondContact O-N 2.91Å; S3-W103 VanDerWaalsContact CB-CE3 3.44Å; S3-W103 WeakPolarHBondContact O-CZ3 3.32Å; S3-W103 WeakPolarHBondContact OG-CZ3 3.44Å; S3-A106 VanDerWaalsContact O-CB 3.31Å; S3-A106 WeakPolarHBondContact O-CB 3.46Å
4	D	39.2	Very low	36.5	Very low	29 Å²	29	44.9 Å²	44.9	16%	0.155	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-98.5	-6.9	-174	-78.7	-53.8	0	0	0	116.6	K2 R50 W103 Y460	K2-D4 PolarHBondContact O-N 3Å; D4-R50 IonicContact OD1-CZ 3.77Å; D4-R50 IonicContact OD1-NE 3.92Å; D4-R50 PolarHBondContact OD1-NE 2.95Å; D4-R50 IonicContact OD1-NH2 3.69Å; D4-R50 PolarHBondContact OD1-NH2 3.46Å; D4-R50 IonicContact OD2-NH2 2.69Å; D4-W103 WeakPolarHBondContact OD1-CH2 3.37Å; D4-W103 WeakPolarHBondContact OD1-CZ2 3.16Å; D4-W103 WeakPolarHBondContact OD1-CZ3 3.43Å; D4-Y460 HydrophobicContact CB-CD2 3.64Å; D4-Y460 HydrophobicContact CB-CE2 3.91Å; D4-Y460 HydrophobicContact CB-CG 4.03Å
5	F	39.1	Very low	35.8	Very low	17 Å²	17	57.3 Å²	57.3	8%	0.075	26%	0.26	C	S	.	.			trans	-172.6	134.2	168.7	-137.2	-104.5	0	0	0	110.7	L7 V46 S422 Y460	F5-L7 HydrophobicContact CD1-CD2 3.98Å; F5-L7 HydrophobicContact CE1-CD2 4.01Å; F5-V46 HydrophobicContact CD1-CG1 4.17Å; F5-V46 HydrophobicContact CE1-CG1 3.33Å; F5-V46 HydrophobicContact CZ-CG1 3.69Å; F5-S422 WeakPolarHBondContact O-CB 3.41Å; F5-S422 PolarHBondContact O-OG 2.68Å; F5-S422 VanDerWaalsContact O-OG 3.08Å; F5-Y460 VanDerWaalsContact CB-CB 3.46Å
6	T	49.2	Very low	35.1	Very low	26 Å²	26	64.8 Å²	64.8	16%	0.16	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	138.9	178	-42.2	0	0	0	0	110.5	G47 A106	T6-G47 PolarHBondContact O-N 3.07Å; T6-A106 PolarHBondContact OG1-O 2.99Å
7	L	42.3	Very low	34.6	Very low	10 Å²	10	71.4 Å²	71.4	5%	0.052	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	143.3	179.5	-62	-175.4	0	0	0	110.2	F5 V46 F456 G458 A465	F5-L7 HydrophobicContact CD1-CD2 3.98Å; F5-L7 HydrophobicContact CE1-CD2 4.01Å; L7-V46 HydrophobicContact CD2-CB 4.27Å; L7-V46 HydrophobicContact CD2-CG1 3.86Å; L7-V46 HydrophobicContact CD2-CG2 3.91Å; L7-F456 HydrophobicContact CB-CD1 3.59Å; L7-F456 HydrophobicContact CB-CE1 3.85Å; L7-F456 HydrophobicContact CB-CG 4.45Å; L7-F456 HydrophobicContact CD1-CD1 3.72Å; L7-F456 HydrophobicContact CD1-CD2 4.31Å; L7-F456 HydrophobicContact CD1-CE1 3.92Å; L7-F456 HydrophobicContact CD1-CE2 4.48Å; L7-F456 HydrophobicContact CD1-CG 3.91Å; L7-F456 HydrophobicContact CD1-CZ 4.29Å; L7-F456 HydrophobicContact CD2-CD1 4.06Å; L7-F456 HydrophobicContact CD2-CE1 3.48Å; L7-F456 VanDerWaalsContact CD2-CE1 3.48Å; L7-F456 HydrophobicContact CD2-CZ 3.85Å; L7-F456 HydrophobicContact CG-CD1 3.99Å; L7-F456 HydrophobicContact CG-CE1 3.94Å; L7-G458 VanDerWaalsContact CD1-CA 3.41Å; L7-A465 HydrophobicContact CD1-CB 3.91Å; L7-A465 HydrophobicContact CD2-CB 3.59Å; L7-A465 HydrophobicContact CG-CB 4.44Å
8	I	49	Very low	34.2	Very low	17 Å²	17	78.7 Å²	78.7	9%	0.087	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	151.4	166.7	-27.5	164.3	0	0	0	110.5	L45 V108 V109	I8-L45 HydrophobicContact CB-CB 4.45Å; I8-L45 HydrophobicContact CD1-CB 4.35Å; I8-L45 HydrophobicContact CD1-CD1 4.15Å; I8-L45 PolarHBondContact N-O 3.37Å; I8-L45 PolarHBondContact O-N 3.47Å; I8-V108 HydrophobicContact CD1-CB 3.53Å; I8-V108 HydrophobicContact CD1-CG1 3.42Å; I8-V108 VanDerWaalsContact CD1-CG1 3.42Å; I8-V108 WeakPolarHBondContact CD1-O 3.43Å; I8-V108 HydrophobicContact CG1-CB 3.86Å; I8-V108 HydrophobicContact CG1-CG1 4.22Å; I8-V108 WeakPolarHBondContact CG1-O 3.34Å; I8-V109 VanDerWaalsContact CD1-C 3.48Å; I8-V109 VanDerWaalsContact CD1-N 3.26Å
9	Q	37.4	Very low	33.7	Very low	0 Å²	0	80.9 Å²	80.9	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	141.7	160.9	-64.3	167	-30.8	0	0	110.3	L44 S110 S424 I427 V429 D454 F456	Q9-L44 HydrophobicContact CB-CD2 4.28Å; Q9-L44 HydrophobicContact CG-CD2 3.6Å; Q9-S110 PolarHBondContact O-OG 3.15Å; Q9-S424 PolarHBondContact N-OG 2.72Å; Q9-I427 HydrophobicContact CB-CB 3.87Å; Q9-I427 HydrophobicContact CB-CD1 3.88Å; Q9-I427 HydrophobicContact CB-CG1 4.35Å; Q9-I427 HydrophobicContact CB-CG2 4.26Å; Q9-I427 VanDerWaalsContact O-CD1 3.26Å; Q9-I427 WeakPolarHBondContact O-CD1 3.46Å; Q9-V429 HydrophobicContact CB-CG2 4.35Å; Q9-V429 HydrophobicContact CG-CG2 3.94Å; Q9-D454 PolarHBondContact NE2-O 3.42Å; Q9-D454 PolarHBondContact OE1-O 3.33Å; Q9-F456 HydrophobicContact CG-CB 4.42Å
10	Q	31.8	Very low	33.6	Very low	4 Å²	4	86.7 Å²	86.7	2%	0.019	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	127.5	178.8	-174.3	-175.2	4.1	0	0	111.2	P42 T43 L45 G114 V117	Q10-P42 VanDerWaalsContact O-CB 3.29Å; Q10-P42 WeakPolarHBondContact O-CB 3.41Å; Q10-T43 WeakPolarHBondContact CB-O 3.43Å; Q10-T43 PolarHBondContact N-O 3.24Å; Q10-T43 PolarHBondContact O-N 2.65Å; Q10-L45 HydrophobicContact CB-CD1 4.44Å; Q10-G114 PolarHBondContact NE2-O 2.9Å; Q10-V117 VanDerWaalsContact NE2-CG2 3.3Å
11	N	31.8	Very low	33.6	Very low	26 Å²	26	92 Å²	92	14%	0.139	44%	0.435	C	S	.	.			trans	-80.2	133.1	168.8	-86.9	-27.7	0	0	0	110.7	G114 I427	N11-G114 WeakPolarHBondContact O-CA 3.16Å; N11-I427 VanDerWaalsContact OD1-CG2 3.31Å; N11-I427 WeakPolarHBondContact OD1-CG2 3.24Å
12	L	26.9	Very low	33.4	Very low	45 Å²	45	90.6 Å²	90.6	24%	0.236	45%	0.445	C	S	.	.			trans	-105.6	92.1	167.5	-79.7	161.6	0	0	0	108
13	L	26.8	Very low	33.1	Very low	108 Å²	108	98.3 Å²	98.3	57%	0.565	48%	0.479	S	S	*	.			trans	-97.9	107.7	177.5	-129.9	137	0	0	0	109.7	R15	L13-R15 PolarHBondContact O-N 2.78Å
14	Y	25.7	Very low	33	Very low	184 Å²	184	102.6 Å²	102.6	72%	0.722	51%	0.509	S	S	*	.			trans	-69.1	123.6	174.7	-100.7	-91.6	0	0	0	110.7	M16	Y14-M16 PolarHBondContact O-N 3.31Å; Y14-M16 VanDerWaalsContact O-N 3.14Å
15	R	25.3	Very low	32.8	Very low	231 Å²	231	108.8 Å²	108.8	87%	0.872	54%	0.541	S	S	*	.			trans	-67.1	104.7	168.7	-168.9	179.9	-163.7	-179	5.2	109	L13 E17	L13-R15 PolarHBondContact O-N 2.78Å; R15-E17 PolarHBondContact O-N 3.22Å
16	M	24.6	Very low	32.7	Very low	177 Å²	177	115.9 Å²	115.9	87%	0.872	57%	0.574	S	S	*	*			trans	-71.1	112.9	163.3	-64.2	-149.5	-35.4	0	0	108.5	Y14 K18	Y14-M16 PolarHBondContact O-N 3.31Å; Y14-M16 VanDerWaalsContact O-N 3.14Å; M16-K18 PolarHBondContact O-N 3.44Å
17	E	26.3	Very low	31.9	Very low	177 Å²	177	120 Å²	120	83%	0.827	60%	0.604	S	S	*	*			trans	-58.8	128.4	165.9	-76.9	-178.7	150.4	0	0	109.2	R15 C19	R15-E17 PolarHBondContact O-N 3.22Å; E17-C19 PolarHBondContact O-N 3.46Å; E17-C19 VanDerWaalsContact O-N 3.07Å
18	K	27.1	Very low	31.6	Very low	202 Å²	202	129.2 Å²	129.2	88%	0.878	64%	0.644	S	S	*	*			trans	-56.6	113.4	169.7	-91.3	179.7	172.1	178	0	108.3	M16 E20	M16-K18 PolarHBondContact O-N 3.44Å; K18-E20 PolarHBondContact O-N 2.92Å
19	C	26.2	Very low	30.8	Very low	122 Å²	122	139 Å²	139	82%	0.824	69%	0.686	S	S	*	*			trans	-65.6	115.3	157	-73.3	0	0	0	0	107.6	E17 E21	E17-C19 PolarHBondContact O-N 3.46Å; E17-C19 VanDerWaalsContact O-N 3.07Å; C19-E21 PolarHBondContact O-N 2.75Å
20	E	31	Very low	30.8	Very low	195 Å²	195	147.2 Å²	147.2	91%	0.911	72%	0.724	S	S	*	*			trans	-62.6	110.7	166.8	-72.4	-176.5	147.7	0	0	109	K18 G22	K18-E20 PolarHBondContact O-N 2.92Å; E20-G22 PolarHBondContact O-N 2.8Å
21	E	33.3	Very low	30.6	Very low	198 Å²	198	156.6 Å²	156.6	93%	0.925	77%	0.768	S	S	*	*			trans	-76.3	117.4	167.2	-79.1	-175.8	155.8	0	0	109.7	C19	C19-E21 PolarHBondContact O-N 2.75Å
22	G	32.1	Very low	30.6	Very low	67 Å²	67	160.7 Å²	160.7	69%	0.691	79%	0.794	S	S	*	*			trans	143.7	87.3	153.2	0	0	0	0	0	116	E20	E20-G22 PolarHBondContact O-N 2.8Å
23	K	34.4	Very low	30.8	Very low	212 Å²	212	165.3 Å²	165.3	92%	0.922	82%	0.824	S	S	*	*				-170	131.2	118.5	-100.1	165.3	-171.7	-179.3	0	111.4
24	S	32.8	Very low	30.9	Very low	108 Å²	108	169.5 Å²	169.5	76%	0.755	84%	0.838	S	S	*	*			trans	-55.4	140.8	-175.1	54.2	0	0	0	0	115.8
25	L	35.3	Very low	31	Very low	158 Å²	158	168.9 Å²	168.9	83%	0.827	84%	0.842	S	S	*	*			trans	-165.3	107.9	131.7	-110.4	135.2	0	0	0	111.7
26	E	36.9	Very low	31.3	Very low	167 Å²	167	163.2 Å²	163.2	78%	0.78	84%	0.835	S	S	*	*			trans	24.1	122.1	145.2	-66.2	172.8	153.2	0	0	121.9
27	S	32.6	Very low	31.3	Very low	111 Å²	111	165.9 Å²	165.9	78%	0.776	84%	0.835	S	S	*	*			trans	75.2	94.8	134.7	73.2	0	0	0	0	119.6
28	K	36.9	Very low	31.6	Very low	204 Å²	204	162.9 Å²	162.9	89%	0.887	83%	0.832	S	S	*	*				-161.4	119.9	129.4	-106.9	171.9	-174.6	-177.5	0	108.8	E30	K28-E30 PolarHBondContact O-N 2.93Å; K28-E30 VanDerWaalsContact O-N 3.16Å
29	K	31.7	Very low	32	Very low	223 Å²	223	160 Å²	160	97%	0.97	82%	0.824	S	S	*	*			trans	-72.9	98.4	170.9	-82	-179.3	174.2	178.4	0	108.2
30	E	36.8	Very low	32.8	Very low	172 Å²	172	157.5 Å²	157.5	80%	0.804	81%	0.807	S	S	*	*			trans	-119.1	131.4	157.3	-100.3	175.8	-180	0	0	108.8	K28 T32	K28-E30 PolarHBondContact O-N 2.93Å; K28-E30 VanDerWaalsContact O-N 3.16Å; E30-T32 PolarHBondContact O-N 3.13Å
31	Q	29.2	Very low	33.8	Very low	202 Å²	202	150.3 Å²	150.3	94%	0.944	78%	0.778	S	S	*	*			trans	-84.8	87.6	-172.6	-161.4	166.7	7.4	0	0	107.5	T33	Q31-T33 PolarHBondContact O-N 3.12Å
32	T	31.5	Very low	35.2	Very low	112 Å²	112	141.6 Å²	141.6	69%	0.687	74%	0.738	S	S	*	*			trans	-85.2	108.7	176.1	46.4	0	0	0	0	110.6	E30 F34	E30-T32 PolarHBondContact O-N 3.13Å; T32-F34 PolarHBondContact O-N 3.06Å
33	T	30.2	Very low	37	Very low	142 Å²	142	138.5 Å²	138.5	87%	0.871	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-58.7	116.4	164.1	1.4	0	0	0	0	109.7	Q31 Q35	Q31-T33 PolarHBondContact O-N 3.12Å; T33-Q35 PolarHBondContact O-N 3.3Å
34	F	28.9	Very low	39.1	Very low	196 Å²	196	128.8 Å²	128.8	86%	0.86	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-74.8	116.3	169	-93.1	-98.2	0	0	0	109.2	T32	T32-F34 PolarHBondContact O-N 3.06Å
35	Q	27.6	Very low	41.7	Very low	171 Å²	171	123.6 Å²	123.6	80%	0.799	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-92.9	119.1	169.2	-151.9	169.3	-10.3	0	0	107.5	T33 W37	T33-Q35 PolarHBondContact O-N 3.3Å; Q35-W37 PolarHBondContact O-N 3.28Å
36	P	31.8	Very low	44.3	Very low	112 Å²	112	116.7 Å²	116.7	73%	0.727	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-66.5	123	175	-8.7	22.4	0	0	0	108.8
37	W	24.5	Very low	46.9	Very low	232 Å²	232	108.8 Å²	108.8	88%	0.879	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-68.4	136.3	170.1	-69.8	87.3	0	0	0	109.3	Q35 I39	Q35-W37 PolarHBondContact O-N 3.28Å; W37-I39 PolarHBondContact O-N 3.37Å
38	P	32.9	Very low	49.8	Very low	115 Å²	115	104.2 Å²	104.2	75%	0.747	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-62.8	128.9	175.3	24.3	-30.1	0	0	0	109.8	P40	P38-P40 WeakPolarHBondContact O-CD 3.28Å
39	I	35.5	Very low	52.5	Low	141 Å²	141	94.6 Å²	94.6	72%	0.723	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-68.7	118.4	173.4	-57	168.7	0	0	0	106.6	W37 S41 F538	W37-I39 PolarHBondContact O-N 3.37Å; I39-S41 PolarHBondContact O-N 2.98Å; I39-F538 HydrophobicContact CD1-CZ 4.21Å
40	P	43.5	Very low	55.4	Low	70 Å²	70	90.9 Å²	90.9	46%	0.455	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-66.3	131.9	179.7	25.2	-31.5	0	0	0	110.3	P38	P38-P40 WeakPolarHBondContact O-CD 3.28Å
41	S	50.5	Low	58.1	Low	43 Å²	43	83.4 Å²	83.4	30%	0.301	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-62.7	139.4	179	7.1	0	0	0	0	111	I39 E70	I39-S41 PolarHBondContact O-N 2.98Å; S41-E70 VanDerWaalsContact CB-OE1 3.24Å; S41-E70 WeakPolarHBondContact CB-OE1 3.39Å; S41-E70 PolarHBondContact OG-OE1 3.33Å
42	P	62.8	Low	61.2	Low	15 Å²	15	78.8 Å²	78.8	10%	0.097	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-60.5	153.3	175.2	27.9	-35.8	0	0	0	110.4	Q10 V429	Q10-P42 VanDerWaalsContact O-CB 3.29Å; Q10-P42 WeakPolarHBondContact O-CB 3.41Å; P42-V429 WeakPolarHBondContact CD-O 3.38Å; P42-V429 HydrophobicContact CG-CB 4.22Å; P42-V429 HydrophobicContact CG-CG1 4.05Å; P42-V429 WeakPolarHBondContact CG-O 3.35Å
43	T	70.4	Confident	64.1	Low	2 Å²	2	74.4 Å²	74.4	1%	0.012	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	136.4	-164.5	-74.2	0	0	0	0	109.5	Q10 L45 R66	Q10-T43 WeakPolarHBondContact CB-O 3.43Å; Q10-T43 PolarHBondContact N-O 3.24Å; Q10-T43 PolarHBondContact O-N 2.65Å; T43-L45 HydrophobicContact CG2-CD2 4.38Å; T43-R66 HydrophobicContact CG2-CB 4.41Å; T43-R66 HydrophobicContact CG2-CG 3.13Å; T43-R66 PolarHBondContact OG1-NE 3.4Å; T43-R66 PolarHBondContact OG1-NH2 2.87Å
44	L	78.9	Confident	67	Low	8 Å²	8	71.1 Å²	71.1	4%	0.042	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	141.2	174.2	-61.2	177	0	0	0	110.6	Q9 R66 C67 P69 V429 F456 L467	Q9-L44 HydrophobicContact CB-CD2 4.28Å; Q9-L44 HydrophobicContact CG-CD2 3.6Å; L44-R66 CarbonylContact O-C 3.42Å; L44-R66 WeakPolarHBondContact O-CA 3.38Å; L44-C67 HydrophobicContact CB-CB 4.09Å; L44-C67 PolarHBondContact N-O 3.3Å; L44-C67 VanDerWaalsContact N-O 3.11Å; L44-C67 PolarHBondContact O-N 2.78Å; L44-P69 HydrophobicContact CD1-CG 3.99Å; L44-P69 HydrophobicContact CG-CG 4.1Å; L44-V429 HydrophobicContact CD2-CG1 4.05Å; L44-V429 HydrophobicContact CD2-CG2 3.96Å; L44-V429 HydrophobicContact CG-CG1 4.3Å; L44-F456 HydrophobicContact CB-CE1 4.39Å; L44-F456 HydrophobicContact CD1-CE2 4.24Å; L44-F456 HydrophobicContact CD1-CZ 4.25Å; L44-F456 HydrophobicContact CD2-CD1 4.44Å; L44-L467 HydrophobicContact CD1-CD1 4.23Å; L44-L467 HydrophobicContact CD1-CD2 4.09Å; L44-L467 HydrophobicContact CD2-CD1 4.33Å
45	L	86.6	Confident	70.1	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	129.5	175.3	-62.8	178.1	0	0	0	110.5	I8 Q10 T43 V64 Y65 I77 V108 V117 F147	I8-L45 HydrophobicContact CB-CB 4.45Å; I8-L45 HydrophobicContact CD1-CB 4.35Å; I8-L45 HydrophobicContact CD1-CD1 4.15Å; I8-L45 PolarHBondContact N-O 3.37Å; I8-L45 PolarHBondContact O-N 3.47Å; Q10-L45 HydrophobicContact CB-CD1 4.44Å; T43-L45 HydrophobicContact CG2-CD2 4.38Å; L45-V64 HydrophobicContact CB-CG1 4.36Å; L45-V64 HydrophobicContact CD2-CG1 4.3Å; L45-Y65 CarbonylContact C-O 3.42Å; L45-Y65 WeakPolarHBondContact CA-O 3.38Å; L45-I77 HydrophobicContact CD2-CD1 3.65Å; L45-V108 HydrophobicContact CD1-CG1 4.48Å; L45-V117 HydrophobicContact CD1-CB 4.36Å; L45-V117 HydrophobicContact CD1-CG1 3.59Å; L45-V117 HydrophobicContact CD1-CG2 3.78Å; L45-F147 HydrophobicContact CD1-CZ 4.33Å; L45-F147 HydrophobicContact CD2-CZ 4.02Å
46	V	89.8	Confident	73.4	Confident	13 Å²	13	58.7 Å²	58.7	8%	0.079	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	117.3	179.6	-178.4	0	0	0	0	109.2	F5 L7 V64 Y65 F456	F5-V46 HydrophobicContact CD1-CG1 4.17Å; F5-V46 HydrophobicContact CE1-CG1 3.33Å; F5-V46 HydrophobicContact CZ-CG1 3.69Å; L7-V46 HydrophobicContact CD2-CB 4.27Å; L7-V46 HydrophobicContact CD2-CG1 3.86Å; L7-V46 HydrophobicContact CD2-CG2 3.91Å; V46-V64 CarbonylContact O-C 3.52Å; V46-V64 WeakPolarHBondContact O-CA 3.47Å; V46-Y65 PolarHBondContact N-O 3.35Å; V46-Y65 PolarHBondContact O-N 3.02Å; V46-F456 HydrophobicContact CG2-CE1 3.79Å; V46-F456 HydrophobicContact CG2-CZ 3.64Å
47	G	92	Very high	76.3	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	127.5	171.5	0	0	0	0	0	111.2	T6 P49 G105	T6-G47 PolarHBondContact O-N 3.07Å; G47-P49 WeakPolarHBondContact O-CD 3.39Å; G47-G105 VanDerWaalsContact CA-O 3.22Å; G47-G105 WeakPolarHBondContact CA-O 3.26Å
48	A	93.8	Very high	79.8	Confident	15 Å²	15	45.9 Å²	45.9	12%	0.124	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	83.7	179.1	0	0	0	0	0	109.5	R50 A51 G62 A63 Y65	A48-R50 PolarHBondContact O-N 3.32Å; A48-A51 HydrophobicContact CB-CB 3.86Å; A48-A51 WeakPolarHBondContact O-CB 3.42Å; A48-A51 PolarHBondContact O-N 2.84Å; A48-G62 VanDerWaalsContact O-CA 3.26Å; A48-G62 WeakPolarHBondContact O-CA 3.31Å; A48-A63 PolarHBondContact N-O 2.84Å; A48-A63 PolarHBondContact O-N 3.12Å; A48-Y65 HydrophobicContact CB-CD2 3.91Å; A48-Y65 HydrophobicContact CB-CE2 3.68Å
49	P	93.3	Very high	82.8	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.019	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-26.2	-167.4	-26.4	36	0	0	0	114.7	G47 G62 W103 F104 A106	G47-P49 WeakPolarHBondContact O-CD 3.39Å; P49-G62 WeakPolarHBondContact O-CA 3.06Å; P49-W103 HydrophobicContact CB-CB 3.98Å; P49-W103 HydrophobicContact CB-CD2 4.42Å; P49-W103 HydrophobicContact CB-CG 4.12Å; P49-W103 VanDerWaalsContact O-CA 3.3Å; P49-W103 WeakPolarHBondContact O-CA 3.46Å; P49-F104 WeakPolarHBondContact CA-O 2.96Å; P49-A106 HydrophobicContact CB-CB 4.19Å; P49-A106 HydrophobicContact CG-CB 3.97Å
50	R	92.9	Very high	85.6	Confident	144 Å²	144	43.5 Å²	43.5	54%	0.543	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	9.4	-177.5	-57.8	-174.6	-173.8	-174	5.2	113.5	D4 A48 Q52	D4-R50 IonicContact OD1-CZ 3.77Å; D4-R50 IonicContact OD1-NE 3.92Å; D4-R50 PolarHBondContact OD1-NE 2.95Å; D4-R50 IonicContact OD1-NH2 3.69Å; D4-R50 PolarHBondContact OD1-NH2 3.46Å; D4-R50 IonicContact OD2-NH2 2.69Å; A48-R50 PolarHBondContact O-N 3.32Å; R50-Q52 PolarHBondContact O-N 3.44Å
51	A	93	Very high	88	Confident	16 Å²	16	40.2 Å²	40.2	13%	0.132	24%	0.238	C	C	.	.			trans	-59.9	135.8	179.4	0	0	0	0	0	111.3	A48 G61 G62 A63 Y65	A48-A51 HydrophobicContact CB-CB 3.86Å; A48-A51 WeakPolarHBondContact O-CB 3.42Å; A48-A51 PolarHBondContact O-N 2.84Å; A51-G61 PolarHBondContact O-N 3.17Å; A51-G62 WeakPolarHBondContact O-CA 3.43Å; A51-G62 PolarHBondContact O-N 3.39Å; A51-A63 HydrophobicContact CB-CB 3.86Å; A51-Y65 HydrophobicContact CB-CE2 4.2Å
52	Q	94.6	Very high	90.1	Very high	104 Å²	104	38.3 Å²	38.3	49%	0.486	23%	0.225	S	C	.	.			trans	-77.3	130.5	171.9	-176.4	57.4	27.1	0	0	109.9	R50 V58	R50-Q52 PolarHBondContact O-N 3.44Å; Q52-V58 PolarHBondContact NE2-O 3.28Å
53	T	92	Very high	91.6	Very high	20 Å²	20	37.7 Å²	37.7	12%	0.123	22%	0.221	C	C	.	.			trans	-108.4	170.6	179.4	65.1	0	0	0	0	110.9	Q55 G62 A63	T53-Q55 WeakPolarHBondContact OG1-CB 3.06Å; T53-Q55 WeakPolarHBondContact OG1-CG 3.04Å; T53-Q55 PolarHBondContact OG1-N 3.42Å; T53-Q55 PolarHBondContact OG1-OE1 2.71Å; T53-G62 VanDerWaalsContact CG2-O 3.22Å; T53-G62 WeakPolarHBondContact CG2-O 3.11Å; T53-A63 HydrophobicContact CG2-CB 4.36Å
54	G	91.9	Very high	92.7	Very high	73 Å²	73	37.6 Å²	37.6	75%	0.753	22%	0.221	S	C	*	.			trans	-86	10.6	172	0	0	0	0	0	113.2
55	Q	94.7	Very high	93.3	Very high	15 Å²	15	40.3 Å²	40.3	7%	0.07	23%	0.231	C	C	.	.	S	Bend	trans	-65.7	126.4	180	-70.6	169	-41.9	0	0	109.4	T53 G57 V58 D80 A82	T53-Q55 WeakPolarHBondContact OG1-CB 3.06Å; T53-Q55 WeakPolarHBondContact OG1-CG 3.04Å; T53-Q55 PolarHBondContact OG1-N 3.42Å; T53-Q55 PolarHBondContact OG1-OE1 2.71Å; Q55-G57 PolarHBondContact O-N 2.92Å; Q55-G57 VanDerWaalsContact O-N 3.17Å; Q55-V58 HydrophobicContact CB-CB 3.82Å; Q55-V58 HydrophobicContact CB-CG2 3.73Å; Q55-V58 PolarHBondContact O-N 2.86Å; Q55-D80 PolarHBondContact NE2-O 3.05Å; Q55-D80 PolarHBondContact NE2-OD2 2.81Å; Q55-D80 VanDerWaalsContact NE2-OD2 3.16Å; Q55-A82 WeakPolarHBondContact CG-O 3.47Å
56	P	95.6	Very high	93.4	Very high	91 Å²	91	43.9 Å²	43.9	59%	0.591	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	121.3	-175.9	-26	34.1	0	0	0	112.6	V58 G83	P56-V58 VanDerWaalsContact C-N 3.29Å; P56-V58 PolarHBondContact O-N 3.38Å; P56-G83 WeakPolarHBondContact O-CA 3.37Å
57	G	94.3	Very high	93.1	Very high	70 Å²	70	43.9 Å²	43.9	72%	0.722	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.9	1.2	176.7	0	0	0	0	0	115.9	Q55 H84	Q55-G57 PolarHBondContact O-N 2.92Å; Q55-G57 VanDerWaalsContact O-N 3.17Å; G57-H84 PolarHBondContact O-NE2 3.43Å
58	V	96.2	Very high	92.5	Very high	5 Å²	5	47 Å²	47	3%	0.03	26%	0.259	C	S	.	.			trans	-95.2	128.8	-177.8	-178.7	0	0	0	0	110.9	Q52 Q55 P56 K99	Q52-V58 PolarHBondContact NE2-O 3.28Å; Q55-V58 HydrophobicContact CB-CB 3.82Å; Q55-V58 HydrophobicContact CB-CG2 3.73Å; Q55-V58 PolarHBondContact O-N 2.86Å; P56-V58 VanDerWaalsContact C-N 3.29Å; P56-V58 PolarHBondContact O-N 3.38Å; V58-K99 HydrophobicContact CG1-CB 3.97Å; V58-K99 VanDerWaalsContact CG1-O 3.29Å; V58-K99 WeakPolarHBondContact CG1-O 2.88Å; V58-K99 HydrophobicContact CG2-CB 3.93Å
59	R	96.5	Very high	91.2	Very high	154 Å²	154	47.3 Å²	47.3	58%	0.581	26%	0.26	S	S	*	.	S	Bend	trans	-108.1	132.6	174.6	-174.7	-174.8	65.6	-152.3	-4.2	110.7	G61 S100 D101	R59-G61 PolarHBondContact O-N 2.9Å; R59-S100 PolarHBondContact N-OG 3.31Å; R59-S100 CarbonylContact O-C 3.51Å; R59-S100 VanDerWaalsContact O-CA 3.22Å; R59-S100 WeakPolarHBondContact O-CA 3.15Å; R59-D101 IonicContact CZ-OD2 3.75Å; R59-D101 IonicContact NE-OD2 3.61Å; R59-D101 IonicContact NH2-OD2 2.96Å; R59-D101 PolarHBondContact NH2-OD2 2.85Å; R59-D101 PolarHBondContact O-N 2.98Å
60	N	94.7	Very high	90	Very high	53 Å²	53	53.9 Å²	53.9	28%	0.283	29%	0.29	S	S	.	.	S	Bend	trans	47.3	45.8	180	-51.5	-32.5	0	0	0	112.4	G62 D101	N60-G62 PolarHBondContact O-N 3.3Å; N60-D101 WeakPolarHBondContact CB-OD1 3.3Å; N60-D101 PolarHBondContact ND2-OD1 2.9Å; N60-D101 PolarHBondContact O-N 2.76Å
61	G	93.7	Very high	88.9	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.293	C	S	.	.			trans	-64.4	-25.3	-176.3	0	0	0	0	0	113.2	A51 R59 K99 Q102 F104	A51-G61 PolarHBondContact O-N 3.17Å; R59-G61 PolarHBondContact O-N 2.9Å; G61-K99 WeakPolarHBondContact CA-O 3.47Å; G61-Q102 WeakPolarHBondContact O-CG 3.34Å; G61-Q102 PolarHBondContact O-NE2 3.42Å; G61-F104 WeakPolarHBondContact O-CB 3.09Å; G61-F104 PolarHBondContact O-N 2.83Å
62	G	94.8	Very high	88	Confident	3 Å²	3	58.8 Å²	58.8	3%	0.031	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	87.8	157.6	-174.7	0	0	0	0	0	112.5	A48 P49 A51 T53 N60 F104	A48-G62 VanDerWaalsContact O-CA 3.26Å; A48-G62 WeakPolarHBondContact O-CA 3.31Å; P49-G62 WeakPolarHBondContact O-CA 3.06Å; A51-G62 WeakPolarHBondContact O-CA 3.43Å; A51-G62 PolarHBondContact O-N 3.39Å; T53-G62 VanDerWaalsContact CG2-O 3.22Å; T53-G62 WeakPolarHBondContact CG2-O 3.11Å; N60-G62 PolarHBondContact O-N 3.3Å; G62-F104 CarbonylContact C-O 3.5Å; G62-F104 VanDerWaalsContact CA-O 3.23Å; G62-F104 WeakPolarHBondContact CA-O 3.3Å
63	A	94.6	Very high	87.5	Confident	3 Å²	3	61.9 Å²	61.9	3%	0.025	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	163.3	-178	0	0	0	0	0	111	A48 A51 T53 Y65 K76 F104	A48-A63 PolarHBondContact N-O 2.84Å; A48-A63 PolarHBondContact O-N 3.12Å; A51-A63 HydrophobicContact CB-CB 3.86Å; T53-A63 HydrophobicContact CG2-CB 4.36Å; A63-Y65 HydrophobicContact CB-CE2 3.99Å; A63-K76 HydrophobicContact CB-CD 3.89Å; A63-K76 HydrophobicContact CB-CG 4.03Å; A63-F104 PolarHBondContact N-O 2.96Å; A63-F104 VanDerWaalsContact N-O 3.14Å
64	V	93.6	Very high	87.2	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.6	166.7	179.7	0	0	0	0	108.2	L45 V46 I77 F79 F104 V108 A119	L45-V64 HydrophobicContact CB-CG1 4.36Å; L45-V64 HydrophobicContact CD2-CG1 4.3Å; V46-V64 CarbonylContact O-C 3.52Å; V46-V64 WeakPolarHBondContact O-CA 3.47Å; V64-I77 HydrophobicContact CG1-CD1 4.28Å; V64-I77 PolarHBondContact O-N 3.34Å; V64-F79 HydrophobicContact CB-CD2 4.41Å; V64-F79 HydrophobicContact CB-CE2 3.87Å; V64-F79 HydrophobicContact CG1-CE2 4.35Å; V64-F79 HydrophobicContact CG2-CE2 4.11Å; V64-F104 HydrophobicContact CG2-CE1 3.96Å; V64-F104 HydrophobicContact CG2-CZ 4.42Å; V64-V108 HydrophobicContact CG1-CG1 4.08Å; V64-V108 HydrophobicContact CG2-CG1 4.22Å; V64-V108 HydrophobicContact CG2-CG2 3.89Å; V64-A119 HydrophobicContact CG2-CB 3.74Å
65	Y	91.2	Very high	87.2	Confident	65 Å²	65	63.4 Å²	63.4	26%	0.255	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	135.6	178.2	-70	-94.8	0	0	0	110.5	L45 V46 A48 A51 A63 C74 T75 K76	L45-Y65 CarbonylContact C-O 3.42Å; L45-Y65 WeakPolarHBondContact CA-O 3.38Å; V46-Y65 PolarHBondContact N-O 3.35Å; V46-Y65 PolarHBondContact O-N 3.02Å; A48-Y65 HydrophobicContact CB-CD2 3.91Å; A48-Y65 HydrophobicContact CB-CE2 3.68Å; A51-Y65 HydrophobicContact CB-CE2 4.2Å; A63-Y65 HydrophobicContact CB-CE2 3.99Å; Y65-C74 HydrophobicContact CD1-CB 4.32Å; Y65-T75 CarbonylContact C-O 3.59Å; Y65-T75 WeakPolarHBondContact CA-O 3.12Å; Y65-K76 HydrophobicContact CD1-CB 4.08Å; Y65-K76 HydrophobicContact CE1-CB 3.83Å; Y65-K76 HydrophobicContact CE1-CG 4.44Å
66	R	88.4	Confident	87	Confident	75 Å²	75	65.6 Å²	65.6	28%	0.283	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	112.2	169.4	-168.5	-172.6	174.5	-158.9	-5.4	108.9	T43 L44 E68 C74 T75 I77	T43-R66 HydrophobicContact CG2-CB 4.41Å; T43-R66 HydrophobicContact CG2-CG 3.13Å; T43-R66 PolarHBondContact OG1-NE 3.4Å; T43-R66 PolarHBondContact OG1-NH2 2.87Å; L44-R66 CarbonylContact O-C 3.42Å; L44-R66 WeakPolarHBondContact O-CA 3.38Å; R66-E68 IonicContact CZ-OE1 2.82Å; R66-E68 IonicContact NH1-OE1 3.28Å; R66-E68 IonicContact NH2-OE1 2.61Å; R66-C74 CarbonylContact O-C 3.56Å; R66-C74 VanDerWaalsContact O-CA 3.29Å; R66-C74 WeakPolarHBondContact O-CA 3.29Å; R66-T75 PolarHBondContact N-O 2.88Å; R66-T75 PolarHBondContact O-N 2.96Å; R66-T75 PolarHBondContact O-OG1 2.91Å; R66-I77 HydrophobicContact CB-CD1 3.98Å; R66-I77 HydrophobicContact CB-CG1 3.94Å
67	C	83.4	Confident	86.8	Confident	12 Å²	12	62.1 Å²	62.1	8%	0.081	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	127.5	-179.9	-57.7	0	0	0	0	110.7	L44 R73 C74	L44-C67 HydrophobicContact CB-CB 4.09Å; L44-C67 PolarHBondContact N-O 3.3Å; L44-C67 VanDerWaalsContact N-O 3.11Å; L44-C67 PolarHBondContact O-N 2.78Å; C67-R73 WeakPolarHBondContact CA-O 3.46Å; C67-C74 HydrophobicContact CB-CB 4.15Å; C67-C74 WeakPolarHBondContact CB-SG 3.41Å; C67-C74 WeakPolarHBondContact SG-CB 3.32Å; C67-C74 CovalentContact SG-SG 2.04Å; C67-C74 PolarHBondContact SG-SG 2.88Å
68	E	78.5	Confident	86.7	Confident	67 Å²	67	64.8 Å²	64.8	31%	0.313	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	114.6	176.1	-71.2	174.4	-177.7	0	0	108.4	R66 E70 D71 Q72 R73	R66-E68 IonicContact CZ-OE1 2.82Å; R66-E68 IonicContact NH1-OE1 3.28Å; R66-E68 IonicContact NH2-OE1 2.61Å; E68-E70 PolarHBondContact O-N 2.87Å; E68-D71 PolarHBondContact O-N 2.88Å; E68-Q72 PolarHBondContact O-N 3.07Å; E68-R73 PolarHBondContact N-O 2.9Å
69	P	67.7	Low	86.6	Confident	21 Å²	21	65 Å²	65	14%	0.136	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-22.8	-172.9	-20.8	29.4	0	0	0	115	L44 V429 L467 K469	L44-P69 HydrophobicContact CD1-CG 3.99Å; L44-P69 HydrophobicContact CG-CG 4.1Å; P69-V429 HydrophobicContact CB-CG1 4.4Å; P69-V429 HydrophobicContact CG-CG1 3.5Å; P69-V429 VanDerWaalsContact CG-CG1 3.5Å; P69-L467 HydrophobicContact CB-CD2 4.14Å; P69-K469 PolarHBondContact O-NZ 2.87Å
70	E	68.1	Low	86.4	Confident	140 Å²	140	59.3 Å²	59.3	65%	0.654	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-45.5	-179.4	-68.8	167.9	-153.1	0	0	110.9	S41 E68	S41-E70 VanDerWaalsContact CB-OE1 3.24Å; S41-E70 WeakPolarHBondContact CB-OE1 3.39Å; S41-E70 PolarHBondContact OG-OE1 3.33Å; E68-E70 PolarHBondContact O-N 2.87Å
71	D	69.5	Low	86.3	Confident	113 Å²	113	61.5 Å²	61.5	60%	0.604	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-6.9	-176.4	-75.2	-9.8	0	0	0	113.5	E68 R73	E68-D71 PolarHBondContact O-N 2.88Å; D71-R73 HydrophobicContact CB-CB 3.94Å; D71-R73 PolarHBondContact O-N 2.94Å
72	Q	74.3	Confident	86.3	Confident	150 Å²	150	63.9 Å²	63.9	70%	0.701	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	25.4	-168.5	-59.2	-175.8	1.9	0	0	112.7	E68	E68-Q72 PolarHBondContact O-N 3.07Å
73	R	83.3	Confident	86.3	Confident	169 Å²	169	64.5 Å²	64.5	64%	0.638	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	128	-174.3	-169.3	177.8	-176.8	168.2	0.6	109.4	C67 E68 D71	C67-R73 WeakPolarHBondContact CA-O 3.46Å; E68-R73 PolarHBondContact N-O 2.9Å; D71-R73 HydrophobicContact CB-CB 3.94Å; D71-R73 PolarHBondContact O-N 2.94Å
74	C	86.6	Confident	86.3	Confident	67 Å²	67	65.9 Å²	65.9	45%	0.453	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128.1	174.1	-62	0	0	0	0	110.2	Y65 R66 C67	Y65-C74 HydrophobicContact CD1-CB 4.32Å; R66-C74 CarbonylContact O-C 3.56Å; R66-C74 VanDerWaalsContact O-CA 3.29Å; R66-C74 WeakPolarHBondContact O-CA 3.29Å; C67-C74 HydrophobicContact CB-CB 4.15Å; C67-C74 WeakPolarHBondContact CB-SG 3.41Å; C67-C74 WeakPolarHBondContact SG-CB 3.32Å; C67-C74 CovalentContact SG-SG 2.04Å; C67-C74 PolarHBondContact SG-SG 2.88Å
75	T	91	Very high	86.1	Confident	59 Å²	59	66.9 Å²	66.9	36%	0.362	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	138.1	177.1	58.9	0	0	0	0	110	Y65 R66	Y65-T75 CarbonylContact C-O 3.59Å; Y65-T75 WeakPolarHBondContact CA-O 3.12Å; R66-T75 PolarHBondContact N-O 2.88Å; R66-T75 PolarHBondContact O-N 2.96Å; R66-T75 PolarHBondContact O-OG1 2.91Å
76	K	91.4	Very high	86	Confident	61 Å²	61	71.5 Å²	71.5	27%	0.265	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	133	-178.4	-178.2	172.3	60.4	-174.4	0	110.7	A63 Y65	A63-K76 HydrophobicContact CB-CD 3.89Å; A63-K76 HydrophobicContact CB-CG 4.03Å; Y65-K76 HydrophobicContact CD1-CB 4.08Å; Y65-K76 HydrophobicContact CE1-CB 3.83Å; Y65-K76 HydrophobicContact CE1-CG 4.44Å
77	I	92.1	Very high	85.8	Confident	18 Å²	18	69.8 Å²	69.8	9%	0.092	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	128.5	172.3	-49.9	-179.4	0	0	0	108.9	L45 V64 R66 F79 F147 F150	L45-I77 HydrophobicContact CD2-CD1 3.65Å; V64-I77 HydrophobicContact CG1-CD1 4.28Å; V64-I77 PolarHBondContact O-N 3.34Å; R66-I77 HydrophobicContact CB-CD1 3.98Å; R66-I77 HydrophobicContact CB-CG1 3.94Å; I77-F79 HydrophobicContact CB-CD2 4.03Å; I77-F79 HydrophobicContact CB-CE2 3.87Å; I77-F79 HydrophobicContact CD1-CE2 4.37Å; I77-F79 HydrophobicContact CG2-CD2 3.71Å; I77-F79 HydrophobicContact CG2-CE2 3.57Å; I77-F79 HydrophobicContact CG2-CZ 4.43Å; I77-F79 PolarHBondContact O-N 2.84Å; I77-F147 HydrophobicContact CD1-CD1 3.91Å; I77-F147 HydrophobicContact CD1-CE1 3.52Å; I77-F147 HydrophobicContact CD1-CE2 4.18Å; I77-F147 HydrophobicContact CD1-CG 4.41Å; I77-F147 HydrophobicContact CD1-CZ 3.66Å; I77-F147 HydrophobicContact CG2-CB 4.35Å; I77-F147 HydrophobicContact CG2-CD1 3.73Å; I77-F147 HydrophobicContact CG2-CE1 4.33Å; I77-F147 HydrophobicContact CG2-CG 4.16Å; I77-F150 HydrophobicContact CG2-CE1 4.19Å; I77-F150 HydrophobicContact CG2-CZ 4.27Å
78	F	92.1	Very high	85.7	Confident	125 Å²	125	75.3 Å²	75.3	55%	0.548	39%	0.388	S	S	.	.			trans	-93.6	76.7	-177.8	-64	-86.8	0	0	0	111.2	D80 T81	F78-D80 VanDerWaalsContact C-N 3.32Å; F78-T81 HydrophobicContact CB-CG2 4.03Å; F78-T81 HydrophobicContact CD1-CG2 4.19Å; F78-T81 HydrophobicContact CG-CG2 4.46Å
79	F	93.1	Very high	85.5	Confident	11 Å²	11	76 Å²	76	5%	0.048	39%	0.393	C	S	.	.	S	Bend	trans	-63.5	-36.9	175	-79.6	-99.6	0	0	0	112.9	V64 I77 F104 V117 A119 A143 F147 F150	V64-F79 HydrophobicContact CB-CD2 4.41Å; V64-F79 HydrophobicContact CB-CE2 3.87Å; V64-F79 HydrophobicContact CG1-CE2 4.35Å; V64-F79 HydrophobicContact CG2-CE2 4.11Å; I77-F79 HydrophobicContact CB-CD2 4.03Å; I77-F79 HydrophobicContact CB-CE2 3.87Å; I77-F79 HydrophobicContact CD1-CE2 4.37Å; I77-F79 HydrophobicContact CG2-CD2 3.71Å; I77-F79 HydrophobicContact CG2-CE2 3.57Å; I77-F79 HydrophobicContact CG2-CZ 4.43Å; I77-F79 PolarHBondContact O-N 2.84Å; F79-F104 HydrophobicContact CB-CE1 3.96Å; F79-F104 HydrophobicContact CB-CZ 3.57Å; F79-F104 HydrophobicContact CD1-CZ 4.02Å; F79-F104 AromaticContact CD2-CE1 3.91Å; F79-F104 HydrophobicContact CD2-CE1 3.91Å; F79-F104 AromaticContact CD2-CZ 3.81Å; F79-F104 HydrophobicContact CD2-CZ 3.81Å; F79-F104 HydrophobicContact CE2-CZ 4.48Å; F79-F104 HydrophobicContact CG-CE1 4.04Å; F79-F104 AromaticContact CG-CZ 3.54Å; F79-F104 HydrophobicContact CG-CZ 3.54Å; F79-V117 HydrophobicContact CZ-CG1 4.23Å; F79-A119 HydrophobicContact CD1-CB 4.47Å; F79-A119 HydrophobicContact CE1-CB 3.99Å; F79-A119 HydrophobicContact CE2-CB 4.35Å; F79-A119 HydrophobicContact CZ-CB 3.92Å; F79-A143 HydrophobicContact CD1-CB 4.3Å; F79-A143 HydrophobicContact CE1-CB 3.51Å; F79-A143 HydrophobicContact CZ-CB 3.91Å; F79-F147 HydrophobicContact CZ-CD1 4.39Å; F79-F147 HydrophobicContact CZ-CE1 4.24Å; F79-F150 HydrophobicContact CB-CD1 4.28Å; F79-F150 HydrophobicContact CB-CE1 4.46Å; F79-F150 AromaticContact CD1-CD1 3.58Å; F79-F150 HydrophobicContact CD1-CD1 3.58Å; F79-F150 AromaticContact CD1-CE1 3.85Å; F79-F150 HydrophobicContact CD1-CE1 3.85Å; F79-F150 HydrophobicContact CD2-CE1 4.4Å; F79-F150 HydrophobicContact CE1-CD1 4.15Å; F79-F150 HydrophobicContact CE1-CE1 4.21Å; F79-F150 AromaticContact CG-CD1 3.99Å; F79-F150 HydrophobicContact CG-CD1 3.99Å; F79-F150 AromaticContact CG-CE1 3.97Å; F79-F150 HydrophobicContact CG-CE1 3.97Å
80	D	93.2	Very high	86.1	Confident	33 Å²	33	78.3 Å²	78.3	18%	0.176	42%	0.422	C	S	.	.			trans	-145	125.1	177.9	173.6	27.2	0	0	0	110	Q55 F78 A82 K99 Y141	Q55-D80 PolarHBondContact NE2-O 3.05Å; Q55-D80 PolarHBondContact NE2-OD2 2.81Å; Q55-D80 VanDerWaalsContact NE2-OD2 3.16Å; F78-D80 VanDerWaalsContact C-N 3.32Å; D80-A82 WeakPolarHBondContact OD1-CB 3.31Å; D80-A82 PolarHBondContact OD1-N 2.83Å; D80-K99 IonicContact OD1-NZ 2.68Å; D80-K99 WeakPolarHBondContact OD2-CE 3.37Å; D80-K99 IonicContact OD2-NZ 3.2Å; D80-K99 PolarHBondContact OD2-NZ 3.12Å; D80-Y141 HydrophobicContact CB-CE1 4.03Å
81	T	92.6	Very high	86.9	Confident	100 Å²	100	77.2 Å²	77.2	61%	0.613	43%	0.43	S	S	*	.			trans	-103.6	-7.4	176.1	56.3	0	0	0	0	113	F78	F78-T81 HydrophobicContact CB-CG2 4.03Å; F78-T81 HydrophobicContact CD1-CG2 4.19Å; F78-T81 HydrophobicContact CG-CG2 4.46Å
82	A	93.7	Very high	87.6	Confident	50 Å²	50	75.7 Å²	75.7	41%	0.413	42%	0.424	S	S	.	.			trans	-76.1	149.4	-179.7	0	0	0	0	0	111.4	Q55 D80	Q55-A82 WeakPolarHBondContact CG-O 3.47Å; D80-A82 WeakPolarHBondContact OD1-CB 3.31Å; D80-A82 PolarHBondContact OD1-N 2.83Å
83	G	94.2	Very high	88.1	Confident	16 Å²	16	73 Å²	73	17%	0.165	41%	0.414	C	S	.	.			trans	-74.6	-156.9	169.4	0	0	0	0	0	111.8	P56 G85 K99	P56-G83 WeakPolarHBondContact O-CA 3.37Å; G83-G85 PolarHBondContact O-N 2.94Å; G83-K99 WeakPolarHBondContact O-CD 3.16Å; G83-K99 WeakPolarHBondContact O-CE 3.36Å; G83-K99 PolarHBondContact O-NZ 2.04Å
84	H	94.2	Very high	88.2	Confident	32 Å²	32	67.6 Å²	67.6	15%	0.148	40%	0.398	C	S	.	.	S	Bend	trans	-55.5	134.5	171	-65.7	-56.4	0	0	0	112.3	G57 Q95 D97 K99 S100	G57-H84 PolarHBondContact O-NE2 3.43Å; H84-Q95 HydrophobicContact CB-CG 3.94Å; H84-Q95 PolarHBondContact ND1-NE2 2.9Å; H84-D97 WeakPolarHBondContact CA-OD1 3.26Å; H84-D97 IonicContact CG-OD1 3.97Å; H84-D97 IonicContact ND1-OD1 3.53Å; H84-K99 PolarHBondContact CE1-N 3.38Å; H84-K99 VanDerWaalsContact CE1-N 3.27Å; H84-K99 PolarHBondContact ND1-N 3.48Å; H84-S100 PolarHBondContact NE2-OG 2.81Å
85	G	90.5	Very high	88.3	Confident	20 Å²	20	67.5 Å²	67.5	21%	0.206	39%	0.39	C	S	.	.			trans	-60.9	142.4	170.9	0	0	0	0	0	111	G83 Q95 I96 D97	G83-G85 PolarHBondContact O-N 2.94Å; G85-Q95 CarbonylContact O-C 3.58Å; G85-Q95 WeakPolarHBondContact O-CA 3.36Å; G85-I96 VanDerWaalsContact C-CG1 3.48Å; G85-I96 WeakPolarHBondContact O-CG1 3.24Å; G85-I96 PolarHBondContact O-N 3.21Å; G85-D97 PolarHBondContact N-OD1 3.43Å; G85-D97 PolarHBondContact N-OD2 3.46Å; G85-D97 VanDerWaalsContact N-OD2 3.08Å
86	R	87.9	Confident	88.2	Confident	162 Å²	162	66.5 Å²	66.5	61%	0.611	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.4	138.1	176	-61.2	-176.6	175.6	-172.3	-3.2	110.7	L93 L94	R86-L93 HydrophobicContact CB-CD1 3.65Å; R86-L93 HydrophobicContact CB-CD2 4.16Å; R86-L93 HydrophobicContact CB-CG 3.75Å; R86-L93 HydrophobicContact CG-CG 4.44Å; R86-L94 CarbonylContact C-O 3.59Å; R86-L94 WeakPolarHBondContact CA-O 3.44Å
87	A	84	Confident	88.3	Confident	39 Å²	39	63.9 Å²	63.9	32%	0.322	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	152.5	173.7	0	0	0	0	0	110.8	N89 L94 I96	A87-N89 PolarHBondContact O-N 3.21Å; A87-L94 PolarHBondContact N-O 2.8Å; A87-L94 PolarHBondContact O-N 3.24Å; A87-I96 HydrophobicContact CB-CD1 4.25Å; A87-I96 HydrophobicContact CB-CG2 3.55Å
88	L	81.9	Confident	88.3	Confident	128 Å²	128	64.1 Å²	64.1	67%	0.67	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	120.1	175.5	-74.3	164.8	0	0	0	109.6	L93	L88-L93 HydrophobicContact CD2-CB 4.28Å; L88-L93 HydrophobicContact CD2-CD1 4.37Å; L88-L93 HydrophobicContact CG-CD1 4.33Å
89	N	75.5	Confident	88.5	Confident	81 Å²	81	58.8 Å²	58.8	43%	0.433	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	98.7	165	-170.8	2.6	0	0	0	108.1	A87 S91 V92 L94 F131	A87-N89 PolarHBondContact O-N 3.21Å; N89-S91 PolarHBondContact O-N 2.92Å; N89-V92 PolarHBondContact N-O 3.46Å; N89-V92 PolarHBondContact O-N 3.36Å; N89-L94 HydrophobicContact CB-CD1 3.72Å; N89-L94 HydrophobicContact CB-CG 4.37Å; N89-F131 HydrophobicContact CB-CE2 3.72Å; N89-F131 HydrophobicContact CB-CZ 4.28Å; N89-F131 WeakPolarHBondContact ND2-CD2 3.4Å; N89-F131 VanDerWaalsContact ND2-CE2 3.28Å; N89-F131 WeakPolarHBondContact ND2-CE2 3.42Å
90	G	80.1	Confident	88.7	Confident	71 Å²	71	59.4 Å²	59.4	73%	0.732	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	-114.7	-164.9	0	0	0	0	0	110.7
91	S	84	Confident	88.7	Confident	117 Å²	117	59.9 Å²	59.9	82%	0.818	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-3.8	178	51	0	0	0	0	114.1	N89	N89-S91 PolarHBondContact O-N 2.92Å
92	V	84	Confident	88.9	Confident	80 Å²	80	55.3 Å²	55.3	49%	0.485	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	123.9	-175.7	-173.9	0	0	0	0	109.9	N89 L94	N89-V92 PolarHBondContact N-O 3.46Å; N89-V92 PolarHBondContact O-N 3.36Å; V92-L94 HydrophobicContact CB-CG 4.4Å; V92-L94 HydrophobicContact CG1-CD2 3.63Å; V92-L94 HydrophobicContact CG1-CG 3.94Å; V92-L94 PolarHBondContact O-N 2.56Å
93	L	85.2	Confident	88.9	Confident	93 Å²	93	54 Å²	54	49%	0.487	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	106.4	172.8	-174.3	68.2	0	0	0	109.2	R86 L88	R86-L93 HydrophobicContact CB-CD1 3.65Å; R86-L93 HydrophobicContact CB-CD2 4.16Å; R86-L93 HydrophobicContact CB-CG 3.75Å; R86-L93 HydrophobicContact CG-CG 4.44Å; L88-L93 HydrophobicContact CD2-CB 4.28Å; L88-L93 HydrophobicContact CD2-CD1 4.37Å; L88-L93 HydrophobicContact CG-CD1 4.33Å
94	L	85.8	Confident	89	Confident	57 Å²	57	53.9 Å²	53.9	30%	0.298	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	148.3	-178.2	-65.4	177.9	0	0	0	110.9	R86 A87 N89 V92 F131	R86-L94 CarbonylContact C-O 3.59Å; R86-L94 WeakPolarHBondContact CA-O 3.44Å; A87-L94 PolarHBondContact N-O 2.8Å; A87-L94 PolarHBondContact O-N 3.24Å; N89-L94 HydrophobicContact CB-CD1 3.72Å; N89-L94 HydrophobicContact CB-CG 4.37Å; V92-L94 HydrophobicContact CB-CG 4.4Å; V92-L94 HydrophobicContact CG1-CD2 3.63Å; V92-L94 HydrophobicContact CG1-CG 3.94Å; V92-L94 PolarHBondContact O-N 2.56Å; L94-F131 HydrophobicContact CB-CD1 4.01Å; L94-F131 HydrophobicContact CB-CE1 3.32Å; L94-F131 HydrophobicContact CB-CE2 4.12Å; L94-F131 HydrophobicContact CB-CZ 3.38Å; L94-F131 HydrophobicContact CD1-CD1 4.13Å; L94-F131 HydrophobicContact CD1-CD2 3.62Å; L94-F131 HydrophobicContact CD1-CE1 4.01Å; L94-F131 HydrophobicContact CD1-CE2 3.51Å; L94-F131 HydrophobicContact CD1-CG 3.95Å; L94-F131 HydrophobicContact CD1-CZ 3.7Å; L94-F131 HydrophobicContact CG-CE1 4.3Å; L94-F131 HydrophobicContact CG-CE2 4.45Å; L94-F131 HydrophobicContact CG-CZ 4.17Å
95	Q	87.8	Confident	89	Confident	64 Å²	64	52.3 Å²	52.3	30%	0.299	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	126.9	175.1	172.4	170.1	-25.1	0	0	110.1	H84 G85 D97 F127 F131	H84-Q95 HydrophobicContact CB-CG 3.94Å; H84-Q95 PolarHBondContact ND1-NE2 2.9Å; G85-Q95 CarbonylContact O-C 3.58Å; G85-Q95 WeakPolarHBondContact O-CA 3.36Å; Q95-D97 VanDerWaalsContact CD-O 3.3Å; Q95-D97 WeakPolarHBondContact CG-O 3.21Å; Q95-D97 PolarHBondContact NE2-O 3.18Å; Q95-F127 HydrophobicContact CG-CD2 4.38Å; Q95-F127 HydrophobicContact CG-CE2 3.92Å; Q95-F127 WeakPolarHBondContact O-CD2 3.4Å; Q95-F131 WeakPolarHBondContact O-CE1 3.47Å
96	I	89.1	Confident	89.1	Confident	38 Å²	38	51.5 Å²	51.5	20%	0.195	30%	0.295	C	S	.	.			trans	-105.9	-3.4	-176.1	56	164.1	0	0	0	113.7	G85 A87 Y126 F127 F131	G85-I96 VanDerWaalsContact C-CG1 3.48Å; G85-I96 WeakPolarHBondContact O-CG1 3.24Å; G85-I96 PolarHBondContact O-N 3.21Å; A87-I96 HydrophobicContact CB-CD1 4.25Å; A87-I96 HydrophobicContact CB-CG2 3.55Å; I96-Y126 HydrophobicContact CB-CE2 4.34Å; I96-Y126 HydrophobicContact CD1-CE2 4.42Å; I96-Y126 WeakPolarHBondContact O-CD2 3.31Å; I96-Y126 WeakPolarHBondContact O-CE2 3.29Å; I96-F127 PolarHBondContact O-N 3.19Å; I96-F131 HydrophobicContact CG2-CE1 3.92Å; I96-F131 HydrophobicContact CG2-CZ 3.97Å
97	D	92.4	Very high	89.3	Confident	7 Å²	7	44.4 Å²	44.4	4%	0.037	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	171	178.9	71.5	19	0	0	0	111.9	H84 G85 Q95 Y124 T125	H84-D97 WeakPolarHBondContact CA-OD1 3.26Å; H84-D97 IonicContact CG-OD1 3.97Å; H84-D97 IonicContact ND1-OD1 3.53Å; G85-D97 PolarHBondContact N-OD1 3.43Å; G85-D97 PolarHBondContact N-OD2 3.46Å; G85-D97 VanDerWaalsContact N-OD2 3.08Å; Q95-D97 VanDerWaalsContact CD-O 3.3Å; Q95-D97 WeakPolarHBondContact CG-O 3.21Å; Q95-D97 PolarHBondContact NE2-O 3.18Å; D97-Y124 HydrophobicContact CB-CE2 3.83Å; D97-Y124 WeakPolarHBondContact CB-OH 3.31Å; D97-Y124 PolarHBondContact OD2-OH 2.71Å; D97-T125 CarbonylContact C-O 3.43Å; D97-T125 VanDerWaalsContact CA-O 3.26Å; D97-T125 WeakPolarHBondContact CA-O 3.47Å; D97-T125 WeakPolarHBondContact CB-O 3.27Å
98	S	93.6	Very high	89.7	Confident	23 Å²	23	42.7 Å²	42.7	16%	0.161	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	109.1	162.6	177.3	0	0	0	0	110.2	S100 T125	S98-S100 VanDerWaalsContact C-N 3.28Å; S98-S100 PolarHBondContact OG-N 3.44Å; S98-T125 PolarHBondContact N-O 2.97Å; S98-T125 PolarHBondContact O-N 3.45Å
99	K	96.1	Very high	90.1	Very high	13 Å²	13	37.9 Å²	37.9	6%	0.057	23%	0.23	C	C	.	.			trans	-81.3	-5.8	167.5	-59.9	-178.1	-177.6	175.9	0	113.2	V58 G61 D80 G83 H84 Q102 Y124	V58-K99 HydrophobicContact CG1-CB 3.97Å; V58-K99 VanDerWaalsContact CG1-O 3.29Å; V58-K99 WeakPolarHBondContact CG1-O 2.88Å; V58-K99 HydrophobicContact CG2-CB 3.93Å; G61-K99 WeakPolarHBondContact CA-O 3.47Å; D80-K99 IonicContact OD1-NZ 2.68Å; D80-K99 WeakPolarHBondContact OD2-CE 3.37Å; D80-K99 IonicContact OD2-NZ 3.2Å; D80-K99 PolarHBondContact OD2-NZ 3.12Å; G83-K99 WeakPolarHBondContact O-CD 3.16Å; G83-K99 WeakPolarHBondContact O-CE 3.36Å; G83-K99 PolarHBondContact O-NZ 2.04Å; H84-K99 PolarHBondContact CE1-N 3.38Å; H84-K99 VanDerWaalsContact CE1-N 3.27Å; H84-K99 PolarHBondContact ND1-N 3.48Å; K99-Q102 WeakPolarHBondContact O-CB 3.49Å; K99-Q102 VanDerWaalsContact O-CD 3.24Å; K99-Q102 WeakPolarHBondContact O-CG 3.48Å; K99-Y124 HydrophobicContact CG-CD2 4.26Å; K99-Y124 HydrophobicContact CG-CE2 4.1Å
100	S	96	Very high	90.5	Very high	23 Å²	23	35.1 Å²	35.1	16%	0.161	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	133.9	177.4	-71.3	0	0	0	0	109.9	R59 H84 S98 Q102	R59-S100 PolarHBondContact N-OG 3.31Å; R59-S100 CarbonylContact O-C 3.51Å; R59-S100 VanDerWaalsContact O-CA 3.22Å; R59-S100 WeakPolarHBondContact O-CA 3.15Å; H84-S100 PolarHBondContact NE2-OG 2.81Å; S98-S100 VanDerWaalsContact C-N 3.28Å; S98-S100 PolarHBondContact OG-N 3.44Å; S100-Q102 PolarHBondContact O-N 3.26Å
101	D	95.2	Very high	90.5	Very high	43 Å²	43	32 Å²	32	23%	0.23	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	27	-176.8	-58.3	-65.8	0	0	0	113.2	R59 N60 W103	R59-D101 IonicContact CZ-OD2 3.75Å; R59-D101 IonicContact NE-OD2 3.61Å; R59-D101 IonicContact NH2-OD2 2.96Å; R59-D101 PolarHBondContact NH2-OD2 2.85Å; R59-D101 PolarHBondContact O-N 2.98Å; N60-D101 WeakPolarHBondContact CB-OD1 3.3Å; N60-D101 PolarHBondContact ND2-OD1 2.9Å; N60-D101 PolarHBondContact O-N 2.76Å; D101-W103 VanDerWaalsContact C-N 3.27Å; D101-W103 VanDerWaalsContact O-CD1 3.26Å; D101-W103 PolarHBondContact O-N 2.92Å
102	Q	95	Very high	90	Very high	5 Å²	5	34 Å²	34	2%	0.023	18%	0.179	C	C	.	.			trans	-74.3	-12	-175.3	69.6	-178.2	-16.2	0	0	114.6	G61 K99 S100 F104 A121 R123 Y124	G61-Q102 WeakPolarHBondContact O-CG 3.34Å; G61-Q102 PolarHBondContact O-NE2 3.42Å; K99-Q102 WeakPolarHBondContact O-CB 3.49Å; K99-Q102 VanDerWaalsContact O-CD 3.24Å; K99-Q102 WeakPolarHBondContact O-CG 3.48Å; S100-Q102 PolarHBondContact O-N 3.26Å; Q102-F104 HydrophobicContact CG-CB 4.14Å; Q102-A121 HydrophobicContact CB-CB 4.19Å; Q102-A121 HydrophobicContact CG-CB 3.98Å; Q102-A121 CarbonylContact O-C 3.49Å; Q102-A121 WeakPolarHBondContact O-CA 3.46Å; Q102-A121 WeakPolarHBondContact O-CB 3.28Å; Q102-R123 CarbonylContact O-C 3.51Å; Q102-R123 WeakPolarHBondContact O-CA 3.36Å; Q102-R123 WeakPolarHBondContact O-CB 3.49Å; Q102-R123 PolarHBondContact O-N 2.9Å; Q102-R123 VanDerWaalsContact O-N 3.11Å; Q102-Y124 PolarHBondContact O-N 2.78Å
103	W	94.5	Very high	89.3	Confident	22 Å²	22	33.4 Å²	33.4	8%	0.083	17%	0.173	C	C	.	.			trans	63.9	41.6	179.6	-72.2	23.7	0	0	0	113.9	S3 D4 P49 D101 G105 A106 R123	S3-W103 VanDerWaalsContact CB-CE3 3.44Å; S3-W103 WeakPolarHBondContact O-CZ3 3.32Å; S3-W103 WeakPolarHBondContact OG-CZ3 3.44Å; D4-W103 WeakPolarHBondContact OD1-CH2 3.37Å; D4-W103 WeakPolarHBondContact OD1-CZ2 3.16Å; D4-W103 WeakPolarHBondContact OD1-CZ3 3.43Å; P49-W103 HydrophobicContact CB-CB 3.98Å; P49-W103 HydrophobicContact CB-CD2 4.42Å; P49-W103 HydrophobicContact CB-CG 4.12Å; P49-W103 VanDerWaalsContact O-CA 3.3Å; P49-W103 WeakPolarHBondContact O-CA 3.46Å; D101-W103 VanDerWaalsContact C-N 3.27Å; D101-W103 VanDerWaalsContact O-CD1 3.26Å; D101-W103 PolarHBondContact O-N 2.92Å; W103-G105 PolarHBondContact O-N 2.76Å; W103-A106 HydrophobicContact CB-CB 4.12Å; W103-A106 HydrophobicContact CE3-CB 4.45Å; W103-A106 WeakPolarHBondContact O-CB 3.41Å; W103-A106 PolarHBondContact O-N 2.87Å; W103-A106 VanDerWaalsContact O-N 3.08Å; W103-R123 HydrophobicContact CB-CB 4.44Å; W103-R123 HydrophobicContact CB-CG 4.4Å; W103-R123 HydrophobicContact CD2-CG 4.42Å; W103-R123 HydrophobicContact CG-CG 4.26Å
104	F	96.5	Very high	88.6	Confident	13 Å²	13	29 Å²	29	6%	0.057	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-65.4	126.4	176.4	-176.9	-103	0	0	0	111.2	P49 G61 G62 A63 V64 F79 Q102 A119 A121 Y141	P49-F104 WeakPolarHBondContact CA-O 2.96Å; G61-F104 WeakPolarHBondContact O-CB 3.09Å; G61-F104 PolarHBondContact O-N 2.83Å; G62-F104 CarbonylContact C-O 3.5Å; G62-F104 VanDerWaalsContact CA-O 3.23Å; G62-F104 WeakPolarHBondContact CA-O 3.3Å; A63-F104 PolarHBondContact N-O 2.96Å; A63-F104 VanDerWaalsContact N-O 3.14Å; V64-F104 HydrophobicContact CG2-CE1 3.96Å; V64-F104 HydrophobicContact CG2-CZ 4.42Å; F79-F104 HydrophobicContact CB-CE1 3.96Å; F79-F104 HydrophobicContact CB-CZ 3.57Å; F79-F104 HydrophobicContact CD1-CZ 4.02Å; F79-F104 AromaticContact CD2-CE1 3.91Å; F79-F104 HydrophobicContact CD2-CE1 3.91Å; F79-F104 AromaticContact CD2-CZ 3.81Å; F79-F104 HydrophobicContact CD2-CZ 3.81Å; F79-F104 HydrophobicContact CE2-CZ 4.48Å; F79-F104 HydrophobicContact CG-CE1 4.04Å; F79-F104 AromaticContact CG-CZ 3.54Å; F79-F104 HydrophobicContact CG-CZ 3.54Å; Q102-F104 HydrophobicContact CG-CB 4.14Å; F104-A119 HydrophobicContact CE1-CB 4.31Å; F104-A119 HydrophobicContact CE2-CB 3.79Å; F104-A119 WeakPolarHBondContact CE2-O 3.23Å; F104-A119 HydrophobicContact CZ-CB 3.5Å; F104-A121 HydrophobicContact CB-CB 3.94Å; F104-A121 HydrophobicContact CD2-CB 4.01Å; F104-A121 HydrophobicContact CG-CB 4.49Å; F104-Y141 HydrophobicContact CD2-CD2 4.36Å; F104-Y141 AromaticContact CE2-CD2 3.75Å; F104-Y141 HydrophobicContact CE2-CD2 3.75Å; F104-Y141 HydrophobicContact CE2-CG 4.31Å
105	G	93.2	Very high	88.2	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.6	7.5	-171.6	0	0	0	0	0	113.9	G47 W103 T107 C120	G47-G105 VanDerWaalsContact CA-O 3.22Å; G47-G105 WeakPolarHBondContact CA-O 3.26Å; W103-G105 PolarHBondContact O-N 2.76Å; G105-T107 PolarHBondContact O-N 2.94Å; G105-C120 PolarHBondContact N-O 2.83Å
106	A	92.4	Very high	88	Confident	3 Å²	3	27.8 Å²	27.8	3%	0.025	15%	0.146	C	C	.	.	S	Bend	trans	-73.1	-11.2	170.8	0	0	0	0	0	113.8	S3 T6 P49 W103 C120 P122	S3-A106 VanDerWaalsContact O-CB 3.31Å; S3-A106 WeakPolarHBondContact O-CB 3.46Å; T6-A106 PolarHBondContact OG1-O 2.99Å; P49-A106 HydrophobicContact CB-CB 4.19Å; P49-A106 HydrophobicContact CG-CB 3.97Å; W103-A106 HydrophobicContact CB-CB 4.12Å; W103-A106 HydrophobicContact CE3-CB 4.45Å; W103-A106 WeakPolarHBondContact O-CB 3.41Å; W103-A106 PolarHBondContact O-N 2.87Å; W103-A106 VanDerWaalsContact O-N 3.08Å; A106-C120 PolarHBondContact N-O 3.45Å; A106-P122 HydrophobicContact CB-CG 3.99Å
107	T	93.5	Very high	88.1	Confident	12 Å²	12	26 Å²	26	7%	0.074	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	130.8	161.8	-65.5	0	0	0	0	106.2	G105 V109 A119 C120 G173 F174 A176	G105-T107 PolarHBondContact O-N 2.94Å; T107-V109 HydrophobicContact CG2-CG1 4.28Å; T107-A119 CarbonylContact O-C 3.56Å; T107-A119 WeakPolarHBondContact O-CA 3.49Å; T107-C120 PolarHBondContact O-N 3.04Å; T107-G173 WeakPolarHBondContact CB-O 3.37Å; T107-G173 PolarHBondContact OG1-O 3.24Å; T107-F174 PolarHBondContact OG1-O 2.88Å; T107-A176 HydrophobicContact CG2-CB 3.97Å
108	V	92.1	Very high	88.1	Confident	3 Å²	3	25.7 Å²	25.7	2%	0.018	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	132.4	170.3	-157.3	0	0	0	0	103.8	I8 L45 V64 V117 L118 A119	I8-V108 HydrophobicContact CD1-CB 3.53Å; I8-V108 HydrophobicContact CD1-CG1 3.42Å; I8-V108 VanDerWaalsContact CD1-CG1 3.42Å; I8-V108 WeakPolarHBondContact CD1-O 3.43Å; I8-V108 HydrophobicContact CG1-CB 3.86Å; I8-V108 HydrophobicContact CG1-CG1 4.22Å; I8-V108 WeakPolarHBondContact CG1-O 3.34Å; L45-V108 HydrophobicContact CD1-CG1 4.48Å; V64-V108 HydrophobicContact CG1-CG1 4.08Å; V64-V108 HydrophobicContact CG2-CG1 4.22Å; V64-V108 HydrophobicContact CG2-CG2 3.89Å; V108-V117 HydrophobicContact CG1-CG1 3.97Å; V108-L118 CarbonylContact C-O 3.5Å; V108-L118 VanDerWaalsContact CA-O 3.3Å; V108-L118 WeakPolarHBondContact CA-O 3.08Å; V108-A119 HydrophobicContact CG1-CB 4.24Å
109	V	89.3	Confident	88.1	Confident	27 Å²	27	24.6 Å²	24.6	16%	0.164	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	151.8	171.4	-66.8	0	0	0	0	110.7	I8 T107 V117 L118 A176 I178	I8-V109 VanDerWaalsContact CD1-C 3.48Å; I8-V109 VanDerWaalsContact CD1-N 3.26Å; T107-V109 HydrophobicContact CG2-CG1 4.28Å; V109-V117 CarbonylContact O-C 3.55Å; V109-V117 WeakPolarHBondContact O-CA 3.43Å; V109-L118 HydrophobicContact CG2-CB 3.81Å; V109-L118 HydrophobicContact CG2-CD2 4.21Å; V109-L118 PolarHBondContact N-O 2.68Å; V109-L118 PolarHBondContact O-N 3.02Å; V109-A176 WeakPolarHBondContact CG1-O 3.35Å; V109-A176 HydrophobicContact CG2-CB 4.01Å; V109-I178 HydrophobicContact CG2-CD1 4.17Å; V109-I178 HydrophobicContact CG2-CG1 3.91Å
110	S	84.9	Confident	88.2	Confident	24 Å²	24	24 Å²	24	17%	0.168	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	151.8	175.5	76	0	0	0	0	110.5	Q9 S116	Q9-S110 PolarHBondContact O-OG 3.15Å; S110-S116 VanDerWaalsContact CA-O 3.3Å; S110-S116 WeakPolarHBondContact CA-O 3.39Å
111	S	80.5	Confident	88.2	Confident	6 Å²	6	22.9 Å²	22.9	4%	0.042	12%	0.118	C	C	.	.			trans	-69.1	155.6	171.7	54.4	0	0	0	0	110.5	N113 G114 D115 S116	S111-N113 WeakPolarHBondContact CB-OD1 3.37Å; S111-N113 PolarHBondContact O-N 2.99Å; S111-N113 PolarHBondContact OG-OD1 3.13Å; S111-G114 VanDerWaalsContact O-CA 3.31Å; S111-G114 WeakPolarHBondContact O-CA 3.2Å; S111-G114 PolarHBondContact O-N 2.89Å; S111-D115 PolarHBondContact OG-N 2.65Å; S111-S116 PolarHBondContact N-O 2.81Å; S111-S116 PolarHBondContact OG-N 2.96Å; S111-S116 PolarHBondContact OG-O 2.88Å
112	K	71.9	Confident	88.3	Confident	158 Å²	158	20.9 Å²	20.9	69%	0.687	11%	0.107	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-32	-178.7	-78.5	-177.7	-168.1	150.5	0	114.4	G114 D180	K112-G114 VanDerWaalsContact C-N 3.27Å; K112-D180 WeakPolarHBondContact CB-OD1 3.3Å; K112-D180 VanDerWaalsContact CD-CG 3.45Å; K112-D180 WeakPolarHBondContact CD-OD2 3.29Å; K112-D180 WeakPolarHBondContact CE-OD2 3.34Å; K112-D180 WeakPolarHBondContact CG-OD1 3.37Å; K112-D180 PolarHBondContact N-OD1 2.99Å; K112-D180 IonicContact NZ-OD2 3.7Å; K112-D180 PolarHBondContact NZ-OD2 2.04Å
113	N	69.6	Low	88.3	Confident	68 Å²	68	25.8 Å²	25.8	36%	0.364	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-12	173.1	61.8	-11.4	0	0	0	113.8	S111 D115	S111-N113 WeakPolarHBondContact CB-OD1 3.37Å; S111-N113 PolarHBondContact O-N 2.99Å; S111-N113 PolarHBondContact OG-OD1 3.13Å; N113-D115 VanDerWaalsContact C-N 3.26Å; N113-D115 PolarHBondContact ND2-OD2 3.36Å; N113-D115 PolarHBondContact O-N 2.83Å; N113-D115 PolarHBondContact OD1-N 2.92Å
114	G	71.6	Confident	88.3	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.01	12%	0.122	C	C	.	.	S	Bend	trans	64.4	19.1	-176.7	0	0	0	0	0	115.6	Q10 N11 S111 K112 S116	Q10-G114 PolarHBondContact NE2-O 2.9Å; N11-G114 WeakPolarHBondContact O-CA 3.16Å; S111-G114 VanDerWaalsContact O-CA 3.31Å; S111-G114 WeakPolarHBondContact O-CA 3.2Å; S111-G114 PolarHBondContact O-N 2.89Å; K112-G114 VanDerWaalsContact C-N 3.27Å; G114-S116 VanDerWaalsContact C-N 3.31Å
115	D	76.1	Confident	88.1	Confident	83 Å²	83	25.6 Å²	25.6	44%	0.444	13%	0.128	S	C	.	.	S	Bend	trans	-75.5	-21.7	175.6	-72.1	-30.3	0	0	0	113	S111 N113	S111-D115 PolarHBondContact OG-N 2.65Å; N113-D115 VanDerWaalsContact C-N 3.26Å; N113-D115 PolarHBondContact ND2-OD2 3.36Å; N113-D115 PolarHBondContact O-N 2.83Å; N113-D115 PolarHBondContact OD1-N 2.92Å
116	S	84.7	Confident	88	Confident	11 Å²	11	26.6 Å²	26.6	8%	0.077	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	135.6	-176.7	-65.4	0	0	0	0	111.7	S110 S111 G114 A143 Q144	S110-S116 VanDerWaalsContact CA-O 3.3Å; S110-S116 WeakPolarHBondContact CA-O 3.39Å; S111-S116 PolarHBondContact N-O 2.81Å; S111-S116 PolarHBondContact OG-N 2.96Å; S111-S116 PolarHBondContact OG-O 2.88Å; G114-S116 VanDerWaalsContact C-N 3.31Å; S116-A143 WeakPolarHBondContact CA-O 3.4Å; S116-Q144 PolarHBondContact OG-NE2 3.21Å
117	V	90.2	Very high	87.7	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.006	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	123.7	176.9	177.5	0	0	0	0	109	Q10 L45 F79 V108 V109 L142 A143 F147	Q10-V117 VanDerWaalsContact NE2-CG2 3.3Å; L45-V117 HydrophobicContact CD1-CB 4.36Å; L45-V117 HydrophobicContact CD1-CG1 3.59Å; L45-V117 HydrophobicContact CD1-CG2 3.78Å; F79-V117 HydrophobicContact CZ-CG1 4.23Å; V108-V117 HydrophobicContact CG1-CG1 3.97Å; V109-V117 CarbonylContact O-C 3.55Å; V109-V117 WeakPolarHBondContact O-CA 3.43Å; V117-L142 CarbonylContact O-C 3.45Å; V117-L142 WeakPolarHBondContact O-CA 3.44Å; V117-A143 HydrophobicContact CB-CB 4.37Å; V117-A143 PolarHBondContact N-O 3.38Å; V117-A143 PolarHBondContact O-N 2.83Å; V117-F147 HydrophobicContact CB-CE1 4.05Å; V117-F147 HydrophobicContact CB-CZ 4.49Å; V117-F147 HydrophobicContact CG1-CE1 4.29Å; V117-F147 HydrophobicContact CG2-CE1 3.96Å; V117-F147 HydrophobicContact CG2-CZ 3.92Å
118	L	92.3	Very high	86.7	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	126.3	175	-173.7	74.5	0	0	0	109	V108 V109 C140 Y141 L142 A176 I178 L185 I187	V108-L118 CarbonylContact C-O 3.5Å; V108-L118 VanDerWaalsContact CA-O 3.3Å; V108-L118 WeakPolarHBondContact CA-O 3.08Å; V109-L118 HydrophobicContact CG2-CB 3.81Å; V109-L118 HydrophobicContact CG2-CD2 4.21Å; V109-L118 PolarHBondContact N-O 2.68Å; V109-L118 PolarHBondContact O-N 3.02Å; L118-C140 HydrophobicContact CD1-CB 3.72Å; L118-C140 HydrophobicContact CG-CB 4.13Å; L118-Y141 WeakPolarHBondContact CA-O 3.04Å; L118-L142 HydrophobicContact CB-CD1 4.34Å; L118-L142 HydrophobicContact CD1-CB 4.17Å; L118-L142 HydrophobicContact CD1-CD1 4.25Å; L118-A176 HydrophobicContact CD2-CB 3.77Å; L118-I178 HydrophobicContact CB-CD1 3.9Å; L118-I178 HydrophobicContact CB-CG1 4.32Å; L118-L185 HydrophobicContact CD1-CD1 4.06Å; L118-L185 HydrophobicContact CD2-CD2 4.41Å; L118-I187 HydrophobicContact CD2-CG1 4.43Å
119	A	95.4	Very high	85.2	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	131.7	175.4	0	0	0	0	0	110.1	V64 F79 F104 T107 V108 C140 Y141	V64-A119 HydrophobicContact CG2-CB 3.74Å; F79-A119 HydrophobicContact CD1-CB 4.47Å; F79-A119 HydrophobicContact CE1-CB 3.99Å; F79-A119 HydrophobicContact CE2-CB 4.35Å; F79-A119 HydrophobicContact CZ-CB 3.92Å; F104-A119 HydrophobicContact CE1-CB 4.31Å; F104-A119 HydrophobicContact CE2-CB 3.79Å; F104-A119 WeakPolarHBondContact CE2-O 3.23Å; F104-A119 HydrophobicContact CZ-CB 3.5Å; T107-A119 CarbonylContact O-C 3.56Å; T107-A119 WeakPolarHBondContact O-CA 3.49Å; V108-A119 HydrophobicContact CG1-CB 4.24Å; A119-C140 CarbonylContact O-C 3.49Å; A119-C140 WeakPolarHBondContact O-CA 3.22Å; A119-Y141 PolarHBondContact N-O 2.82Å; A119-Y141 PolarHBondContact O-N 2.78Å
120	C	96.9	Very high	84.1	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	153.7	-171.6	-59.4	0	0	0	0	113.7	G105 A106 T107 T139 C140 G173	G105-C120 PolarHBondContact N-O 2.83Å; A106-C120 PolarHBondContact N-O 3.45Å; T107-C120 PolarHBondContact O-N 3.04Å; C120-T139 WeakPolarHBondContact CA-O 3.48Å; C120-C140 HydrophobicContact CB-CB 4.06Å; C120-C140 WeakPolarHBondContact CB-SG 3.38Å; C120-C140 WeakPolarHBondContact SG-CB 3.31Å; C120-C140 CovalentContact SG-SG 2.05Å; C120-C140 PolarHBondContact SG-SG 2.83Å; C120-G173 WeakPolarHBondContact CB-O 3.47Å
121	A	97.1	Very high	83.1	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	83.3	175.7	0	0	0	0	0	109.2	Q102 F104 R123 Y124 G138 T139	Q102-A121 HydrophobicContact CB-CB 4.19Å; Q102-A121 HydrophobicContact CG-CB 3.98Å; Q102-A121 CarbonylContact O-C 3.49Å; Q102-A121 WeakPolarHBondContact O-CA 3.46Å; Q102-A121 WeakPolarHBondContact O-CB 3.28Å; F104-A121 HydrophobicContact CB-CB 3.94Å; F104-A121 HydrophobicContact CD2-CB 4.01Å; F104-A121 HydrophobicContact CG-CB 4.49Å; A121-R123 PolarHBondContact O-N 3Å; A121-R123 VanDerWaalsContact O-N 3.12Å; A121-Y124 VanDerWaalsContact O-CB 3.31Å; A121-Y124 WeakPolarHBondContact O-CB 3.37Å; A121-Y124 PolarHBondContact O-N 2.64Å; A121-Y124 VanDerWaalsContact O-N 3.08Å; A121-G138 WeakPolarHBondContact O-CA 3.06Å; A121-T139 HydrophobicContact CB-CG2 4.09Å; A121-T139 PolarHBondContact N-O 2.91Å; A121-T139 PolarHBondContact O-N 2.98Å
122	P	95.7	Very high	82.6	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.013	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-15.8	-174.5	25.7	-34.3	0	0	0	113.7	A106 M171 F174	A106-P122 HydrophobicContact CB-CG 3.99Å; P122-M171 HydrophobicContact CB-CB 4.43Å; P122-M171 WeakPolarHBondContact O-CA 3.28Å; P122-M171 WeakPolarHBondContact O-CB 3.35Å; P122-F174 HydrophobicContact CB-CB 4.24Å; P122-F174 HydrophobicContact CB-CD2 4.4Å
123	R	95	Very high	82.7	Confident	108 Å²	108	39.8 Å²	39.8	41%	0.408	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	6	176.8	-62.6	-174.2	65.5	-167.3	-4.3	113.5	Q102 W103 A121 T125 M171	Q102-R123 CarbonylContact O-C 3.51Å; Q102-R123 WeakPolarHBondContact O-CA 3.36Å; Q102-R123 WeakPolarHBondContact O-CB 3.49Å; Q102-R123 PolarHBondContact O-N 2.9Å; Q102-R123 VanDerWaalsContact O-N 3.11Å; W103-R123 HydrophobicContact CB-CB 4.44Å; W103-R123 HydrophobicContact CB-CG 4.4Å; W103-R123 HydrophobicContact CD2-CG 4.42Å; W103-R123 HydrophobicContact CG-CG 4.26Å; A121-R123 PolarHBondContact O-N 3Å; A121-R123 VanDerWaalsContact O-N 3.12Å; R123-T125 PolarHBondContact O-N 3.12Å; R123-T125 PolarHBondContact O-OG1 2.64Å; R123-T125 VanDerWaalsContact O-OG1 3.13Å; R123-M171 HydrophobicContact CG-CE 4.23Å
124	Y	95.6	Very high	83.4	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.008	21%	0.206	C	C	.	.			trans	-54.9	127	171.8	169.4	-92.1	0	0	0	109.9	D97 K99 Q102 A121 P136 V137 G138 T139	D97-Y124 HydrophobicContact CB-CE2 3.83Å; D97-Y124 WeakPolarHBondContact CB-OH 3.31Å; D97-Y124 PolarHBondContact OD2-OH 2.71Å; K99-Y124 HydrophobicContact CG-CD2 4.26Å; K99-Y124 HydrophobicContact CG-CE2 4.1Å; Q102-Y124 PolarHBondContact O-N 2.78Å; A121-Y124 VanDerWaalsContact O-CB 3.31Å; A121-Y124 WeakPolarHBondContact O-CB 3.37Å; A121-Y124 PolarHBondContact O-N 2.64Å; A121-Y124 VanDerWaalsContact O-N 3.08Å; Y124-P136 CarbonylContact O-C 3.59Å; Y124-P136 WeakPolarHBondContact O-CA 3.17Å; Y124-V137 HydrophobicContact CD1-CG2 3.89Å; Y124-V137 HydrophobicContact CE1-CG2 4.01Å; Y124-V137 PolarHBondContact O-N 2.93Å; Y124-G138 PolarHBondContact O-N 2.94Å; Y124-G138 VanDerWaalsContact O-N 3.13Å; Y124-T139 HydrophobicContact CD1-CG2 3.95Å; Y124-T139 HydrophobicContact CD2-CG2 3.86Å; Y124-T139 HydrophobicContact CG-CG2 3.53Å
125	T	93.1	Very high	84.2	Confident	28 Å²	28	44 Å²	44	17%	0.172	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129	-172.9	-56.2	0	0	0	0	109.9	D97 S98 R123 F127 K134 E135	D97-T125 CarbonylContact C-O 3.43Å; D97-T125 VanDerWaalsContact CA-O 3.26Å; D97-T125 WeakPolarHBondContact CA-O 3.47Å; D97-T125 WeakPolarHBondContact CB-O 3.27Å; S98-T125 PolarHBondContact N-O 2.97Å; S98-T125 PolarHBondContact O-N 3.45Å; R123-T125 PolarHBondContact O-N 3.12Å; R123-T125 PolarHBondContact O-OG1 2.64Å; R123-T125 VanDerWaalsContact O-OG1 3.13Å; T125-F127 HydrophobicContact CG2-CD1 4.13Å; T125-F127 HydrophobicContact CG2-CE1 3.84Å; T125-K134 HydrophobicContact CG2-CB 3.74Å; T125-E135 CarbonylContact C-O 3.43Å; T125-E135 VanDerWaalsContact CA-O 3.28Å; T125-E135 WeakPolarHBondContact CA-O 3.3Å
126	Y	90.3	Very high	84.9	Confident	22 Å²	22	41.2 Å²	41.2	9%	0.086	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	139.6	173.6	-174.8	-115.4	0	0	0	110.2	I96 E135 R157	I96-Y126 HydrophobicContact CB-CE2 4.34Å; I96-Y126 HydrophobicContact CD1-CE2 4.42Å; I96-Y126 WeakPolarHBondContact O-CD2 3.31Å; I96-Y126 WeakPolarHBondContact O-CE2 3.29Å; Y126-E135 PolarHBondContact N-O 3.11Å; Y126-E135 PolarHBondContact O-N 2.88Å; Y126-R157 HydrophobicContact CD1-CG 3.94Å; Y126-R157 HydrophobicContact CD2-CG 4.1Å; Y126-R157 HydrophobicContact CE1-CG 4Å; Y126-R157 HydrophobicContact CE2-CG 4.17Å; Y126-R157 HydrophobicContact CG-CG 3.98Å
127	F	86	Confident	85.3	Confident	23 Å²	23	40.8 Å²	40.8	10%	0.101	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	115	175.2	-55.7	-9.2	0	0	0	107.1	Q95 I96 T125 R133 K134	Q95-F127 HydrophobicContact CG-CD2 4.38Å; Q95-F127 HydrophobicContact CG-CE2 3.92Å; Q95-F127 WeakPolarHBondContact O-CD2 3.4Å; I96-F127 PolarHBondContact O-N 3.19Å; T125-F127 HydrophobicContact CG2-CD1 4.13Å; T125-F127 HydrophobicContact CG2-CE1 3.84Å; F127-R133 WeakPolarHBondContact CA-O 3.39Å; F127-K134 HydrophobicContact CD1-CB 4.04Å; F127-K134 HydrophobicContact CD1-CD 4.11Å; F127-K134 HydrophobicContact CD1-CG 3.57Å; F127-K134 HydrophobicContact CE1-CB 4.1Å; F127-K134 HydrophobicContact CE1-CD 3.56Å; F127-K134 HydrophobicContact CE1-CG 3.57Å; F127-K134 HydrophobicContact CG-CG 4.35Å; F127-K134 HydrophobicContact CZ-CD 3.95Å; F127-K134 HydrophobicContact CZ-CG 4.32Å
128	Y	71.6	Confident	85.5	Confident	18 Å²	18	40.7 Å²	40.7	7%	0.071	19%	0.191	C	C	.	.			trans	-56.4	155.5	179.8	-173.2	-97.3	0	0	0	110.9	T130 F131 R133 E159 W162	Y128-T130 HydrophobicContact CD1-CG2 4.14Å; Y128-T130 WeakPolarHBondContact CD1-OG1 3.49Å; Y128-T130 HydrophobicContact CE1-CG2 3.97Å; Y128-T130 PolarHBondContact O-N 2.85Å; Y128-F131 WeakPolarHBondContact O-CA 3.2Å; Y128-F131 PolarHBondContact O-N 3.23Å; Y128-R133 PolarHBondContact N-O 3.49Å; Y128-E159 WeakPolarHBondContact CE2-O 3.49Å; Y128-E159 PolarHBondContact OH-O 3.16Å; Y128-E159 VanDerWaalsContact OH-O 3.06Å; Y128-W162 HydrophobicContact CD1-CE3 4.01Å; Y128-W162 HydrophobicContact CD1-CZ3 4.26Å; Y128-W162 HydrophobicContact CE1-CD2 4.36Å; Y128-W162 AromaticContact CE1-CE3 3.22Å; Y128-W162 HydrophobicContact CE1-CE3 3.22Å; Y128-W162 HydrophobicContact CE1-CH2 4.48Å; Y128-W162 AromaticContact CE1-CZ3 3.3Å; Y128-W162 HydrophobicContact CE1-CZ3 3.3Å; Y128-W162 HydrophobicContact CE2-CB 4.03Å; Y128-W162 HydrophobicContact CE2-CD2 4.35Å; Y128-W162 AromaticContact CE2-CE3 3.87Å; Y128-W162 HydrophobicContact CE2-CE3 3.87Å; Y128-W162 AromaticContact CZ-CD2 3.86Å; Y128-W162 AromaticContact CZ-CE3 3.11Å; Y128-W162 AromaticContact CZ-CZ3 3.54Å; Y128-W162 VanDerWaalsContact OH-CZ3 3.28Å; Y128-W162 WeakPolarHBondContact OH-CZ3 3.11Å
129	S	62.4	Low	85.7	Confident	65 Å²	65	40.7 Å²	40.7	46%	0.455	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-19.9	-172.1	56.2	0	0	0	0	115.4	F131	S129-F131 WeakPolarHBondContact O-CD2 3.4Å; S129-F131 VanDerWaalsContact O-CE2 3.3Å; S129-F131 WeakPolarHBondContact O-CE2 3.42Å
130	T	65.1	Low	85.7	Confident	63 Å²	63	40.7 Å²	40.7	39%	0.387	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-5.9	172.3	63	0	0	0	0	114.1	Y128 E132	Y128-T130 HydrophobicContact CD1-CG2 4.14Å; Y128-T130 WeakPolarHBondContact CD1-OG1 3.49Å; Y128-T130 HydrophobicContact CE1-CG2 3.97Å; Y128-T130 PolarHBondContact O-N 2.85Å; T130-E132 PolarHBondContact O-N 2.85Å; T130-E132 VanDerWaalsContact O-N 3.09Å
131	F	64.8	Low	85.6	Confident	62 Å²	62	41.9 Å²	41.9	27%	0.272	20%	0.196	S	C	.	.	S	Bend	trans	58.9	10.1	-175.6	-57.7	-88.8	0	0	0	115.4	N89 L94 Q95 I96 Y128 S129	N89-F131 HydrophobicContact CB-CE2 3.72Å; N89-F131 HydrophobicContact CB-CZ 4.28Å; N89-F131 WeakPolarHBondContact ND2-CD2 3.4Å; N89-F131 VanDerWaalsContact ND2-CE2 3.28Å; N89-F131 WeakPolarHBondContact ND2-CE2 3.42Å; L94-F131 HydrophobicContact CB-CD1 4.01Å; L94-F131 HydrophobicContact CB-CE1 3.32Å; L94-F131 HydrophobicContact CB-CE2 4.12Å; L94-F131 HydrophobicContact CB-CZ 3.38Å; L94-F131 HydrophobicContact CD1-CD1 4.13Å; L94-F131 HydrophobicContact CD1-CD2 3.62Å; L94-F131 HydrophobicContact CD1-CE1 4.01Å; L94-F131 HydrophobicContact CD1-CE2 3.51Å; L94-F131 HydrophobicContact CD1-CG 3.95Å; L94-F131 HydrophobicContact CD1-CZ 3.7Å; L94-F131 HydrophobicContact CG-CE1 4.3Å; L94-F131 HydrophobicContact CG-CE2 4.45Å; L94-F131 HydrophobicContact CG-CZ 4.17Å; Q95-F131 WeakPolarHBondContact O-CE1 3.47Å; I96-F131 HydrophobicContact CG2-CE1 3.92Å; I96-F131 HydrophobicContact CG2-CZ 3.97Å; Y128-F131 WeakPolarHBondContact O-CA 3.2Å; Y128-F131 PolarHBondContact O-N 3.23Å; S129-F131 WeakPolarHBondContact O-CD2 3.4Å; S129-F131 VanDerWaalsContact O-CE2 3.3Å; S129-F131 WeakPolarHBondContact O-CE2 3.42Å
132	E	69.6	Low	85.4	Confident	154 Å²	154	41.9 Å²	41.9	72%	0.72	20%	0.196	S	C	*	.	S	Bend	trans	-83.9	-13.4	-179.1	-66.1	178.9	160.8	0	0	113.1	T130	T130-E132 PolarHBondContact O-N 2.85Å; T130-E132 VanDerWaalsContact O-N 3.09Å
133	R	74.3	Confident	85.2	Confident	124 Å²	124	41.9 Å²	41.9	47%	0.468	20%	0.196	S	C	.	.			trans	-139.2	144.6	-170.9	-60.9	-174.3	-176.6	167.7	2.4	112.3	F127 Y128	F127-R133 WeakPolarHBondContact CA-O 3.39Å; Y128-R133 PolarHBondContact N-O 3.49Å
134	K	84.2	Confident	84.8	Confident	145 Å²	145	38.2 Å²	38.2	63%	0.63	18%	0.184	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-119.8	118.5	175.9	-60.8	-169.2	174.7	178.8	0	108.3	T125 F127	T125-K134 HydrophobicContact CG2-CB 3.74Å; F127-K134 HydrophobicContact CD1-CB 4.04Å; F127-K134 HydrophobicContact CD1-CD 4.11Å; F127-K134 HydrophobicContact CD1-CG 3.57Å; F127-K134 HydrophobicContact CE1-CB 4.1Å; F127-K134 HydrophobicContact CE1-CD 3.56Å; F127-K134 HydrophobicContact CE1-CG 3.57Å; F127-K134 HydrophobicContact CG-CG 4.35Å; F127-K134 HydrophobicContact CZ-CD 3.95Å; F127-K134 HydrophobicContact CZ-CG 4.32Å
135	E	87.6	Confident	84.2	Confident	12 Å²	12	43.7 Å²	43.7	6%	0.056	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	116.5	-167.8	-71.2	-175.4	164	0	0	109.9	T125 Y126 V137 G168	T125-E135 CarbonylContact C-O 3.43Å; T125-E135 VanDerWaalsContact CA-O 3.28Å; T125-E135 WeakPolarHBondContact CA-O 3.3Å; Y126-E135 PolarHBondContact N-O 3.11Å; Y126-E135 PolarHBondContact O-N 2.88Å; E135-V137 HydrophobicContact CB-CG1 3.98Å; E135-V137 PolarHBondContact O-N 2.99Å; E135-G168 CarbonylContact C-O 3.57Å; E135-G168 VanDerWaalsContact C-O 3.31Å; E135-G168 WeakPolarHBondContact CA-O 3.21Å; E135-G168 VanDerWaalsContact CB-O 3.3Å; E135-G168 WeakPolarHBondContact CB-O 3.22Å
136	P	91.7	Very high	83.6	Confident	26 Å²	26	45.5 Å²	45.5	17%	0.169	23%	0.227	C	C	.	.			trans	-76.2	68.8	178.3	33.2	-34.3	0	0	0	110.8	Y124 G138 G168 F169 M171	Y124-P136 CarbonylContact O-C 3.59Å; Y124-P136 WeakPolarHBondContact O-CA 3.17Å; P136-G138 VanDerWaalsContact C-N 3.28Å; P136-G138 PolarHBondContact O-N 3.49Å; P136-G168 CarbonylContact C-O 3.33Å; P136-G168 WeakPolarHBondContact CD-O 3.03Å; P136-F169 HydrophobicContact CG-CD1 3.69Å; P136-F169 HydrophobicContact CG-CE1 3.88Å; P136-F169 HydrophobicContact CG-CG 4.04Å; P136-F169 HydrophobicContact CG-CZ 4.32Å; P136-M171 HydrophobicContact CB-CG 4.49Å; P136-M171 PolarHBondContact O-N 3.46Å
137	V	92.9	Very high	83.3	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.006	23%	0.231	C	C	.	.			trans	-69	-26.6	-176.2	-64.5	0	0	0	0	112.9	Y124 E135 C156 R157 M171 A172	Y124-V137 HydrophobicContact CD1-CG2 3.89Å; Y124-V137 HydrophobicContact CE1-CG2 4.01Å; Y124-V137 PolarHBondContact O-N 2.93Å; E135-V137 HydrophobicContact CB-CG1 3.98Å; E135-V137 PolarHBondContact O-N 2.99Å; V137-C156 HydrophobicContact CB-CB 4.11Å; V137-R157 HydrophobicContact CG2-CB 4.45Å; V137-M171 PolarHBondContact O-N 2.78Å; V137-A172 WeakPolarHBondContact O-CB 3.26Å; V137-A172 PolarHBondContact O-N 2.9Å
138	G	94.7	Very high	83.3	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	77.6	157.3	-172.7	0	0	0	0	0	113.5	A121 Y124 P136 S154	A121-G138 WeakPolarHBondContact O-CA 3.06Å; Y124-G138 PolarHBondContact O-N 2.94Å; Y124-G138 VanDerWaalsContact O-N 3.13Å; P136-G138 VanDerWaalsContact C-N 3.28Å; P136-G138 PolarHBondContact O-N 3.49Å; G138-S154 PolarHBondContact O-OG 3.28Å
139	T	95.5	Very high	84.1	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	154.9	176.1	-166.5	0	0	0	0	109.9	C120 A121 Y124 Y141 E152	C120-T139 WeakPolarHBondContact CA-O 3.48Å; A121-T139 HydrophobicContact CB-CG2 4.09Å; A121-T139 PolarHBondContact N-O 2.91Å; A121-T139 PolarHBondContact O-N 2.98Å; Y124-T139 HydrophobicContact CD1-CG2 3.95Å; Y124-T139 HydrophobicContact CD2-CG2 3.86Å; Y124-T139 HydrophobicContact CG-CG2 3.53Å; T139-Y141 HydrophobicContact CG2-CE2 3.98Å; T139-E152 VanDerWaalsContact OG1-CG 3.26Å; T139-E152 WeakPolarHBondContact OG1-CG 3.29Å; T139-E152 PolarHBondContact OG1-OE1 3.33Å
140	C	95.5	Very high	85.5	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	155.2	173.6	-61.3	0	0	0	0	110.7	L118 A119 C120 E152 F153	L118-C140 HydrophobicContact CD1-CB 3.72Å; L118-C140 HydrophobicContact CG-CB 4.13Å; A119-C140 CarbonylContact O-C 3.49Å; A119-C140 WeakPolarHBondContact O-CA 3.22Å; C120-C140 HydrophobicContact CB-CB 4.06Å; C120-C140 WeakPolarHBondContact CB-SG 3.38Å; C120-C140 WeakPolarHBondContact SG-CB 3.31Å; C120-C140 CovalentContact SG-SG 2.05Å; C120-C140 PolarHBondContact SG-SG 2.83Å; C140-E152 CarbonylContact O-C 3.31Å; C140-E152 WeakPolarHBondContact O-CA 3.46Å; C140-F153 PolarHBondContact N-O 2.82Å; C140-F153 PolarHBondContact O-N 2.8Å
141	Y	95.2	Very high	86.8	Confident	24 Å²	24	55 Å²	55	9%	0.094	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	125.4	173.7	-71.9	-104.1	0	0	0	109.4	D80 F104 L118 A119 T139 R151 E152	D80-Y141 HydrophobicContact CB-CE1 4.03Å; F104-Y141 HydrophobicContact CD2-CD2 4.36Å; F104-Y141 AromaticContact CE2-CD2 3.75Å; F104-Y141 HydrophobicContact CE2-CD2 3.75Å; F104-Y141 HydrophobicContact CE2-CG 4.31Å; L118-Y141 WeakPolarHBondContact CA-O 3.04Å; A119-Y141 PolarHBondContact N-O 2.82Å; A119-Y141 PolarHBondContact O-N 2.78Å; T139-Y141 HydrophobicContact CG2-CE2 3.98Å; Y141-R151 CarbonylContact C-O 3.6Å; Y141-R151 VanDerWaalsContact CA-O 3.29Å; Y141-R151 WeakPolarHBondContact CA-O 3.27Å; Y141-E152 HydrophobicContact CD1-CB 4.25Å; Y141-E152 HydrophobicContact CE1-CB 3.86Å; Y141-E152 HydrophobicContact CE1-CG 4.19Å; Y141-E152 HydrophobicContact CE2-CG 4.17Å; Y141-E152 PolarHBondContact OH-OE1 3.46Å
142	L	92.8	Very high	88.1	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	120.2	174.2	-175.1	69.7	0	0	0	109.1	V117 L118 Q144 F150 R151 F153 L185 T204	V117-L142 CarbonylContact O-C 3.45Å; V117-L142 WeakPolarHBondContact O-CA 3.44Å; L118-L142 HydrophobicContact CB-CD1 4.34Å; L118-L142 HydrophobicContact CD1-CB 4.17Å; L118-L142 HydrophobicContact CD1-CD1 4.25Å; L142-Q144 HydrophobicContact CD2-CG 3.97Å; L142-Q144 HydrophobicContact CG-CG 3.93Å; L142-F150 CarbonylContact O-C 3.58Å; L142-F150 WeakPolarHBondContact O-CA 3.3Å; L142-R151 PolarHBondContact N-O 3.43Å; L142-R151 PolarHBondContact O-N 3.4Å; L142-F153 HydrophobicContact CB-CD2 3.95Å; L142-F153 HydrophobicContact CB-CE2 3.59Å; L142-F153 HydrophobicContact CD2-CE2 3.89Å; L142-F153 HydrophobicContact CD2-CZ 4.31Å; L142-F153 HydrophobicContact CG-CE2 4.4Å; L142-L185 HydrophobicContact CD1-CD2 4.11Å; L142-T204 HydrophobicContact CD2-CG2 3.76Å
143	A	91.7	Very high	89.2	Confident	3 Å²	3	47.2 Å²	47.2	3%	0.025	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	132.3	168.2	0	0	0	0	0	110.1	F79 S116 V117 F147 S149 F150	F79-A143 HydrophobicContact CD1-CB 4.3Å; F79-A143 HydrophobicContact CE1-CB 3.51Å; F79-A143 HydrophobicContact CZ-CB 3.91Å; S116-A143 WeakPolarHBondContact CA-O 3.4Å; V117-A143 HydrophobicContact CB-CB 4.37Å; V117-A143 PolarHBondContact N-O 3.38Å; V117-A143 PolarHBondContact O-N 2.83Å; A143-F147 HydrophobicContact CB-CD1 3.55Å; A143-F147 HydrophobicContact CB-CE1 4.01Å; A143-S149 CarbonylContact C-O 3.52Å; A143-S149 VanDerWaalsContact CA-O 3.3Å; A143-S149 WeakPolarHBondContact CA-O 3.36Å; A143-F150 HydrophobicContact CB-CD1 3.81Å; A143-F150 HydrophobicContact CB-CE1 3.76Å
144	Q	87	Confident	90	Very high	31 Å²	31	42 Å²	42	15%	0.145	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	167.1	176.6	-58.9	-175.7	-68.9	0	0	110.2	S116 L142 S146 F147 N148 S149	S116-Q144 PolarHBondContact OG-NE2 3.21Å; L142-Q144 HydrophobicContact CD2-CG 3.97Å; L142-Q144 HydrophobicContact CG-CG 3.93Å; Q144-S146 PolarHBondContact O-N 2.84Å; Q144-F147 PolarHBondContact O-N 3.34Å; Q144-N148 PolarHBondContact O-N 2.01Å; Q144-S149 PolarHBondContact N-O 3.06Å; Q144-S149 PolarHBondContact O-N 3.2Å
145	N	82.4	Confident	90.3	Very high	116 Å²	116	35.5 Å²	35.5	62%	0.62	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.8	51.4	176.6	-58.3	-23.2	0	0	0	112.4	F147 N148	N145-F147 PolarHBondContact O-N 3.47Å; N145-N148 HydrophobicContact CB-CB 4.39Å; N145-N148 WeakPolarHBondContact O-CB 3.46Å; N145-N148 PolarHBondContact O-N 3.1Å; N145-N148 PolarHBondContact O-ND2 3.07Å
146	S	79.3	Confident	90.4	Very high	66 Å²	66	35.1 Å²	35.1	46%	0.462	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	45.8	-178.6	-50.3	0	0	0	0	113.4	Q144 N148	Q144-S146 PolarHBondContact O-N 2.84Å; S146-N148 VanDerWaalsContact C-N 3.34Å; S146-N148 PolarHBondContact O-N 3.06Å
147	F	85.3	Confident	90.3	Very high	37 Å²	37	38.3 Å²	38.3	16%	0.162	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	27.1	179.5	-49.1	-81.6	0	0	0	114.9	L45 I77 F79 V117 A143 Q144 N145 F150	L45-F147 HydrophobicContact CD1-CZ 4.33Å; L45-F147 HydrophobicContact CD2-CZ 4.02Å; I77-F147 HydrophobicContact CD1-CD1 3.91Å; I77-F147 HydrophobicContact CD1-CE1 3.52Å; I77-F147 HydrophobicContact CD1-CE2 4.18Å; I77-F147 HydrophobicContact CD1-CG 4.41Å; I77-F147 HydrophobicContact CD1-CZ 3.66Å; I77-F147 HydrophobicContact CG2-CB 4.35Å; I77-F147 HydrophobicContact CG2-CD1 3.73Å; I77-F147 HydrophobicContact CG2-CE1 4.33Å; I77-F147 HydrophobicContact CG2-CG 4.16Å; F79-F147 HydrophobicContact CZ-CD1 4.39Å; F79-F147 HydrophobicContact CZ-CE1 4.24Å; V117-F147 HydrophobicContact CB-CE1 4.05Å; V117-F147 HydrophobicContact CB-CZ 4.49Å; V117-F147 HydrophobicContact CG1-CE1 4.29Å; V117-F147 HydrophobicContact CG2-CE1 3.96Å; V117-F147 HydrophobicContact CG2-CZ 3.92Å; A143-F147 HydrophobicContact CB-CD1 3.55Å; A143-F147 HydrophobicContact CB-CE1 4.01Å; Q144-F147 PolarHBondContact O-N 3.34Å; N145-F147 PolarHBondContact O-N 3.47Å; F147-F150 HydrophobicContact CB-CE1 4.29Å; F147-F150 HydrophobicContact CB-CZ 3.95Å; F147-F150 HydrophobicContact CD1-CE1 4.39Å; F147-F150 WeakPolarHBondContact O-CE2 3.42Å; F147-F150 WeakPolarHBondContact O-CZ 3.46Å
148	N	85.8	Confident	89.6	Confident	138 Å²	138	40.7 Å²	40.7	74%	0.738	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93	-20.3	173.8	-71.9	-46.5	0	0	0	113.7	Q144 N145 S146	Q144-N148 PolarHBondContact O-N 2.01Å; N145-N148 HydrophobicContact CB-CB 4.39Å; N145-N148 WeakPolarHBondContact O-CB 3.46Å; N145-N148 PolarHBondContact O-N 3.1Å; N145-N148 PolarHBondContact O-ND2 3.07Å; S146-N148 VanDerWaalsContact C-N 3.34Å; S146-N148 PolarHBondContact O-N 3.06Å
149	S	89.1	Confident	88.2	Confident	35 Å²	35	47.2 Å²	47.2	25%	0.245	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	127.6	178.5	173.7	0	0	0	0	109.7	A143 Q144	A143-S149 CarbonylContact C-O 3.52Å; A143-S149 VanDerWaalsContact CA-O 3.3Å; A143-S149 WeakPolarHBondContact CA-O 3.36Å; Q144-S149 PolarHBondContact N-O 3.06Å; Q144-S149 PolarHBondContact O-N 3.2Å
150	F	91.1	Very high	86.6	Confident	71 Å²	71	52.8 Å²	52.8	31%	0.311	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	133.8	176.9	-56.6	-81.9	0	0	0	109.8	I77 F79 L142 A143 F147	I77-F150 HydrophobicContact CG2-CE1 4.19Å; I77-F150 HydrophobicContact CG2-CZ 4.27Å; F79-F150 HydrophobicContact CB-CD1 4.28Å; F79-F150 HydrophobicContact CB-CE1 4.46Å; F79-F150 AromaticContact CD1-CD1 3.58Å; F79-F150 HydrophobicContact CD1-CD1 3.58Å; F79-F150 AromaticContact CD1-CE1 3.85Å; F79-F150 HydrophobicContact CD1-CE1 3.85Å; F79-F150 HydrophobicContact CD2-CE1 4.4Å; F79-F150 HydrophobicContact CE1-CD1 4.15Å; F79-F150 HydrophobicContact CE1-CE1 4.21Å; F79-F150 AromaticContact CG-CD1 3.99Å; F79-F150 HydrophobicContact CG-CD1 3.99Å; F79-F150 AromaticContact CG-CE1 3.97Å; F79-F150 HydrophobicContact CG-CE1 3.97Å; L142-F150 CarbonylContact O-C 3.58Å; L142-F150 WeakPolarHBondContact O-CA 3.3Å; A143-F150 HydrophobicContact CB-CD1 3.81Å; A143-F150 HydrophobicContact CB-CE1 3.76Å; F147-F150 HydrophobicContact CB-CE1 4.29Å; F147-F150 HydrophobicContact CB-CZ 3.95Å; F147-F150 HydrophobicContact CD1-CE1 4.39Å; F147-F150 WeakPolarHBondContact O-CE2 3.42Å; F147-F150 WeakPolarHBondContact O-CZ 3.46Å
151	R	91.5	Very high	84.7	Confident	109 Å²	109	61.6 Å²	61.6	41%	0.411	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	134	176.6	-66.6	-177.1	-180	176.3	-0.5	110.5	Y141 L142 F153 T204	Y141-R151 CarbonylContact C-O 3.6Å; Y141-R151 VanDerWaalsContact CA-O 3.29Å; Y141-R151 WeakPolarHBondContact CA-O 3.27Å; L142-R151 PolarHBondContact N-O 3.43Å; L142-R151 PolarHBondContact O-N 3.4Å; R151-F153 HydrophobicContact CB-CE2 3.93Å; R151-T204 PolarHBondContact NH1-O 2.72Å
152	E	93.2	Very high	82.7	Confident	48 Å²	48	66.9 Å²	66.9	22%	0.224	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	136.1	175.8	-173.6	-174.8	-148.7	0	0	110.4	T139 C140 Y141 R157	T139-E152 VanDerWaalsContact OG1-CG 3.26Å; T139-E152 WeakPolarHBondContact OG1-CG 3.29Å; T139-E152 PolarHBondContact OG1-OE1 3.33Å; C140-E152 CarbonylContact O-C 3.31Å; C140-E152 WeakPolarHBondContact O-CA 3.46Å; Y141-E152 HydrophobicContact CD1-CB 4.25Å; Y141-E152 HydrophobicContact CE1-CB 3.86Å; Y141-E152 HydrophobicContact CE1-CG 4.19Å; Y141-E152 HydrophobicContact CE2-CG 4.17Å; Y141-E152 PolarHBondContact OH-OE1 3.46Å; E152-R157 IonicContact OE1-NH1 3.35Å; E152-R157 IonicContact OE2-CZ 3.51Å; E152-R157 IonicContact OE2-NH1 2.83Å; E152-R157 PolarHBondContact OE2-NH1 2.77Å; E152-R157 IonicContact OE2-NH2 3.43Å; E152-R157 PolarHBondContact OE2-NH2 3.04Å
153	F	92.5	Very high	81.2	Confident	5 Å²	5	67 Å²	67	2%	0.022	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	106.2	172	-71.1	-90.1	0	0	0	108.9	C140 L142 R151 P155 L185 Q202	C140-F153 PolarHBondContact N-O 2.82Å; C140-F153 PolarHBondContact O-N 2.8Å; L142-F153 HydrophobicContact CB-CD2 3.95Å; L142-F153 HydrophobicContact CB-CE2 3.59Å; L142-F153 HydrophobicContact CD2-CE2 3.89Å; L142-F153 HydrophobicContact CD2-CZ 4.31Å; L142-F153 HydrophobicContact CG-CE2 4.4Å; R151-F153 HydrophobicContact CB-CE2 3.93Å; F153-P155 VanDerWaalsContact C-CD 3.49Å; F153-P155 WeakPolarHBondContact O-CD 3.42Å; F153-L185 HydrophobicContact CD1-CD1 4.2Å; F153-L185 HydrophobicContact CD2-CD1 4.07Å; F153-L185 HydrophobicContact CE1-CD1 4.18Å; F153-L185 HydrophobicContact CE2-CD1 4.06Å; F153-L185 HydrophobicContact CG-CD1 4.14Å; F153-L185 HydrophobicContact CZ-CD1 4.11Å; F153-Q202 VanDerWaalsContact CD1-CD 3.46Å; F153-Q202 HydrophobicContact CD1-CG 4.16Å; F153-Q202 HydrophobicContact CE1-CG 4.2Å
154	S	91.9	Very high	79.6	Confident	16 Å²	16	73.3 Å²	73.3	11%	0.112	35%	0.346	C	S	.	.			trans	-124	71.2	176.5	-168.6	0	0	0	0	110.7	G138 C156 R157	G138-S154 PolarHBondContact O-OG 3.28Å; S154-C156 PolarHBondContact O-N 2.7Å; S154-C156 VanDerWaalsContact O-N 3.08Å; S154-R157 WeakPolarHBondContact O-CB 3.26Å; S154-R157 PolarHBondContact O-N 3.01Å; S154-R157 VanDerWaalsContact O-N 3.1Å; S154-R157 WeakPolarHBondContact OG-CB 3.33Å
155	P	90.1	Very high	78.7	Confident	8 Å²	8	74.8 Å²	74.8	5%	0.052	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-12	-170.3	27.9	-36.9	0	0	0	114.3	F153 A172 I187 I200 V210 R212	F153-P155 VanDerWaalsContact C-CD 3.49Å; F153-P155 WeakPolarHBondContact O-CD 3.42Å; P155-A172 HydrophobicContact CG-CB 4.3Å; P155-I187 HydrophobicContact CG-CD1 4.43Å; P155-I200 HydrophobicContact CB-CD1 4.06Å; P155-I200 HydrophobicContact CB-CG2 3.79Å; P155-I200 HydrophobicContact CG-CD1 3.67Å; P155-I200 HydrophobicContact CG-CG2 3.89Å; P155-V210 HydrophobicContact CB-CG1 3.99Å; P155-R212 PolarHBondContact O-NE 2.04Å; P155-R212 PolarHBondContact O-NH2 2.77Å
156	C	90.3	Very high	78.7	Confident	3 Å²	3	74.4 Å²	74.4	2%	0.02	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-4.6	177.4	-73.6	0	0	0	0	113.8	V137 S154 M158 L167 C170 I200	V137-C156 HydrophobicContact CB-CB 4.11Å; S154-C156 PolarHBondContact O-N 2.7Å; S154-C156 VanDerWaalsContact O-N 3.08Å; C156-M158 PolarHBondContact O-N 3.05Å; C156-L167 HydrophobicContact CB-CB 4.42Å; C156-C170 HydrophobicContact CB-CB 3.3Å; C156-C170 WeakPolarHBondContact CB-SG 3.18Å; C156-C170 WeakPolarHBondContact SG-CB 3.13Å; C156-C170 CovalentContact SG-SG 2.02Å; C156-C170 PolarHBondContact SG-SG 2.83Å; C156-I200 VanDerWaalsContact SG-CD1 3.56Å
157	R	87.6	Confident	79.1	Confident	94 Å²	94	71.8 Å²	71.8	36%	0.355	32%	0.323	S	S	.	.			trans	-78.1	102.3	172.2	-176.4	170.3	69.3	-163.6	-1.1	109.2	Y126 V137 E152 S154	Y126-R157 HydrophobicContact CD1-CG 3.94Å; Y126-R157 HydrophobicContact CD2-CG 4.1Å; Y126-R157 HydrophobicContact CE1-CG 4Å; Y126-R157 HydrophobicContact CE2-CG 4.17Å; Y126-R157 HydrophobicContact CG-CG 3.98Å; V137-R157 HydrophobicContact CG2-CB 4.45Å; E152-R157 IonicContact OE1-NH1 3.35Å; E152-R157 IonicContact OE2-CZ 3.51Å; E152-R157 IonicContact OE2-NH1 2.83Å; E152-R157 PolarHBondContact OE2-NH1 2.77Å; E152-R157 IonicContact OE2-NH2 3.43Å; E152-R157 PolarHBondContact OE2-NH2 3.04Å; S154-R157 WeakPolarHBondContact O-CB 3.26Å; S154-R157 PolarHBondContact O-N 3.01Å; S154-R157 VanDerWaalsContact O-N 3.1Å; S154-R157 WeakPolarHBondContact OG-CB 3.33Å
158	M	78.7	Confident	79.1	Confident	50 Å²	50	70.2 Å²	70.2	25%	0.246	32%	0.318	C	S	.	.			trans	-121.9	136.6	178.5	-65.4	-165.9	175.8	0	0	111.7	C156 R161 L167	C156-M158 PolarHBondContact O-N 3.05Å; M158-R161 HydrophobicContact SD-CB 4.11Å; M158-L167 HydrophobicContact CE-CD1 3.48Å; M158-L167 VanDerWaalsContact CE-CD1 3.48Å; M158-L167 HydrophobicContact SD-CD1 3.74Å
159	E	66.4	Low	79.4	Confident	137 Å²	137	65.8 Å²	65.8	64%	0.64	29%	0.292	S	S	*	.	S	Bend	trans	-84	-25.8	178.6	-67.1	-166.6	164.6	0	0	113.9	Y128	Y128-E159 WeakPolarHBondContact CE2-O 3.49Å; Y128-E159 PolarHBondContact OH-O 3.16Å; Y128-E159 VanDerWaalsContact OH-O 3.06Å
160	T	60.8	Low	79.5	Confident	118 Å²	118	64.1 Å²	64.1	72%	0.724	28%	0.28	S	S	*	.	S	Bend	trans	-120.3	-8	-166.5	55.1	0	0	0	0	115.3
161	R	56	Low	79.7	Confident	184 Å²	184	63 Å²	63	69%	0.694	28%	0.277	S	S	*	.	S	Bend	trans	-126.1	63.6	-177.4	-69.1	-173.1	-178.7	-176.5	1.6	111.9	M158	M158-R161 HydrophobicContact SD-CB 4.11Å
162	W	54	Low	79.8	Confident	136 Å²	136	57.9 Å²	57.9	52%	0.515	26%	0.257	S	S	.	.			trans	-71.4	157.4	-178.8	48.8	9.1	0	0	0	116.3	Y128	Y128-W162 HydrophobicContact CD1-CE3 4.01Å; Y128-W162 HydrophobicContact CD1-CZ3 4.26Å; Y128-W162 HydrophobicContact CE1-CD2 4.36Å; Y128-W162 AromaticContact CE1-CE3 3.22Å; Y128-W162 HydrophobicContact CE1-CE3 3.22Å; Y128-W162 HydrophobicContact CE1-CH2 4.48Å; Y128-W162 AromaticContact CE1-CZ3 3.3Å; Y128-W162 HydrophobicContact CE1-CZ3 3.3Å; Y128-W162 HydrophobicContact CE2-CB 4.03Å; Y128-W162 HydrophobicContact CE2-CD2 4.35Å; Y128-W162 AromaticContact CE2-CE3 3.87Å; Y128-W162 HydrophobicContact CE2-CE3 3.87Å; Y128-W162 AromaticContact CZ-CD2 3.86Å; Y128-W162 AromaticContact CZ-CE3 3.11Å; Y128-W162 AromaticContact CZ-CZ3 3.54Å; Y128-W162 VanDerWaalsContact OH-CZ3 3.28Å; Y128-W162 WeakPolarHBondContact OH-CZ3 3.11Å
163	G	59.7	Low	79.9	Confident	3 Å²	3	55.6 Å²	55.6	3%	0.031	25%	0.246	C	C	.	.			trans	153.8	130.8	164.8	0	0	0	0	0	113.1	H165 R166	G163-H165 PolarHBondContact O-N 3.15Å; G163-R166 PolarHBondContact O-N 3.22Å
164	Y	59.6	Low	80	Confident	135 Å²	135	56.1 Å²	56.1	53%	0.529	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-44.3	-32	171.2	171.1	-94.3	0	0	0	112.7	F169 W195	Y164-F169 AromaticContact CD2-CD2 3.79Å; Y164-F169 HydrophobicContact CD2-CD2 3.79Å; Y164-F169 HydrophobicContact CD2-CE1 4.28Å; Y164-F169 AromaticContact CD2-CE2 3.15Å; Y164-F169 HydrophobicContact CD2-CE2 3.15Å; Y164-F169 AromaticContact CD2-CZ 3.43Å; Y164-F169 HydrophobicContact CD2-CZ 3.43Å; Y164-F169 VanDerWaalsContact CD2-CZ 3.43Å; Y164-F169 HydrophobicContact CE2-CD1 4.45Å; Y164-F169 HydrophobicContact CE2-CD2 4.19Å; Y164-F169 AromaticContact CE2-CE1 3.79Å; Y164-F169 HydrophobicContact CE2-CE1 3.79Å; Y164-F169 AromaticContact CE2-CE2 3.56Å; Y164-F169 HydrophobicContact CE2-CE2 3.56Å; Y164-F169 AromaticContact CE2-CZ 3.31Å; Y164-F169 HydrophobicContact CE2-CZ 3.31Å; Y164-F169 HydrophobicContact CG-CD2 4.3Å; Y164-F169 HydrophobicContact CG-CE2 4.03Å; Y164-F169 VanDerWaalsContact O-CD2 3.26Å; Y164-F169 WeakPolarHBondContact O-CD2 3.38Å; Y164-W195 HydrophobicContact CD1-CH2 4.26Å; Y164-W195 HydrophobicContact CD1-CZ3 4.48Å; Y164-W195 AromaticContact CE1-CH2 3.52Å; Y164-W195 HydrophobicContact CE1-CH2 3.52Å; Y164-W195 AromaticContact CE1-CZ3 3.83Å; Y164-W195 HydrophobicContact CE1-CZ3 3.83Å; Y164-W195 HydrophobicContact CE2-CH2 4.17Å; Y164-W195 AromaticContact CZ-CH2 3.46Å; Y164-W195 VanDerWaalsContact CZ-CH2 3.46Å; Y164-W195 WeakPolarHBondContact OH-CH2 3.39Å
165	H	66.5	Low	80.2	Confident	62 Å²	62	55.9 Å²	55.9	29%	0.287	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-3.3	-173.1	46.3	-87	0	0	0	115.2	G163 W193 Y194	G163-H165 PolarHBondContact O-N 3.15Å; H165-W193 CarbonylContact O-C 3.58Å; H165-W193 WeakPolarHBondContact O-CA 3.3Å; H165-Y194 HydrophobicContact CB-CD1 3.54Å; H165-Y194 HydrophobicContact CB-CD2 4.07Å; H165-Y194 HydrophobicContact CB-CE1 3.15Å; H165-Y194 HydrophobicContact CB-CE2 3.7Å; H165-Y194 HydrophobicContact CB-CG 4Å; H165-Y194 AromaticContact CD2-CE2 3.96Å; H165-Y194 AromaticContact CD2-CZ 3.6Å; H165-Y194 PolarHBondContact CD2-OH 3.08Å; H165-Y194 AromaticContact CG-CE1 3.91Å; H165-Y194 AromaticContact CG-CZ 3.61Å; H165-Y194 VanDerWaalsContact O-CD2 3.26Å; H165-Y194 WeakPolarHBondContact O-CD2 3.44Å; H165-Y194 PolarHBondContact O-N 2.89Å
166	R	82.5	Confident	80.3	Confident	107 Å²	107	55.9 Å²	55.9	40%	0.404	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109	-106.7	-178.4	-66.8	-177.9	174.7	178	-1	110.6	G163 A192 W193	G163-R166 PolarHBondContact O-N 3.22Å; R166-A192 CarbonylContact O-C 3.56Å; R166-A192 WeakPolarHBondContact O-CA 2.87Å; R166-W193 HydrophobicContact CB-CE3 3.98Å; R166-W193 HydrophobicContact CB-CZ3 3.75Å; R166-W193 HydrophobicContact CG-CE3 4.12Å; R166-W193 HydrophobicContact CG-CZ3 3.9Å; R166-W193 PolarHBondContact O-N 3.33Å
167	L	88.3	Confident	80.3	Confident	11 Å²	11	56.2 Å²	56.2	6%	0.058	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-5.1	-178.5	-61.3	177.3	0	0	0	113.2	C156 M158 F169 C170 A192 W193	C156-L167 HydrophobicContact CB-CB 4.42Å; M158-L167 HydrophobicContact CE-CD1 3.48Å; M158-L167 VanDerWaalsContact CE-CD1 3.48Å; M158-L167 HydrophobicContact SD-CD1 3.74Å; L167-F169 PolarHBondContact O-N 3.08Å; L167-C170 WeakPolarHBondContact O-CB 3.49Å; L167-C170 PolarHBondContact O-N 2.76Å; L167-C170 VanDerWaalsContact O-N 3.13Å; L167-A192 HydrophobicContact CD2-CB 3.98Å; L167-W193 HydrophobicContact CD1-CH2 4.29Å; L167-W193 HydrophobicContact CD1-CZ2 4.42Å; L167-W193 HydrophobicContact CD2-CD2 4.39Å; L167-W193 HydrophobicContact CD2-CH2 4.14Å; L167-W193 HydrophobicContact CD2-CZ2 3.79Å; L167-W193 HydrophobicContact CG-CH2 4.04Å; L167-W193 HydrophobicContact CG-CZ2 4.18Å; L167-W193 HydrophobicContact CG-CZ3 4.42Å
168	G	86.3	Confident	80.3	Confident	5 Å²	5	52.4 Å²	52.4	5%	0.052	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-28.8	-179.2	0	0	0	0	0	113.7	E135 P136	E135-G168 CarbonylContact C-O 3.57Å; E135-G168 VanDerWaalsContact C-O 3.31Å; E135-G168 WeakPolarHBondContact CA-O 3.21Å; E135-G168 VanDerWaalsContact CB-O 3.3Å; E135-G168 WeakPolarHBondContact CB-O 3.22Å; P136-G168 CarbonylContact C-O 3.33Å; P136-G168 WeakPolarHBondContact CD-O 3.03Å
169	F	90.6	Very high	80.5	Confident	45 Å²	45	50.1 Å²	50.1	20%	0.197	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	15.6	178.5	-81.8	-110.1	0	0	0	112.8	P136 Y164 L167 M171 G191 W195	P136-F169 HydrophobicContact CG-CD1 3.69Å; P136-F169 HydrophobicContact CG-CE1 3.88Å; P136-F169 HydrophobicContact CG-CG 4.04Å; P136-F169 HydrophobicContact CG-CZ 4.32Å; Y164-F169 AromaticContact CD2-CD2 3.79Å; Y164-F169 HydrophobicContact CD2-CD2 3.79Å; Y164-F169 HydrophobicContact CD2-CE1 4.28Å; Y164-F169 AromaticContact CD2-CE2 3.15Å; Y164-F169 HydrophobicContact CD2-CE2 3.15Å; Y164-F169 AromaticContact CD2-CZ 3.43Å; Y164-F169 HydrophobicContact CD2-CZ 3.43Å; Y164-F169 VanDerWaalsContact CD2-CZ 3.43Å; Y164-F169 HydrophobicContact CE2-CD1 4.45Å; Y164-F169 HydrophobicContact CE2-CD2 4.19Å; Y164-F169 AromaticContact CE2-CE1 3.79Å; Y164-F169 HydrophobicContact CE2-CE1 3.79Å; Y164-F169 AromaticContact CE2-CE2 3.56Å; Y164-F169 HydrophobicContact CE2-CE2 3.56Å; Y164-F169 AromaticContact CE2-CZ 3.31Å; Y164-F169 HydrophobicContact CE2-CZ 3.31Å; Y164-F169 HydrophobicContact CG-CD2 4.3Å; Y164-F169 HydrophobicContact CG-CE2 4.03Å; Y164-F169 VanDerWaalsContact O-CD2 3.26Å; Y164-F169 WeakPolarHBondContact O-CD2 3.38Å; L167-F169 PolarHBondContact O-N 3.08Å; F169-M171 WeakPolarHBondContact O-CG 3.38Å; F169-M171 PolarHBondContact O-N 2.91Å; F169-G191 CarbonylContact C-O 3.5Å; F169-G191 VanDerWaalsContact C-O 3.27Å; F169-G191 CarbonylContact O-C 3.56Å; F169-G191 VanDerWaalsContact O-C 3.25Å; F169-G191 WeakPolarHBondContact O-CA 3.08Å; F169-W195 HydrophobicContact CB-CH2 4.34Å; F169-W195 HydrophobicContact CB-CZ2 3.99Å; F169-W195 HydrophobicContact CD1-CH2 4.07Å; F169-W195 AromaticContact CD1-CZ2 3.52Å; F169-W195 HydrophobicContact CD1-CZ2 3.52Å; F169-W195 HydrophobicContact CE1-CZ2 4.27Å; F169-W195 HydrophobicContact CG-CH2 4.14Å; F169-W195 AromaticContact CG-CZ2 3.89Å; F169-W195 HydrophobicContact CG-CZ2 3.89Å
170	C	91.6	Very high	80.6	Confident	0 Å²	0	46 Å²	46	0%	0	21%	0.209	C	C	.	.			trans	-48.4	-38	-173.5	166.8	0	0	0	0	114.9	C156 L167 A172 A189 G191 A192	C156-C170 HydrophobicContact CB-CB 3.3Å; C156-C170 WeakPolarHBondContact CB-SG 3.18Å; C156-C170 WeakPolarHBondContact SG-CB 3.13Å; C156-C170 CovalentContact SG-SG 2.02Å; C156-C170 PolarHBondContact SG-SG 2.83Å; L167-C170 WeakPolarHBondContact O-CB 3.49Å; L167-C170 PolarHBondContact O-N 2.76Å; L167-C170 VanDerWaalsContact O-N 3.13Å; C170-A172 PolarHBondContact O-N 3.04Å; C170-A189 CarbonylContact O-C 3.47Å; C170-A189 VanDerWaalsContact O-CA 3.22Å; C170-A189 WeakPolarHBondContact O-CA 3.27Å; C170-A189 WeakPolarHBondContact O-CB 3.39Å; C170-A189 WeakPolarHBondContact SG-CB 3.38Å; C170-G191 PolarHBondContact O-N 3.28Å; C170-A192 HydrophobicContact CB-CB 4.46Å
171	M	94.7	Very high	80.9	Confident	48 Å²	48	45.5 Å²	45.5	24%	0.236	20%	0.198	C	C	.	.			trans	51.6	42.9	-175.3	-61.4	179.4	76.8	0	0	112	P122 R123 P136 V137 F169 G173 F174	P122-M171 HydrophobicContact CB-CB 4.43Å; P122-M171 WeakPolarHBondContact O-CA 3.28Å; P122-M171 WeakPolarHBondContact O-CB 3.35Å; R123-M171 HydrophobicContact CG-CE 4.23Å; P136-M171 HydrophobicContact CB-CG 4.49Å; P136-M171 PolarHBondContact O-N 3.46Å; V137-M171 PolarHBondContact O-N 2.78Å; F169-M171 WeakPolarHBondContact O-CG 3.38Å; F169-M171 PolarHBondContact O-N 2.91Å; M171-G173 PolarHBondContact O-N 3.29Å; M171-F174 PolarHBondContact O-N 2.77Å
172	A	95.2	Very high	81.4	Confident	0 Å²	0	40 Å²	40	0%	0	18%	0.182	C	C	.	.	B	Isolated β-bridge	trans	-53.6	132.5	-179	0	0	0	0	0	111.1	V137 P155 C170 I187 I200	V137-A172 WeakPolarHBondContact O-CB 3.26Å; V137-A172 PolarHBondContact O-N 2.9Å; P155-A172 HydrophobicContact CG-CB 4.3Å; C170-A172 PolarHBondContact O-N 3.04Å; A172-I187 HydrophobicContact CB-CG2 4.04Å; A172-I200 HydrophobicContact CB-CD1 4.49Å
173	G	94.7	Very high	82.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.2	21.7	-179.1	0	0	0	0	0	113.4	T107 C120 M171 G188	T107-G173 WeakPolarHBondContact CB-O 3.37Å; T107-G173 PolarHBondContact OG1-O 3.24Å; C120-G173 WeakPolarHBondContact CB-O 3.47Å; M171-G173 PolarHBondContact O-N 3.29Å; G173-G188 PolarHBondContact N-O 2.88Å
174	F	95	Very high	83.7	Confident	17 Å²	17	38.9 Å²	38.9	8%	0.075	18%	0.184	C	C	.	.	S	Bend	trans	-66.3	-32.3	167.3	-172.7	-86.8	0	0	0	111.8	K2 T107 P122 M171 G188 P190 Y227	K2-F174 HydrophobicContact CB-CE1 4.4Å; K2-F174 HydrophobicContact CB-CZ 4.45Å; T107-F174 PolarHBondContact OG1-O 2.88Å; P122-F174 HydrophobicContact CB-CB 4.24Å; P122-F174 HydrophobicContact CB-CD2 4.4Å; M171-F174 PolarHBondContact O-N 2.77Å; F174-G188 PolarHBondContact N-O 2.82Å; F174-P190 HydrophobicContact CB-CG 3.69Å; F174-P190 HydrophobicContact CD1-CG 4Å; F174-P190 HydrophobicContact CD2-CG 4.23Å; F174-P190 HydrophobicContact CG-CG 3.7Å; F174-Y227 HydrophobicContact CD1-CD2 4.39Å; F174-Y227 HydrophobicContact CD1-CG 4.42Å; F174-Y227 VanDerWaalsContact CD1-O 3.3Å; F174-Y227 WeakPolarHBondContact CD1-O 3.38Å; F174-Y227 AromaticContact CE1-CD1 3.92Å; F174-Y227 HydrophobicContact CE1-CD1 3.92Å; F174-Y227 AromaticContact CE1-CD2 3.59Å; F174-Y227 HydrophobicContact CE1-CD2 3.59Å; F174-Y227 AromaticContact CE1-CE1 3.95Å; F174-Y227 HydrophobicContact CE1-CE1 3.95Å; F174-Y227 AromaticContact CE1-CE2 3.66Å; F174-Y227 HydrophobicContact CE1-CE2 3.66Å; F174-Y227 AromaticContact CE1-CG 3.74Å; F174-Y227 HydrophobicContact CE1-CG 3.74Å; F174-Y227 AromaticContact CE1-CZ 3.83Å; F174-Y227 WeakPolarHBondContact CE1-O 3.29Å; F174-Y227 HydrophobicContact CZ-CD2 4.01Å; F174-Y227 HydrophobicContact CZ-CE1 4.36Å; F174-Y227 AromaticContact CZ-CE2 3.64Å; F174-Y227 HydrophobicContact CZ-CE2 3.64Å; F174-Y227 AromaticContact CZ-CZ 3.83Å
175	S	94.9	Very high	85.2	Confident	10 Å²	10	32.5 Å²	32.5	7%	0.07	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	157.7	165.1	64.4	0	0	0	0	108.4	G188 G226 I229	S175-G188 PolarHBondContact O-N 2.98Å; S175-G226 PolarHBondContact OG-O 3.03Å; S175-I229 WeakPolarHBondContact OG-CD1 3.41Å; S175-I229 WeakPolarHBondContact OG-CG1 3.32Å
176	A	93.6	Very high	86.5	Confident	8 Å²	8	29.5 Å²	29.5	7%	0.066	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	163	177.8	0	0	0	0	0	111.6	T107 V109 L118 F186	T107-A176 HydrophobicContact CG2-CB 3.97Å; V109-A176 WeakPolarHBondContact CG1-O 3.35Å; V109-A176 HydrophobicContact CG2-CB 4.01Å; L118-A176 HydrophobicContact CD2-CB 3.77Å; A176-F186 CarbonylContact C-O 3.59Å; A176-F186 WeakPolarHBondContact CA-O 3.44Å; A176-F186 WeakPolarHBondContact CB-O 3.18Å
177	A	90.3	Very high	87.1	Confident	10 Å²	10	24.4 Å²	24.4	8%	0.083	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	158.6	166	0	0	0	0	0	109.9	F186 I229 A231	A177-F186 HydrophobicContact CB-CB 4.34Å; A177-F186 HydrophobicContact CB-CD2 4.4Å; A177-F186 PolarHBondContact N-O 3.21Å; A177-F186 PolarHBondContact O-N 3.12Å; A177-I229 HydrophobicContact CB-CG2 3.66Å; A177-A231 HydrophobicContact CB-CB 4.2Å
178	I	87	Confident	87.4	Confident	14 Å²	14	23.9 Å²	23.9	7%	0.072	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	134.4	175.8	-55.9	178.3	0	0	0	108	V109 L118 L185	V109-I178 HydrophobicContact CG2-CD1 4.17Å; V109-I178 HydrophobicContact CG2-CG1 3.91Å; L118-I178 HydrophobicContact CB-CD1 3.9Å; L118-I178 HydrophobicContact CB-CG1 4.32Å; I178-L185 HydrophobicContact CD1-CD2 4.47Å; I178-L185 HydrophobicContact CG1-CD2 3.97Å; I178-L185 HydrophobicContact CG2-CD2 4.27Å
179	S	81.8	Confident	87.9	Confident	3 Å²	3	23.7 Å²	23.7	2%	0.021	12%	0.121	C	C	.	.			trans	-74.3	128.1	171.9	178.1	0	0	0	0	110.8	N182 K184 N240	S179-N182 PolarHBondContact OG-N 3.02Å; S179-K184 WeakPolarHBondContact CB-O 3.49Å; S179-K184 PolarHBondContact N-O 2.86Å; S179-N240 WeakPolarHBondContact CA-ND2 3.32Å; S179-N240 PolarHBondContact OG-ND2 2.77Å
180	D	68.4	Low	88.1	Confident	50 Å²	50	21.9 Å²	21.9	27%	0.267	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-35	174.6	-56.7	-42.2	0	0	0	114.1	K112 N240	K112-D180 WeakPolarHBondContact CB-OD1 3.3Å; K112-D180 VanDerWaalsContact CD-CG 3.45Å; K112-D180 WeakPolarHBondContact CD-OD2 3.29Å; K112-D180 WeakPolarHBondContact CE-OD2 3.34Å; K112-D180 WeakPolarHBondContact CG-OD1 3.37Å; K112-D180 PolarHBondContact N-OD1 2.99Å; K112-D180 IonicContact NZ-OD2 3.7Å; K112-D180 PolarHBondContact NZ-OD2 2.04Å; D180-N240 PolarHBondContact N-ND2 2.93Å
181	E	67.6	Low	88.1	Confident	107 Å²	107	22 Å²	22	50%	0.5	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-39.7	-170.8	-63	-169.4	161.6	0	0	113	S238	E181-S238 WeakPolarHBondContact OE2-CA 3.48Å; E181-S238 VanDerWaalsContact OE2-CB 3.31Å; E181-S238 WeakPolarHBondContact OE2-CB 3.34Å
182	N	66	Low	88	Confident	69 Å²	69	19.7 Å²	19.7	37%	0.369	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	10.5	-162.3	-71.5	-24.9	0	0	0	114.4	S179 K184	S179-N182 PolarHBondContact OG-N 3.02Å; N182-K184 HydrophobicContact CB-CD 4.22Å; N182-K184 HydrophobicContact CB-CG 4.19Å; N182-K184 PolarHBondContact O-N 2.89Å; N182-K184 VanDerWaalsContact O-N 3.11Å
183	N	77	Confident	87.9	Confident	79 Å²	79	21.5 Å²	21.5	42%	0.422	11%	0.11	S	C	.	.			trans	51.7	39.3	179.9	-80.4	-6.5	0	0	0	111.5	G203 T204	N183-G203 CarbonylContact O-C 3.58Å; N183-G203 WeakPolarHBondContact O-CA 3.1Å; N183-T204 WeakPolarHBondContact CB-OG1 3.47Å; N183-T204 WeakPolarHBondContact O-CG2 3.45Å; N183-T204 PolarHBondContact O-N 3.33Å; N183-T204 PolarHBondContact O-OG1 3.48Å
184	K	86.8	Confident	87.7	Confident	37 Å²	37	25.7 Å²	25.7	16%	0.161	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	141.6	179.4	-73.4	-179.9	178.9	-178.6	0	110.2	S179 N182 V201 D267	S179-K184 WeakPolarHBondContact CB-O 3.49Å; S179-K184 PolarHBondContact N-O 2.86Å; N182-K184 HydrophobicContact CB-CD 4.22Å; N182-K184 HydrophobicContact CB-CG 4.19Å; N182-K184 PolarHBondContact O-N 2.89Å; N182-K184 VanDerWaalsContact O-N 3.11Å; K184-V201 HydrophobicContact CB-CG1 4.45Å; K184-V201 HydrophobicContact CD-CG1 4.01Å; K184-V201 HydrophobicContact CG-CG1 4.48Å; K184-D267 HydrophobicContact CD-CB 4.29Å; K184-D267 PolarHBondContact NZ-O 3.43Å; K184-D267 IonicContact NZ-OD2 3.59Å; K184-D267 PolarHBondContact NZ-OD2 3.31Å
185	L	91	Very high	87.5	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	129.6	171.6	-54.4	179.4	0	0	0	108.3	L118 L142 F153 I178 I187 V201 Q202 T204	L118-L185 HydrophobicContact CD1-CD1 4.06Å; L118-L185 HydrophobicContact CD2-CD2 4.41Å; L142-L185 HydrophobicContact CD1-CD2 4.11Å; F153-L185 HydrophobicContact CD1-CD1 4.2Å; F153-L185 HydrophobicContact CD2-CD1 4.07Å; F153-L185 HydrophobicContact CE1-CD1 4.18Å; F153-L185 HydrophobicContact CE2-CD1 4.06Å; F153-L185 HydrophobicContact CG-CD1 4.14Å; F153-L185 HydrophobicContact CZ-CD1 4.11Å; I178-L185 HydrophobicContact CD1-CD2 4.47Å; I178-L185 HydrophobicContact CG1-CD2 3.97Å; I178-L185 HydrophobicContact CG2-CD2 4.27Å; L185-I187 HydrophobicContact CB-CD1 4.46Å; L185-I187 HydrophobicContact CB-CG1 4.4Å; L185-V201 WeakPolarHBondContact O-CA 3.38Å; L185-Q202 PolarHBondContact N-O 2.88Å; L185-Q202 PolarHBondContact O-N 3.07Å; L185-T204 HydrophobicContact CD1-CG2 4.41Å; L185-T204 HydrophobicContact CD2-CG2 3.83Å; L185-T204 HydrophobicContact CG-CG2 3.91Å
186	F	92.8	Very high	87.4	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	118.7	170.6	-59.6	-77.4	0	0	0	107.7	A176 A177 L199 I200 V201 I229 N240 V242 D267	A176-F186 CarbonylContact C-O 3.59Å; A176-F186 WeakPolarHBondContact CA-O 3.44Å; A176-F186 WeakPolarHBondContact CB-O 3.18Å; A177-F186 HydrophobicContact CB-CB 4.34Å; A177-F186 HydrophobicContact CB-CD2 4.4Å; A177-F186 PolarHBondContact N-O 3.21Å; A177-F186 PolarHBondContact O-N 3.12Å; F186-L199 HydrophobicContact CB-CD1 4.13Å; F186-L199 HydrophobicContact CD1-CD1 4.3Å; F186-I200 WeakPolarHBondContact CA-O 3.36Å; F186-V201 HydrophobicContact CD1-CG1 4.19Å; F186-V201 HydrophobicContact CD1-CG2 3.85Å; F186-V201 HydrophobicContact CE1-CG1 3.94Å; F186-V201 HydrophobicContact CE1-CG2 4.01Å; F186-I229 HydrophobicContact CB-CG2 4.49Å; F186-N240 HydrophobicContact CE2-CB 4.36Å; F186-N240 WeakPolarHBondContact CZ-O 3.45Å; F186-V242 HydrophobicContact CB-CG1 4.14Å; F186-V242 HydrophobicContact CD1-CG1 3.64Å; F186-V242 HydrophobicContact CD1-CG2 4.09Å; F186-V242 HydrophobicContact CD2-CG1 3.53Å; F186-V242 HydrophobicContact CE1-CG1 3.81Å; F186-V242 HydrophobicContact CE1-CG2 4.34Å; F186-V242 HydrophobicContact CE2-CG1 3.67Å; F186-V242 HydrophobicContact CG-CG1 3.5Å; F186-V242 HydrophobicContact CZ-CG1 3.82Å; F186-D267 HydrophobicContact CZ-CB 4.4Å
187	I	95	Very high	87.4	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	120.2	-174.2	-60.3	174.8	0	0	0	108.5	L118 P155 A172 L185 I200	L118-I187 HydrophobicContact CD2-CG1 4.43Å; P155-I187 HydrophobicContact CG-CD1 4.43Å; A172-I187 HydrophobicContact CB-CG2 4.04Å; L185-I187 HydrophobicContact CB-CD1 4.46Å; L185-I187 HydrophobicContact CB-CG1 4.4Å; I187-I200 HydrophobicContact CB-CB 4.21Å; I187-I200 PolarHBondContact N-O 2.81Å; I187-I200 PolarHBondContact O-N 3.01Å
188	G	95.3	Very high	87.5	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	136	175.9	0	0	0	0	0	111.4	G173 F174 S175 I229	G173-G188 PolarHBondContact N-O 2.88Å; F174-G188 PolarHBondContact N-O 2.82Å; S175-G188 PolarHBondContact O-N 2.98Å; G188-I229 VanDerWaalsContact N-CD1 3.29Å
189	A	95.8	Very high	87.9	Confident	0 Å²	0	26 Å²	26	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	72.5	-173.6	0	0	0	0	0	111.1	C170 G191 A192 G197 A198 I200	C170-A189 CarbonylContact O-C 3.47Å; C170-A189 VanDerWaalsContact O-CA 3.22Å; C170-A189 WeakPolarHBondContact O-CA 3.27Å; C170-A189 WeakPolarHBondContact O-CB 3.39Å; C170-A189 WeakPolarHBondContact SG-CB 3.38Å; A189-G191 PolarHBondContact O-N 2.86Å; A189-G191 VanDerWaalsContact O-N 3.14Å; A189-A192 HydrophobicContact CB-CB 4.34Å; A189-A192 WeakPolarHBondContact O-CB 3.24Å; A189-A192 PolarHBondContact O-N 3.13Å; A189-A192 VanDerWaalsContact O-N 3.16Å; A189-G197 CarbonylContact O-C 3.46Å; A189-G197 WeakPolarHBondContact O-CA 3.07Å; A189-A198 HydrophobicContact CB-CB 4.26Å; A189-A198 PolarHBondContact N-O 2.98Å; A189-A198 PolarHBondContact O-N 3.34Å; A189-I200 HydrophobicContact CB-CD1 4.04Å; A189-I200 HydrophobicContact CB-CG1 4.42Å
190	P	94.9	Very high	88.5	Confident	8 Å²	8	26 Å²	26	5%	0.052	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-17.5	-169.5	26.3	-35.2	0	0	0	115.1	F174 L225	F174-P190 HydrophobicContact CB-CG 3.69Å; F174-P190 HydrophobicContact CD1-CG 4Å; F174-P190 HydrophobicContact CD2-CG 4.23Å; F174-P190 HydrophobicContact CG-CG 3.7Å; P190-L225 WeakPolarHBondContact CA-O 3.42Å
191	G	92.8	Very high	89.6	Confident	2 Å²	2	23.8 Å²	23.8	2%	0.021	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	8.4	178.2	0	0	0	0	0	114.3	F169 C170 A189	F169-G191 CarbonylContact C-O 3.5Å; F169-G191 VanDerWaalsContact C-O 3.27Å; F169-G191 CarbonylContact O-C 3.56Å; F169-G191 VanDerWaalsContact O-C 3.25Å; F169-G191 WeakPolarHBondContact O-CA 3.08Å; C170-G191 PolarHBondContact O-N 3.28Å; A189-G191 PolarHBondContact O-N 2.86Å; A189-G191 VanDerWaalsContact O-N 3.14Å
192	A	92.8	Very high	90.7	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	151.1	171.8	0	0	0	0	0	110.6	R166 L167 C170 A189 W195 Q196 G197 A198	R166-A192 CarbonylContact O-C 3.56Å; R166-A192 WeakPolarHBondContact O-CA 2.87Å; L167-A192 HydrophobicContact CD2-CB 3.98Å; C170-A192 HydrophobicContact CB-CB 4.46Å; A189-A192 HydrophobicContact CB-CB 4.34Å; A189-A192 WeakPolarHBondContact O-CB 3.24Å; A189-A192 PolarHBondContact O-N 3.13Å; A189-A192 VanDerWaalsContact O-N 3.16Å; A192-W195 PolarHBondContact O-N 3.14Å; A192-Q196 PolarHBondContact O-N 2.78Å; A192-G197 WeakPolarHBondContact O-CA 3.34Å; A192-G197 PolarHBondContact O-N 2.74Å; A192-A198 HydrophobicContact CB-CB 3.72Å
193	W	92.1	Very high	91.7	Very high	37 Å²	37	16.8 Å²	16.8	14%	0.14	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	51	71	170.8	-48.2	127.8	0	0	0	113	H165 R166 L167 W195 Q196 T213 E215	H165-W193 CarbonylContact O-C 3.58Å; H165-W193 WeakPolarHBondContact O-CA 3.3Å; R166-W193 HydrophobicContact CB-CE3 3.98Å; R166-W193 HydrophobicContact CB-CZ3 3.75Å; R166-W193 HydrophobicContact CG-CE3 4.12Å; R166-W193 HydrophobicContact CG-CZ3 3.9Å; R166-W193 PolarHBondContact O-N 3.33Å; L167-W193 HydrophobicContact CD1-CH2 4.29Å; L167-W193 HydrophobicContact CD1-CZ2 4.42Å; L167-W193 HydrophobicContact CD2-CD2 4.39Å; L167-W193 HydrophobicContact CD2-CH2 4.14Å; L167-W193 HydrophobicContact CD2-CZ2 3.79Å; L167-W193 HydrophobicContact CG-CH2 4.04Å; L167-W193 HydrophobicContact CG-CZ2 4.18Å; L167-W193 HydrophobicContact CG-CZ3 4.42Å; W193-W195 PolarHBondContact O-N 3.32Å; W193-W195 VanDerWaalsContact O-N 3.1Å; W193-Q196 HydrophobicContact CB-CB 4.08Å; W193-Q196 HydrophobicContact CB-CG 4.34Å; W193-Q196 WeakPolarHBondContact O-CB 3.12Å; W193-Q196 WeakPolarHBondContact O-CG 3.49Å; W193-Q196 PolarHBondContact O-N 3.2Å; W193-T213 PolarHBondContact NE1-O 2.92Å; W193-E215 HydrophobicContact CB-CB 4.3Å; W193-E215 HydrophobicContact CB-CG 4.18Å; W193-E215 HydrophobicContact CD2-CB 3.77Å; W193-E215 HydrophobicContact CD2-CG 4.38Å; W193-E215 HydrophobicContact CE3-CB 3.8Å; W193-E215 HydrophobicContact CE3-CG 4.2Å; W193-E215 HydrophobicContact CG-CB 3.98Å; W193-E215 HydrophobicContact CG-CG 4.38Å; W193-E215 HydrophobicContact CZ3-CB 4.38Å
194	Y	90.6	Very high	92	Very high	88 Å²	88	13.1 Å²	13.1	35%	0.345	6%	0.062	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	39.8	-178	-59.3	-96.3	0	0	0	113.2	H165 Q196 E215 D221 D222	H165-Y194 HydrophobicContact CB-CD1 3.54Å; H165-Y194 HydrophobicContact CB-CD2 4.07Å; H165-Y194 HydrophobicContact CB-CE1 3.15Å; H165-Y194 HydrophobicContact CB-CE2 3.7Å; H165-Y194 HydrophobicContact CB-CG 4Å; H165-Y194 AromaticContact CD2-CE2 3.96Å; H165-Y194 AromaticContact CD2-CZ 3.6Å; H165-Y194 PolarHBondContact CD2-OH 3.08Å; H165-Y194 AromaticContact CG-CE1 3.91Å; H165-Y194 AromaticContact CG-CZ 3.61Å; H165-Y194 VanDerWaalsContact O-CD2 3.26Å; H165-Y194 WeakPolarHBondContact O-CD2 3.44Å; H165-Y194 PolarHBondContact O-N 2.89Å; Y194-Q196 PolarHBondContact O-N 3.4Å; Y194-Q196 VanDerWaalsContact O-N 3.14Å; Y194-E215 VanDerWaalsContact CE2-OE1 3.28Å; Y194-E215 WeakPolarHBondContact CE2-OE1 3.34Å; Y194-D221 VanDerWaalsContact CB-CG 3.5Å; Y194-D221 WeakPolarHBondContact CB-OD2 3.36Å; Y194-D222 PolarHBondContact O-N 3.06Å; Y194-D222 VanDerWaalsContact O-N 3.08Å
195	W	91.9	Very high	91.6	Very high	54 Å²	54	16.8 Å²	16.8	21%	0.205	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	16.4	-175.7	-64.2	-99.2	0	0	0	115.2	Y164 F169 A192 W193 G197 D222 I223 Y224	Y164-W195 HydrophobicContact CD1-CH2 4.26Å; Y164-W195 HydrophobicContact CD1-CZ3 4.48Å; Y164-W195 AromaticContact CE1-CH2 3.52Å; Y164-W195 HydrophobicContact CE1-CH2 3.52Å; Y164-W195 AromaticContact CE1-CZ3 3.83Å; Y164-W195 HydrophobicContact CE1-CZ3 3.83Å; Y164-W195 HydrophobicContact CE2-CH2 4.17Å; Y164-W195 AromaticContact CZ-CH2 3.46Å; Y164-W195 VanDerWaalsContact CZ-CH2 3.46Å; Y164-W195 WeakPolarHBondContact OH-CH2 3.39Å; F169-W195 HydrophobicContact CB-CH2 4.34Å; F169-W195 HydrophobicContact CB-CZ2 3.99Å; F169-W195 HydrophobicContact CD1-CH2 4.07Å; F169-W195 AromaticContact CD1-CZ2 3.52Å; F169-W195 HydrophobicContact CD1-CZ2 3.52Å; F169-W195 HydrophobicContact CE1-CZ2 4.27Å; F169-W195 HydrophobicContact CG-CH2 4.14Å; F169-W195 AromaticContact CG-CZ2 3.89Å; F169-W195 HydrophobicContact CG-CZ2 3.89Å; A192-W195 PolarHBondContact O-N 3.14Å; W193-W195 PolarHBondContact O-N 3.32Å; W193-W195 VanDerWaalsContact O-N 3.1Å; W195-G197 PolarHBondContact O-N 2.87Å; W195-D222 CarbonylContact O-C 3.32Å; W195-D222 VanDerWaalsContact O-CA 3.3Å; W195-D222 WeakPolarHBondContact O-CA 3.24Å; W195-D222 PolarHBondContact O-N 3.01Å; W195-I223 PolarHBondContact O-N 2.69Å; W195-Y224 HydrophobicContact CB-CD1 3.93Å; W195-Y224 HydrophobicContact CB-CE1 3.7Å; W195-Y224 AromaticContact CD1-CE1 3.68Å; W195-Y224 AromaticContact CG-CE1 4Å; W195-Y224 HydrophobicContact CG-CE1 4Å; W195-Y224 PolarHBondContact O-N 3.07Å
196	Q	91.7	Very high	90.5	Very high	9 Å²	9	25.8 Å²	25.8	4%	0.042	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-39.3	162.7	-64.9	172.2	6.9	0	0	109.6	A192 W193 Y194 G216 L220 D221 I223 L225	A192-Q196 PolarHBondContact O-N 2.78Å; W193-Q196 HydrophobicContact CB-CB 4.08Å; W193-Q196 HydrophobicContact CB-CG 4.34Å; W193-Q196 WeakPolarHBondContact O-CB 3.12Å; W193-Q196 WeakPolarHBondContact O-CG 3.49Å; W193-Q196 PolarHBondContact O-N 3.2Å; Y194-Q196 PolarHBondContact O-N 3.4Å; Y194-Q196 VanDerWaalsContact O-N 3.14Å; Q196-G216 PolarHBondContact NE2-O 3.29Å; Q196-L220 HydrophobicContact CG-CB 4.27Å; Q196-L220 VanDerWaalsContact CG-O 3.31Å; Q196-L220 WeakPolarHBondContact CG-O 3.37Å; Q196-D221 WeakPolarHBondContact CG-OD1 3.47Å; Q196-D221 PolarHBondContact NE2-OD1 3.33Å; Q196-I223 WeakPolarHBondContact O-CG1 3.26Å; Q196-L225 WeakPolarHBondContact O-CB 3.05Å; Q196-L225 PolarHBondContact O-N 2.94Å
197	G	93.3	Very high	89.2	Confident	3 Å²	3	31.9 Å²	31.9	3%	0.031	15%	0.146	C	C	.	.	B	Isolated β-bridge	trans	87.1	168.6	-178	0	0	0	0	0	113.3	A189 A192 W195 L225	A189-G197 CarbonylContact O-C 3.46Å; A189-G197 WeakPolarHBondContact O-CA 3.07Å; A192-G197 WeakPolarHBondContact O-CA 3.34Å; A192-G197 PolarHBondContact O-N 2.74Å; W195-G197 PolarHBondContact O-N 2.87Å; G197-L225 CarbonylContact C-O 3.59Å; G197-L225 WeakPolarHBondContact CA-O 3.42Å
198	A	94	Very high	87.8	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.008	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	151.5	-177.6	0	0	0	0	0	113.6	A189 A192 T213 L225	A189-A198 HydrophobicContact CB-CB 4.26Å; A189-A198 PolarHBondContact N-O 2.98Å; A189-A198 PolarHBondContact O-N 3.34Å; A192-A198 HydrophobicContact CB-CB 3.72Å; A198-T213 WeakPolarHBondContact CA-OG1 3.43Å; A198-T213 VanDerWaalsContact CB-OG1 3.24Å; A198-T213 WeakPolarHBondContact CB-OG1 3.42Å; A198-L225 PolarHBondContact N-O 2.89Å; A198-L225 VanDerWaalsContact N-O 3.1Å
199	L	94.9	Very high	86.7	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	130.5	159.5	175.6	63.3	0	0	0	108.5	F186 V201 R212 T213 I229 V242 I244 F265 A269	F186-L199 HydrophobicContact CB-CD1 4.13Å; F186-L199 HydrophobicContact CD1-CD1 4.3Å; L199-V201 HydrophobicContact CD2-CG2 4.09Å; L199-V201 HydrophobicContact CG-CG2 4.04Å; L199-R212 WeakPolarHBondContact O-CA 3.44Å; L199-T213 HydrophobicContact CB-CG2 3.94Å; L199-T213 PolarHBondContact N-OG1 3.32Å; L199-T213 VanDerWaalsContact N-OG1 3.13Å; L199-T213 PolarHBondContact O-N 2.99Å; L199-T213 VanDerWaalsContact O-N 3.09Å; L199-I229 HydrophobicContact CD1-CD1 4.01Å; L199-V242 HydrophobicContact CD1-CG2 4.33Å; L199-V242 HydrophobicContact CD2-CG2 3.61Å; L199-I244 HydrophobicContact CB-CD1 3.71Å; L199-I244 HydrophobicContact CD1-CD1 4.13Å; L199-I244 HydrophobicContact CG-CD1 4.42Å; L199-F265 HydrophobicContact CD2-CB 3.73Å; L199-F265 HydrophobicContact CD2-CD1 4.27Å; L199-F265 HydrophobicContact CD2-CD2 4.28Å; L199-F265 HydrophobicContact CD2-CG 3.85Å; L199-A269 HydrophobicContact CD2-CB 4.36Å
200	I	93.8	Very high	86.2	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	124.3	173.2	-55.5	178.1	0	0	0	108.2	P155 C156 A172 F186 I187 A189 V210 Q211 R212	P155-I200 HydrophobicContact CB-CD1 4.06Å; P155-I200 HydrophobicContact CB-CG2 3.79Å; P155-I200 HydrophobicContact CG-CD1 3.67Å; P155-I200 HydrophobicContact CG-CG2 3.89Å; C156-I200 VanDerWaalsContact SG-CD1 3.56Å; A172-I200 HydrophobicContact CB-CD1 4.49Å; F186-I200 WeakPolarHBondContact CA-O 3.36Å; I187-I200 HydrophobicContact CB-CB 4.21Å; I187-I200 PolarHBondContact N-O 2.81Å; I187-I200 PolarHBondContact O-N 3.01Å; A189-I200 HydrophobicContact CB-CD1 4.04Å; A189-I200 HydrophobicContact CB-CG1 4.42Å; I200-V210 HydrophobicContact CG2-CG1 3.47Å; I200-V210 VanDerWaalsContact CG2-CG1 3.47Å; I200-Q211 WeakPolarHBondContact CA-O 3.21Å; I200-R212 HydrophobicContact CG1-CG 4.1Å; I200-R212 HydrophobicContact CG2-CG 4.23Å
201	V	92.3	Very high	85.9	Confident	4 Å²	4	48 Å²	48	2%	0.024	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	122	176	-170.7	0	0	0	0	108.4	K184 L185 F186 L199 Q211 A269	K184-V201 HydrophobicContact CB-CG1 4.45Å; K184-V201 HydrophobicContact CD-CG1 4.01Å; K184-V201 HydrophobicContact CG-CG1 4.48Å; L185-V201 WeakPolarHBondContact O-CA 3.38Å; F186-V201 HydrophobicContact CD1-CG1 4.19Å; F186-V201 HydrophobicContact CD1-CG2 3.85Å; F186-V201 HydrophobicContact CE1-CG1 3.94Å; F186-V201 HydrophobicContact CE1-CG2 4.01Å; L199-V201 HydrophobicContact CD2-CG2 4.09Å; L199-V201 HydrophobicContact CG-CG2 4.04Å; V201-Q211 HydrophobicContact CB-CB 4.3Å; V201-Q211 PolarHBondContact N-O 3.44Å; V201-Q211 PolarHBondContact O-N 2.84Å; V201-A269 HydrophobicContact CG2-CB 4.04Å
202	Q	89.8	Confident	85.7	Confident	8 Å²	8	51.4 Å²	51.4	4%	0.037	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	134	-176.9	-171.8	167.1	12.7	0	0	110.8	F153 L185 E207 V210	F153-Q202 VanDerWaalsContact CD1-CD 3.46Å; F153-Q202 HydrophobicContact CD1-CG 4.16Å; F153-Q202 HydrophobicContact CE1-CG 4.2Å; L185-Q202 PolarHBondContact N-O 2.88Å; L185-Q202 PolarHBondContact O-N 3.07Å; Q202-E207 PolarHBondContact NE2-O 2.98Å; Q202-E207 VanDerWaalsContact NE2-O 3.08Å; Q202-V210 HydrophobicContact CG-CG2 4Å
203	G	87.4	Confident	85.6	Confident	21 Å²	21	52.2 Å²	52.2	22%	0.216	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	149	174.9	0	0	0	0	0	112	N183 D205	N183-G203 CarbonylContact O-C 3.58Å; N183-G203 WeakPolarHBondContact O-CA 3.1Å; G203-D205 VanDerWaalsContact C-N 3.26Å; G203-D205 PolarHBondContact O-N 2.97Å
204	T	82.7	Confident	85.5	Confident	3 Å²	3	55.4 Å²	55.4	2%	0.018	28%	0.276	C	S	.	.	S	Bend	trans	-72.4	-21.4	178.1	58.4	0	0	0	0	113.3	L142 R151 N183 L185	L142-T204 HydrophobicContact CD2-CG2 3.76Å; R151-T204 PolarHBondContact NH1-O 2.72Å; N183-T204 WeakPolarHBondContact CB-OG1 3.47Å; N183-T204 WeakPolarHBondContact O-CG2 3.45Å; N183-T204 PolarHBondContact O-N 3.33Å; N183-T204 PolarHBondContact O-OG1 3.48Å; L185-T204 HydrophobicContact CD1-CG2 4.41Å; L185-T204 HydrophobicContact CD2-CG2 3.83Å; L185-T204 HydrophobicContact CG-CG2 3.91Å
205	D	77.9	Confident	85.5	Confident	114 Å²	114	55.2 Å²	55.2	61%	0.61	28%	0.278	S	S	*	.	S	Bend	trans	-92.1	-19.3	-171.3	-61.2	-16.9	0	0	0	113.3	G203	G203-D205 VanDerWaalsContact C-N 3.26Å; G203-D205 PolarHBondContact O-N 2.97Å
206	R	67.8	Low	85.2	Confident	188 Å²	188	53.8 Å²	53.8	71%	0.709	28%	0.281	S	S	*	.			trans	-142.4	127.2	-176	-68.9	-173	177.4	177	-0.7	111.9	D208	R206-D208 VanDerWaalsContact C-N 3.3Å; R206-D208 PolarHBondContact O-N 2.8Å
207	E	66.1	Low	85	Confident	128 Å²	128	57.5 Å²	57.5	60%	0.598	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-30.6	173.5	-73.3	-177.2	-170.1	0	0	112.4	Q202 N209 V210	Q202-E207 PolarHBondContact NE2-O 2.98Å; Q202-E207 VanDerWaalsContact NE2-O 3.08Å; E207-N209 PolarHBondContact O-N 2.85Å; E207-V210 VanDerWaalsContact O-CG2 3.23Å; E207-V210 WeakPolarHBondContact O-CG2 3.15Å
208	D	65.5	Low	84.7	Confident	156 Å²	156	60.6 Å²	60.6	83%	0.834	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-18.1	-167	-57.9	-26.1	0	0	0	115.2	R206 V210	R206-D208 VanDerWaalsContact C-N 3.3Å; R206-D208 PolarHBondContact O-N 2.8Å; D208-V210 PolarHBondContact O-N 3.07Å
209	N	73.7	Confident	84.2	Confident	101 Å²	101	62.9 Å²	62.9	54%	0.54	35%	0.345	S	S	.	.			trans	-98.5	71.5	-175.6	-166.5	22.5	0	0	0	111.4	E207	E207-N209 PolarHBondContact O-N 2.85Å
210	V	84.7	Confident	83.7	Confident	29 Å²	29	65.4 Å²	65.4	18%	0.176	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	113.1	178.7	-167	0	0	0	0	110.9	P155 I200 Q202 E207 D208 R212	P155-V210 HydrophobicContact CB-CG1 3.99Å; I200-V210 HydrophobicContact CG2-CG1 3.47Å; I200-V210 VanDerWaalsContact CG2-CG1 3.47Å; Q202-V210 HydrophobicContact CG-CG2 4Å; E207-V210 VanDerWaalsContact O-CG2 3.23Å; E207-V210 WeakPolarHBondContact O-CG2 3.15Å; D208-V210 PolarHBondContact O-N 3.07Å; V210-R212 HydrophobicContact CG1-CG 4.03Å; V210-R212 PolarHBondContact O-NH1 2.75Å
211	Q	88.5	Confident	83.5	Confident	61 Å²	61	67.2 Å²	67.2	29%	0.285	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	139.6	171.1	-64.5	174.7	-4.4	0	0	109.2	I200 V201 H268	I200-Q211 WeakPolarHBondContact CA-O 3.21Å; V201-Q211 HydrophobicContact CB-CB 4.3Å; V201-Q211 PolarHBondContact N-O 3.44Å; V201-Q211 PolarHBondContact O-N 2.84Å; Q211-H268 VanDerWaalsContact OE1-CA 3.27Å; Q211-H268 PolarHBondContact OE1-O 2.76Å
212	R	88.9	Confident	83.3	Confident	73 Å²	73	70 Å²	70	28%	0.275	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	145	-177.9	-54.8	-178.8	-174.3	72.3	-3.6	109	P155 L199 I200 V210	P155-R212 PolarHBondContact O-NE 2.04Å; P155-R212 PolarHBondContact O-NH2 2.77Å; L199-R212 WeakPolarHBondContact O-CA 3.44Å; I200-R212 HydrophobicContact CG1-CG 4.1Å; I200-R212 HydrophobicContact CG2-CG 4.23Å; V210-R212 HydrophobicContact CG1-CG 4.03Å; V210-R212 PolarHBondContact O-NH1 2.75Å
213	T	90.7	Very high	83.4	Confident	17 Å²	17	71 Å²	71	10%	0.104	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-61.7	139.4	166	53.6	0	0	0	0	109.9	W193 A198 L199 F265 A269	W193-T213 PolarHBondContact NE1-O 2.92Å; A198-T213 WeakPolarHBondContact CA-OG1 3.43Å; A198-T213 VanDerWaalsContact CB-OG1 3.24Å; A198-T213 WeakPolarHBondContact CB-OG1 3.42Å; L199-T213 HydrophobicContact CB-CG2 3.94Å; L199-T213 PolarHBondContact N-OG1 3.32Å; L199-T213 VanDerWaalsContact N-OG1 3.13Å; L199-T213 PolarHBondContact O-N 2.99Å; L199-T213 VanDerWaalsContact O-N 3.09Å; T213-F265 HydrophobicContact CG2-CD1 4.39Å; T213-F265 HydrophobicContact CG2-CE1 3.63Å; T213-F265 HydrophobicContact CG2-CZ 4.03Å; T213-A269 HydrophobicContact CG2-CB 4.3Å
214	S	89.1	Confident	83.6	Confident	105 Å²	105	72.6 Å²	72.6	73%	0.734	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-77.6	159.3	-179.5	-62.8	0	0	0	0	111.5	G216	S214-G216 PolarHBondContact O-N 3Å
215	E	90.3	Very high	84.2	Confident	83 Å²	83	73.5 Å²	73.5	39%	0.388	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-60.8	126.7	170	-178.2	172	-162.1	0	0	110	W193 Y194	W193-E215 HydrophobicContact CB-CB 4.3Å; W193-E215 HydrophobicContact CB-CG 4.18Å; W193-E215 HydrophobicContact CD2-CB 3.77Å; W193-E215 HydrophobicContact CD2-CG 4.38Å; W193-E215 HydrophobicContact CE3-CB 3.8Å; W193-E215 HydrophobicContact CE3-CG 4.2Å; W193-E215 HydrophobicContact CG-CB 3.98Å; W193-E215 HydrophobicContact CG-CG 4.38Å; W193-E215 HydrophobicContact CZ3-CB 4.38Å; Y194-E215 VanDerWaalsContact CE2-OE1 3.28Å; Y194-E215 WeakPolarHBondContact CE2-OE1 3.34Å
216	G	86.9	Confident	84.9	Confident	25 Å²	25	68.1 Å²	68.1	26%	0.258	36%	0.364	S	S	.	.			trans	-87.2	179.3	172	0	0	0	0	0	112.5	Q196 S214	Q196-G216 PolarHBondContact NE2-O 3.29Å; S214-G216 PolarHBondContact O-N 3Å
217	P	87.9	Confident	86.2	Confident	86 Å²	86	59.7 Å²	59.7	56%	0.558	33%	0.332	S	S	*	.			trans	-68.9	153.7	175.6	31.9	-37.8	0	0	0	111.8	P219 L220	P217-P219 VanDerWaalsContact C-N 3.3Å; P217-P219 WeakPolarHBondContact O-CD 3.42Å; P217-L220 HydrophobicContact CG-CD1 4.24Å; P217-L220 HydrophobicContact CG-CG 4.24Å; P217-L220 WeakPolarHBondContact O-CB 3.2Å; P217-L220 PolarHBondContact O-N 3.23Å
218	A	86.4	Confident	87.6	Confident	69 Å²	69	53.7 Å²	53.7	57%	0.57	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-49.1	-32.6	-176.3	0	0	0	0	0	116.7	L220 D221	A218-L220 PolarHBondContact O-N 2.92Å; A218-L220 VanDerWaalsContact O-N 3.13Å; A218-D221 WeakPolarHBondContact O-CB 3.39Å; A218-D221 PolarHBondContact O-N 2.73Å
219	P	84.1	Confident	88.9	Confident	48 Å²	48	47.2 Å²	47.2	31%	0.312	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-63.7	-15	175.4	-25	36.5	0	0	0	115.1	P217 D221 D251 L257	P217-P219 VanDerWaalsContact C-N 3.3Å; P217-P219 WeakPolarHBondContact O-CD 3.42Å; P219-D221 VanDerWaalsContact C-N 3.35Å; P219-D251 PolarHBondContact O-N 3.23Å; P219-L257 HydrophobicContact CB-CD1 3.62Å
220	L	84.3	Confident	89.7	Confident	54 Å²	54	43 Å²	43	28%	0.283	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-88.2	-3	173.9	-61.1	-174.5	0	0	0	113.1	Q196 P217 A218 I223 L257	Q196-L220 HydrophobicContact CG-CB 4.27Å; Q196-L220 VanDerWaalsContact CG-O 3.31Å; Q196-L220 WeakPolarHBondContact CG-O 3.37Å; P217-L220 HydrophobicContact CG-CD1 4.24Å; P217-L220 HydrophobicContact CG-CG 4.24Å; P217-L220 WeakPolarHBondContact O-CB 3.2Å; P217-L220 PolarHBondContact O-N 3.23Å; A218-L220 PolarHBondContact O-N 2.92Å; A218-L220 VanDerWaalsContact O-N 3.13Å; L220-I223 WeakPolarHBondContact O-CG1 3.48Å; L220-I223 WeakPolarHBondContact O-CG2 3.47Å; L220-L257 HydrophobicContact CD2-CD2 3.74Å
221	D	88.6	Confident	89.9	Confident	38 Å²	38	43.3 Å²	43.3	20%	0.203	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	152.3	176.7	-66.8	-1.7	0	0	0	110.1	Y194 Q196 A218 P219 I223	Y194-D221 VanDerWaalsContact CB-CG 3.5Å; Y194-D221 WeakPolarHBondContact CB-OD2 3.36Å; Q196-D221 WeakPolarHBondContact CG-OD1 3.47Å; Q196-D221 PolarHBondContact NE2-OD1 3.33Å; A218-D221 WeakPolarHBondContact O-CB 3.39Å; A218-D221 PolarHBondContact O-N 2.73Å; P219-D221 VanDerWaalsContact C-N 3.35Å; D221-I223 VanDerWaalsContact C-N 3.27Å; D221-I223 PolarHBondContact O-N 2.87Å
222	D	88.7	Confident	89.9	Confident	64 Å²	64	40.9 Å²	40.9	34%	0.342	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	12.1	176.6	-87.6	-55.8	0	0	0	117.5	Y194 W195 Y224 K248	Y194-D222 PolarHBondContact O-N 3.06Å; Y194-D222 VanDerWaalsContact O-N 3.08Å; W195-D222 CarbonylContact O-C 3.32Å; W195-D222 VanDerWaalsContact O-CA 3.3Å; W195-D222 WeakPolarHBondContact O-CA 3.24Å; W195-D222 PolarHBondContact O-N 3.01Å; D222-Y224 VanDerWaalsContact C-N 3.35Å; D222-Y224 PolarHBondContact O-N 2.82Å; D222-K248 HydrophobicContact CB-CD 4.43Å; D222-K248 VanDerWaalsContact O-CB 3.26Å; D222-K248 WeakPolarHBondContact O-CB 3.4Å; D222-K248 WeakPolarHBondContact O-CD 3.47Å; D222-K248 WeakPolarHBondContact O-CE 3.35Å; D222-K248 VanDerWaalsContact O-CG 3.24Å; D222-K248 WeakPolarHBondContact O-CG 3.43Å; D222-K248 IonicContact OD1-NZ 3.03Å; D222-K248 PolarHBondContact OD1-NZ 2.91Å; D222-K248 IonicContact OD2-NZ 3.76Å
223	I	90.5	Very high	89.9	Confident	28 Å²	28	39.8 Å²	39.8	14%	0.144	25%	0.245	C	C	.	.			trans	-75.5	-18.6	179.9	67.9	175.3	0	0	0	114.4	W195 Q196 L220 D221 L225 A246 K248 G250	W195-I223 PolarHBondContact O-N 2.69Å; Q196-I223 WeakPolarHBondContact O-CG1 3.26Å; L220-I223 WeakPolarHBondContact O-CG1 3.48Å; L220-I223 WeakPolarHBondContact O-CG2 3.47Å; D221-I223 VanDerWaalsContact C-N 3.27Å; D221-I223 PolarHBondContact O-N 2.87Å; I223-L225 HydrophobicContact CD1-CB 4.26Å; I223-L225 HydrophobicContact CG1-CB 4.37Å; I223-A246 HydrophobicContact CB-CB 4.35Å; I223-A246 HydrophobicContact CD1-CB 4.36Å; I223-A246 HydrophobicContact CG1-CB 4.34Å; I223-A246 CarbonylContact O-C 3.15Å; I223-A246 WeakPolarHBondContact O-CA 3.37Å; I223-K248 PolarHBondContact O-N 3.06Å; I223-G250 VanDerWaalsContact CG2-CA 3.5Å
224	Y	93.2	Very high	89.8	Confident	55 Å²	55	39.2 Å²	39.2	22%	0.216	24%	0.242	C	C	.	.			trans	61.8	42.5	-178.3	-56.9	-16.3	0	0	0	115.3	W195 D222 G226 Y227 K248	W195-Y224 HydrophobicContact CB-CD1 3.93Å; W195-Y224 HydrophobicContact CB-CE1 3.7Å; W195-Y224 AromaticContact CD1-CE1 3.68Å; W195-Y224 AromaticContact CG-CE1 4Å; W195-Y224 HydrophobicContact CG-CE1 4Å; W195-Y224 PolarHBondContact O-N 3.07Å; D222-Y224 VanDerWaalsContact C-N 3.35Å; D222-Y224 PolarHBondContact O-N 2.82Å; Y224-G226 PolarHBondContact O-N 3.35Å; Y224-Y227 WeakPolarHBondContact O-CB 3.04Å; Y224-Y227 PolarHBondContact O-N 3.09Å; Y224-K248 HydrophobicContact CD2-CB 3.88Å; Y224-K248 HydrophobicContact CD2-CD 4.01Å; Y224-K248 HydrophobicContact CE1-CD 4.04Å; Y224-K248 HydrophobicContact CE2-CB 4.22Å; Y224-K248 HydrophobicContact CE2-CD 3.48Å; Y224-K248 VanDerWaalsContact CE2-CD 3.48Å; Y224-K248 HydrophobicContact CE2-CG 4.45Å; Y224-K248 HydrophobicContact CG-CB 4.24Å; Y224-K248 HydrophobicContact CG-CD 4.5Å; Y224-K248 VanDerWaalsContact CZ-CD 3.5Å; Y224-K248 PolarHBondContact OH-NZ 3.27Å
225	L	94	Very high	89.6	Confident	22 Å²	22	39.2 Å²	39.2	12%	0.115	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-56.5	125	173.2	-172.3	75.3	0	0	0	110.9	P190 Q196 G197 A198 I223 I244 A246 A263 F265	P190-L225 WeakPolarHBondContact CA-O 3.42Å; Q196-L225 WeakPolarHBondContact O-CB 3.05Å; Q196-L225 PolarHBondContact O-N 2.94Å; G197-L225 CarbonylContact C-O 3.59Å; G197-L225 WeakPolarHBondContact CA-O 3.42Å; A198-L225 PolarHBondContact N-O 2.89Å; A198-L225 VanDerWaalsContact N-O 3.1Å; I223-L225 HydrophobicContact CD1-CB 4.26Å; I223-L225 HydrophobicContact CG1-CB 4.37Å; L225-I244 HydrophobicContact CD1-CG1 4.39Å; L225-I244 HydrophobicContact CD1-CG2 3.61Å; L225-I244 HydrophobicContact CG-CD1 4.16Å; L225-I244 HydrophobicContact CG-CG1 4.48Å; L225-I244 HydrophobicContact CG-CG2 4.31Å; L225-A246 HydrophobicContact CB-CB 4.37Å; L225-A246 HydrophobicContact CD1-CB 4.04Å; L225-A263 HydrophobicContact CD1-CB 4.47Å; L225-F265 HydrophobicContact CD1-CE2 4.46Å; L225-F265 HydrophobicContact CD2-CZ 4.31Å
226	G	93.9	Very high	88.7	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.5	14.1	-175.1	0	0	0	0	0	114.2	S175 Y224 S228 I244 G245	S175-G226 PolarHBondContact OG-O 3.03Å; Y224-G226 PolarHBondContact O-N 3.35Å; G226-S228 VanDerWaalsContact C-N 3.32Å; G226-I244 VanDerWaalsContact CA-CD1 3.44Å; G226-I244 VanDerWaalsContact CA-CG1 3.44Å; G226-G245 PolarHBondContact N-O 3.44Å
227	Y	95.2	Very high	87.8	Confident	11 Å²	11	37.7 Å²	37.7	4%	0.043	23%	0.232	C	C	.	.	S	Bend	trans	-64.3	-37.5	171.3	-164.4	-84.7	0	0	0	112.8	M1 K2 F174 Y224 G245 P247 Y283	M1-Y227 WeakPolarHBondContact CA-OH 3.42Å; M1-Y227 WeakPolarHBondContact CB-OH 3.35Å; M1-Y227 PolarHBondContact N-OH 2.65Å; K2-Y227 HydrophobicContact CB-CE1 4.47Å; K2-Y227 HydrophobicContact CG-CE1 4.28Å; F174-Y227 HydrophobicContact CD1-CD2 4.39Å; F174-Y227 HydrophobicContact CD1-CG 4.42Å; F174-Y227 VanDerWaalsContact CD1-O 3.3Å; F174-Y227 WeakPolarHBondContact CD1-O 3.38Å; F174-Y227 AromaticContact CE1-CD1 3.92Å; F174-Y227 HydrophobicContact CE1-CD1 3.92Å; F174-Y227 AromaticContact CE1-CD2 3.59Å; F174-Y227 HydrophobicContact CE1-CD2 3.59Å; F174-Y227 AromaticContact CE1-CE1 3.95Å; F174-Y227 HydrophobicContact CE1-CE1 3.95Å; F174-Y227 AromaticContact CE1-CE2 3.66Å; F174-Y227 HydrophobicContact CE1-CE2 3.66Å; F174-Y227 AromaticContact CE1-CG 3.74Å; F174-Y227 HydrophobicContact CE1-CG 3.74Å; F174-Y227 AromaticContact CE1-CZ 3.83Å; F174-Y227 WeakPolarHBondContact CE1-O 3.29Å; F174-Y227 HydrophobicContact CZ-CD2 4.01Å; F174-Y227 HydrophobicContact CZ-CE1 4.36Å; F174-Y227 AromaticContact CZ-CE2 3.64Å; F174-Y227 HydrophobicContact CZ-CE2 3.64Å; F174-Y227 AromaticContact CZ-CZ 3.83Å; Y224-Y227 WeakPolarHBondContact O-CB 3.04Å; Y224-Y227 PolarHBondContact O-N 3.09Å; Y227-G245 PolarHBondContact N-O 3.08Å; Y227-P247 VanDerWaalsContact CB-CD 3.49Å; Y227-P247 HydrophobicContact CD1-CG 4Å; Y227-P247 HydrophobicContact CD2-CG 3.89Å; Y227-P247 HydrophobicContact CE2-CG 4.48Å; Y227-P247 HydrophobicContact CG-CG 3.59Å; Y227-Y283 HydrophobicContact CE1-CE1 4.11Å; Y227-Y283 HydrophobicContact CE2-CE1 4.04Å; Y227-Y283 WeakPolarHBondContact CE2-OH 3.37Å; Y227-Y283 AromaticContact CZ-CE1 3.71Å
228	S	94.9	Very high	86.4	Confident	3 Å²	3	38 Å²	38	2%	0.021	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	149.1	177.6	65.4	0	0	0	0	109.1	G226 I244 G245 G285 A286 L288	G226-S228 VanDerWaalsContact C-N 3.32Å; S228-I244 WeakPolarHBondContact O-CA 3.44Å; S228-G245 PolarHBondContact O-N 2.81Å; S228-G245 WeakPolarHBondContact OG-CA 3.41Å; S228-G245 PolarHBondContact OG-N 3.41Å; S228-G285 PolarHBondContact OG-O 2.87Å; S228-A286 WeakPolarHBondContact CB-O 3.45Å; S228-L288 VanDerWaalsContact OG-CD1 3.3Å; S228-L288 WeakPolarHBondContact OG-CD1 3.4Å; S228-L288 WeakPolarHBondContact OG-CG 3.27Å
229	I	93.4	Very high	85.1	Confident	20 Å²	20	34.9 Å²	34.9	10%	0.103	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	139.7	177.8	-72.5	173.8	0	0	0	108.4	S175 A177 F186 G188 L199 V242 A243 I244	S175-I229 WeakPolarHBondContact OG-CD1 3.41Å; S175-I229 WeakPolarHBondContact OG-CG1 3.32Å; A177-I229 HydrophobicContact CB-CG2 3.66Å; F186-I229 HydrophobicContact CB-CG2 4.49Å; G188-I229 VanDerWaalsContact N-CD1 3.29Å; L199-I229 HydrophobicContact CD1-CD1 4.01Å; I229-V242 HydrophobicContact CG2-CB 4.46Å; I229-V242 HydrophobicContact CG2-CG1 4.5Å; I229-A243 CarbonylContact C-O 3.6Å; I229-A243 VanDerWaalsContact CA-O 3.28Å; I229-A243 WeakPolarHBondContact CA-O 3.38Å; I229-I244 HydrophobicContact CD1-CD1 4.24Å; I229-I244 HydrophobicContact CD1-CG1 4.49Å; I229-I244 HydrophobicContact CG1-CB 4.38Å; I229-I244 HydrophobicContact CG1-CD1 4.14Å; I229-I244 HydrophobicContact CG1-CG1 3.84Å
230	A	90.5	Very high	84.5	Confident	12 Å²	12	33.4 Å²	33.4	10%	0.099	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	135.6	164.9	0	0	0	0	0	109.6	V242 A243 L288 V290	A230-V242 CarbonylContact O-C 3.5Å; A230-V242 WeakPolarHBondContact O-CA 3.37Å; A230-A243 PolarHBondContact N-O 3.45Å; A230-A243 PolarHBondContact O-N 2.99Å; A230-L288 HydrophobicContact CB-CB 3.77Å; A230-V290 HydrophobicContact CB-CG2 3.75Å
231	A	88.6	Confident	84.7	Confident	36 Å²	36	30.9 Å²	30.9	30%	0.298	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	143.1	176.3	0	0	0	0	0	110.6	A177 D241 V242	A177-A231 HydrophobicContact CB-CB 4.2Å; A231-D241 WeakPolarHBondContact CA-O 3.44Å; A231-V242 HydrophobicContact CB-CG1 4.34Å
232	G	87.2	Confident	84.9	Confident	9 Å²	9	29 Å²	29	9%	0.093	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	179.2	-178.1	0	0	0	0	0	112.5	D241 D299	G232-D241 PolarHBondContact N-O 2.86Å; G232-D241 CarbonylContact O-C 3.47Å; G232-D241 WeakPolarHBondContact O-CA 3.46Å; G232-D241 WeakPolarHBondContact O-CB 3.35Å; G232-D241 PolarHBondContact O-N 2.79Å; G232-D299 WeakPolarHBondContact CA-OD2 3.47Å
233	N	88.9	Confident	85.1	Confident	50 Å²	50	26 Å²	26	27%	0.267	16%	0.161	S	C	.	.			trans	-110.7	93.9	177.9	-172.6	-5.4	0	0	0	110.8	G236 G237 D299 Q335	N233-G236 WeakPolarHBondContact OD1-CA 3.43Å; N233-G236 PolarHBondContact OD1-N 2.85Å; N233-G236 VanDerWaalsContact OD1-N 3.08Å; N233-G237 PolarHBondContact ND2-O 3Å; N233-D299 PolarHBondContact N-OD2 2.89Å; N233-Q335 PolarHBondContact O-NE2 3.48Å; N233-Q335 PolarHBondContact O-OE1 2.87Å
234	F	89.4	Confident	85.4	Confident	6 Å²	6	24.7 Å²	24.7	3%	0.026	15%	0.154	C	C	.	.	S	Bend	trans	-100.6	-10.2	-171.6	-58.6	-55.7	0	0	0	114.2	D241 A243 L264 L272 V290 D299 L301 Q335 H339 F341	F234-D241 WeakPolarHBondContact CA-OD2 3.37Å; F234-D241 HydrophobicContact CB-CB 4.19Å; F234-D241 HydrophobicContact CD2-CB 3.61Å; F234-D241 HydrophobicContact CE2-CB 4.46Å; F234-D241 HydrophobicContact CG-CB 4.31Å; F234-D241 PolarHBondContact N-OD2 3.29Å; F234-A243 HydrophobicContact CE2-CB 4.02Å; F234-A243 HydrophobicContact CZ-CB 4.07Å; F234-L264 HydrophobicContact CB-CD1 3.99Å; F234-L264 HydrophobicContact CD1-CD1 4.06Å; F234-L264 HydrophobicContact CD2-CB 4.31Å; F234-L264 HydrophobicContact CD2-CD1 4.14Å; F234-L264 HydrophobicContact CD2-CD2 4.09Å; F234-L264 HydrophobicContact CD2-CG 4.41Å; F234-L264 HydrophobicContact CE2-CD2 3.99Å; F234-L264 HydrophobicContact CG-CD1 3.79Å; F234-L264 HydrophobicContact CG-CD2 4.48Å; F234-L264 HydrophobicContact CZ-CD2 4.25Å; F234-L272 HydrophobicContact CB-CD1 4.35Å; F234-V290 HydrophobicContact CE1-CG1 4.25Å; F234-V290 HydrophobicContact CE1-CG2 4.39Å; F234-V290 HydrophobicContact CZ-CG1 4.22Å; F234-V290 HydrophobicContact CZ-CG2 3.75Å; F234-D299 HydrophobicContact CE1-CB 4.48Å; F234-L301 HydrophobicContact CZ-CD1 4.41Å; F234-Q335 VanDerWaalsContact C-NE2 3.34Å; F234-Q335 PolarHBondContact O-NE2 3.27Å; F234-H339 VanDerWaalsContact O-CB 3.25Å; F234-H339 WeakPolarHBondContact O-CB 3.41Å; F234-F341 HydrophobicContact CD1-CE2 4.49Å; F234-F341 AromaticContact CD1-CZ 3.78Å; F234-F341 HydrophobicContact CD1-CZ 3.78Å; F234-F341 HydrophobicContact CE1-CZ 4.18Å
235	R	85.3	Confident	85.4	Confident	104 Å²	104	22 Å²	22	39%	0.392	14%	0.144	S	C	.	.	S	Bend	trans	-116.7	-4.6	-179.3	70.4	-165	168.5	87.9	-10	115.5	D241 D267 H339	R235-D241 WeakPolarHBondContact CD-OD1 3.14Å; R235-D241 VanDerWaalsContact CG-OD2 3.28Å; R235-D241 WeakPolarHBondContact CG-OD2 3.44Å; R235-D241 IonicContact CZ-OD1 3.79Å; R235-D241 PolarHBondContact N-OD2 3.07Å; R235-D241 IonicContact NE-OD1 3.37Å; R235-D241 PolarHBondContact NE-OD1 3.2Å; R235-D241 IonicContact NE-OD2 3.88Å; R235-D267 IonicContact NH2-OD1 3.6Å; R235-H339 PolarHBondContact O-CD2 2.71Å; R235-H339 PolarHBondContact O-NE2 3.27Å
236	G	70.3	Confident	85.5	Confident	31 Å²	31	21.2 Å²	21.2	32%	0.32	14%	0.14	S	C	.	.	S	Bend	trans	74.9	125.1	-170.8	0	0	0	0	0	111.4	N233 H339	N233-G236 WeakPolarHBondContact OD1-CA 3.43Å; N233-G236 PolarHBondContact OD1-N 2.85Å; N233-G236 VanDerWaalsContact OD1-N 3.08Å; G236-H339 WeakPolarHBondContact CA-CE1 3.4Å; G236-H339 PolarHBondContact N-CE1 2.9Å; G236-H339 PolarHBondContact N-ND1 3.16Å
237	G	68.6	Low	85.4	Confident	46 Å²	46	21.2 Å²	21.2	47%	0.474	14%	0.14	S	C	.	.	S	Bend	trans	135	-178.6	-178.4	0	0	0	0	0	112.9	N233 G239	N233-G237 PolarHBondContact ND2-O 3Å; G237-G239 VanDerWaalsContact C-N 3.28Å; G237-G239 PolarHBondContact O-N 3.45Å
238	S	57.6	Low	85.1	Confident	93 Å²	93	24.5 Å²	24.5	65%	0.65	15%	0.154	S	C	*	.	S	Bend	trans	-89.7	59.6	175.5	63.3	0	0	0	0	110.2	E181	E181-S238 WeakPolarHBondContact OE2-CA 3.48Å; E181-S238 VanDerWaalsContact OE2-CB 3.31Å; E181-S238 WeakPolarHBondContact OE2-CB 3.34Å
239	G	59.9	Low	84.2	Confident	2 Å²	2	24.6 Å²	24.6	2%	0.021	16%	0.156	C	C	.	.			trans	-141	128.5	-175.1	0	0	0	0	0	110.5	G237 D241	G237-G239 VanDerWaalsContact C-N 3.28Å; G237-G239 PolarHBondContact O-N 3.45Å; G239-D241 PolarHBondContact O-N 2.9Å
240	N	71.5	Confident	82.9	Confident	18 Å²	18	24.2 Å²	24.2	10%	0.096	16%	0.157	C	C	.	.			trans	-84.6	98.2	177.5	-67.2	11.7	0	0	0	108.8	S179 D180 F186	S179-N240 WeakPolarHBondContact CA-ND2 3.32Å; S179-N240 PolarHBondContact OG-ND2 2.77Å; D180-N240 PolarHBondContact N-ND2 2.93Å; F186-N240 HydrophobicContact CE2-CB 4.36Å; F186-N240 WeakPolarHBondContact CZ-O 3.45Å
241	D	89.3	Confident	81.7	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	168.1	165.3	-54.6	-32.2	0	0	0	108.5	A231 G232 F234 R235 G239 F265 L272	A231-D241 WeakPolarHBondContact CA-O 3.44Å; G232-D241 PolarHBondContact N-O 2.86Å; G232-D241 CarbonylContact O-C 3.47Å; G232-D241 WeakPolarHBondContact O-CA 3.46Å; G232-D241 WeakPolarHBondContact O-CB 3.35Å; G232-D241 PolarHBondContact O-N 2.79Å; F234-D241 WeakPolarHBondContact CA-OD2 3.37Å; F234-D241 HydrophobicContact CB-CB 4.19Å; F234-D241 HydrophobicContact CD2-CB 3.61Å; F234-D241 HydrophobicContact CE2-CB 4.46Å; F234-D241 HydrophobicContact CG-CB 4.31Å; F234-D241 PolarHBondContact N-OD2 3.29Å; R235-D241 WeakPolarHBondContact CD-OD1 3.14Å; R235-D241 VanDerWaalsContact CG-OD2 3.28Å; R235-D241 WeakPolarHBondContact CG-OD2 3.44Å; R235-D241 IonicContact CZ-OD1 3.79Å; R235-D241 PolarHBondContact N-OD2 3.07Å; R235-D241 IonicContact NE-OD1 3.37Å; R235-D241 PolarHBondContact NE-OD1 3.2Å; R235-D241 IonicContact NE-OD2 3.88Å; G239-D241 PolarHBondContact O-N 2.9Å; D241-F265 CarbonylContact C-O 3.53Å; D241-F265 VanDerWaalsContact CA-O 3.27Å; D241-F265 WeakPolarHBondContact CA-O 3.37Å; D241-F265 VanDerWaalsContact CB-O 3.31Å; D241-F265 WeakPolarHBondContact CB-O 3.19Å; D241-L272 HydrophobicContact CB-CD1 4.1Å
242	V	91.7	Very high	80.2	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	136.6	179.2	-65.5	0	0	0	0	111.9	F186 L199 I229 A230 A231 L264 F265	F186-V242 HydrophobicContact CB-CG1 4.14Å; F186-V242 HydrophobicContact CD1-CG1 3.64Å; F186-V242 HydrophobicContact CD1-CG2 4.09Å; F186-V242 HydrophobicContact CD2-CG1 3.53Å; F186-V242 HydrophobicContact CE1-CG1 3.81Å; F186-V242 HydrophobicContact CE1-CG2 4.34Å; F186-V242 HydrophobicContact CE2-CG1 3.67Å; F186-V242 HydrophobicContact CG-CG1 3.5Å; F186-V242 HydrophobicContact CZ-CG1 3.82Å; L199-V242 HydrophobicContact CD1-CG2 4.33Å; L199-V242 HydrophobicContact CD2-CG2 3.61Å; I229-V242 HydrophobicContact CG2-CB 4.46Å; I229-V242 HydrophobicContact CG2-CG1 4.5Å; A230-V242 CarbonylContact O-C 3.5Å; A230-V242 WeakPolarHBondContact O-CA 3.37Å; A231-V242 HydrophobicContact CB-CG1 4.34Å; V242-L264 CarbonylContact O-C 3.6Å; V242-L264 WeakPolarHBondContact O-CA 3.18Å; V242-F265 HydrophobicContact CG2-CB 3.87Å; V242-F265 PolarHBondContact N-O 3.37Å; V242-F265 PolarHBondContact O-N 3.48Å
243	A	94.3	Very high	78.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	133.2	165.3	0	0	0	0	0	108.7	I229 A230 F234 V262 L264 L288 L301	I229-A243 CarbonylContact C-O 3.6Å; I229-A243 VanDerWaalsContact CA-O 3.28Å; I229-A243 WeakPolarHBondContact CA-O 3.38Å; A230-A243 PolarHBondContact N-O 3.45Å; A230-A243 PolarHBondContact O-N 2.99Å; F234-A243 HydrophobicContact CE2-CB 4.02Å; F234-A243 HydrophobicContact CZ-CB 4.07Å; A243-V262 HydrophobicContact CB-CG1 4.24Å; A243-L264 HydrophobicContact CB-CD2 3.44Å; A243-L264 VanDerWaalsContact CB-CD2 3.44Å; A243-L288 HydrophobicContact CB-CD1 4.01Å; A243-L288 WeakPolarHBondContact O-CD1 3.27Å; A243-L301 HydrophobicContact CB-CD1 3.69Å; A243-L301 HydrophobicContact CB-CD2 4.46Å
244	I	95.2	Very high	77.1	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	130.8	-179.9	-165.2	168.9	0	0	0	110.9	L199 L225 G226 S228 I229 V262 A263 F265	L199-I244 HydrophobicContact CB-CD1 3.71Å; L199-I244 HydrophobicContact CD1-CD1 4.13Å; L199-I244 HydrophobicContact CG-CD1 4.42Å; L225-I244 HydrophobicContact CD1-CG1 4.39Å; L225-I244 HydrophobicContact CD1-CG2 3.61Å; L225-I244 HydrophobicContact CG-CD1 4.16Å; L225-I244 HydrophobicContact CG-CG1 4.48Å; L225-I244 HydrophobicContact CG-CG2 4.31Å; G226-I244 VanDerWaalsContact CA-CD1 3.44Å; G226-I244 VanDerWaalsContact CA-CG1 3.44Å; S228-I244 WeakPolarHBondContact O-CA 3.44Å; I229-I244 HydrophobicContact CD1-CD1 4.24Å; I229-I244 HydrophobicContact CD1-CG1 4.49Å; I229-I244 HydrophobicContact CG1-CB 4.38Å; I229-I244 HydrophobicContact CG1-CD1 4.14Å; I229-I244 HydrophobicContact CG1-CG1 3.84Å; I244-V262 CarbonylContact O-C 3.48Å; I244-V262 WeakPolarHBondContact O-CA 3.41Å; I244-A263 HydrophobicContact CG2-CB 3.98Å; I244-A263 WeakPolarHBondContact CG2-O 3.38Å; I244-A263 PolarHBondContact N-O 2.89Å; I244-A263 PolarHBondContact O-N 2.73Å; I244-F265 HydrophobicContact CB-CD2 4.47Å; I244-F265 HydrophobicContact CG2-CD2 3.43Å; I244-F265 VanDerWaalsContact CG2-CD2 3.43Å; I244-F265 HydrophobicContact CG2-CE2 3.24Å; I244-F265 HydrophobicContact CG2-CZ 4.45Å
245	G	94.6	Very high	75.6	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	140.4	-179.9	0	0	0	0	0	113.3	G226 Y227 S228	G226-G245 PolarHBondContact N-O 3.44Å; Y227-G245 PolarHBondContact N-O 3.08Å; S228-G245 PolarHBondContact O-N 2.81Å; S228-G245 WeakPolarHBondContact OG-CA 3.41Å; S228-G245 PolarHBondContact OG-N 3.41Å
246	A	94.6	Very high	74.6	Confident	4 Å²	4	43.6 Å²	43.6	3%	0.033	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	77	170.4	0	0	0	0	0	109.2	I223 L225 K248 S260 K261	I223-A246 HydrophobicContact CB-CB 4.35Å; I223-A246 HydrophobicContact CD1-CB 4.36Å; I223-A246 HydrophobicContact CG1-CB 4.34Å; I223-A246 CarbonylContact O-C 3.15Å; I223-A246 WeakPolarHBondContact O-CA 3.37Å; L225-A246 HydrophobicContact CB-CB 4.37Å; L225-A246 HydrophobicContact CD1-CB 4.04Å; A246-K248 PolarHBondContact O-N 3.39Å; A246-S260 WeakPolarHBondContact O-CA 3.38Å; A246-K261 WeakPolarHBondContact CA-O 3.38Å; A246-K261 PolarHBondContact N-O 3.03Å; A246-K261 PolarHBondContact O-N 2.87Å
247	P	93.3	Very high	74.4	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	27%	0.265	C	S	.	.			trans	-77.4	-14.7	-162.3	29.7	-36.7	0	0	0	115.2	Y227 S260 Y283 F284	Y227-P247 VanDerWaalsContact CB-CD 3.49Å; Y227-P247 HydrophobicContact CD1-CG 4Å; Y227-P247 HydrophobicContact CD2-CG 3.89Å; Y227-P247 HydrophobicContact CE2-CG 4.48Å; Y227-P247 HydrophobicContact CG-CG 3.59Å; P247-S260 VanDerWaalsContact O-CB 3.32Å; P247-S260 WeakPolarHBondContact O-CB 3.49Å; P247-S260 PolarHBondContact O-OG 3.46Å; P247-Y283 HydrophobicContact CB-CD1 3.73Å; P247-Y283 HydrophobicContact CB-CD2 3.98Å; P247-Y283 HydrophobicContact CB-CE1 3.88Å; P247-Y283 HydrophobicContact CB-CE2 4.15Å; P247-Y283 HydrophobicContact CB-CG 3.77Å; P247-Y283 HydrophobicContact CG-CD1 4.18Å; P247-Y283 HydrophobicContact CG-CE1 3.8Å; P247-Y283 HydrophobicContact CG-CE2 4.28Å; P247-Y283 WeakPolarHBondContact O-CA 3.45Å; P247-F284 WeakPolarHBondContact CA-O 3.42Å
248	K	88.6	Confident	74.7	Confident	80 Å²	80	44.3 Å²	44.3	35%	0.348	25%	0.254	S	S	.	.	S	Bend	trans	-81.9	-30.2	-173.1	-178.2	161.4	156	-165.1	0	113.7	D222 I223 Y224 A246	D222-K248 HydrophobicContact CB-CD 4.43Å; D222-K248 VanDerWaalsContact O-CB 3.26Å; D222-K248 WeakPolarHBondContact O-CB 3.4Å; D222-K248 WeakPolarHBondContact O-CD 3.47Å; D222-K248 WeakPolarHBondContact O-CE 3.35Å; D222-K248 VanDerWaalsContact O-CG 3.24Å; D222-K248 WeakPolarHBondContact O-CG 3.43Å; D222-K248 IonicContact OD1-NZ 3.03Å; D222-K248 PolarHBondContact OD1-NZ 2.91Å; D222-K248 IonicContact OD2-NZ 3.76Å; I223-K248 PolarHBondContact O-N 3.06Å; Y224-K248 HydrophobicContact CD2-CB 3.88Å; Y224-K248 HydrophobicContact CD2-CD 4.01Å; Y224-K248 HydrophobicContact CE1-CD 4.04Å; Y224-K248 HydrophobicContact CE2-CB 4.22Å; Y224-K248 HydrophobicContact CE2-CD 3.48Å; Y224-K248 VanDerWaalsContact CE2-CD 3.48Å; Y224-K248 HydrophobicContact CE2-CG 4.45Å; Y224-K248 HydrophobicContact CG-CB 4.24Å; Y224-K248 HydrophobicContact CG-CD 4.5Å; Y224-K248 VanDerWaalsContact CZ-CD 3.5Å; Y224-K248 PolarHBondContact OH-NZ 3.27Å; A246-K248 PolarHBondContact O-N 3.39Å
249	G	75.4	Confident	75.8	Confident	6 Å²	6	43.2 Å²	43.2	6%	0.062	24%	0.236	C	C	.	.			trans	74.9	157.5	-165.3	0	0	0	0	0	111.2
250	G	67	Low	77.2	Confident	11 Å²	11	43.1 Å²	43.1	11%	0.113	24%	0.235	C	C	.	.			trans	-89.1	-163.4	-177.9	0	0	0	0	0	112.8	I223 L257	I223-G250 VanDerWaalsContact CG2-CA 3.5Å; G250-L257 WeakPolarHBondContact CA-O 3.44Å; G250-L257 PolarHBondContact N-O 3.04Å
251	D	63.6	Low	78.2	Confident	83 Å²	83	44.9 Å²	44.9	44%	0.444	24%	0.242	S	C	.	.			trans	-65.4	153.9	-173.5	-174.8	31	0	0	0	114	P219 S253	P219-D251 PolarHBondContact O-N 3.23Å; D251-S253 PolarHBondContact O-N 3Å; D251-S253 PolarHBondContact OD2-OG 3.3Å
252	L	57.3	Low	78.4	Confident	142 Å²	142	44.9 Å²	44.9	74%	0.743	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-3	-179.3	-70.6	162.7	0	0	0	113.9	G254 L258	L252-G254 VanDerWaalsContact C-N 3.28Å; L252-G254 PolarHBondContact O-N 2.97Å; L252-L258 HydrophobicContact CD2-CD1 3.62Å; L252-L258 HydrophobicContact CD2-CD2 4.34Å; L252-L258 HydrophobicContact CG-CD1 4.42Å
253	S	56.2	Low	78.5	Confident	86 Å²	86	45.2 Å²	45.2	60%	0.601	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-10.7	-176.1	45.9	0	0	0	0	114.3	D251	D251-S253 PolarHBondContact O-N 3Å; D251-S253 PolarHBondContact OD2-OG 3.3Å
254	G	55.9	Low	78.5	Confident	27 Å²	27	45.2 Å²	45.2	28%	0.278	25%	0.245	S	C	.	.	S	Bend	trans	-151.9	135.3	172.4	0	0	0	0	0	113	L252 D256 L257 L258	L252-G254 VanDerWaalsContact C-N 3.28Å; L252-G254 PolarHBondContact O-N 2.97Å; G254-D256 VanDerWaalsContact C-N 3.3Å; G254-D256 PolarHBondContact O-N 2.78Å; G254-L257 PolarHBondContact O-N 3.37Å; G254-L258 PolarHBondContact O-N 3.03Å
255	M	57.3	Low	78.3	Confident	159 Å²	159	45.6 Å²	45.6	78%	0.783	25%	0.246	S	C	*	.	H	α-helix	trans	-56.5	-39.9	-175.7	-75.5	-166.5	176.9	0	0	113.2	L257 L258 Y259	M255-L257 VanDerWaalsContact C-N 3.29Å; M255-L257 PolarHBondContact O-N 2.92Å; M255-L258 WeakPolarHBondContact O-CB 3.49Å; M255-L258 PolarHBondContact O-N 3.12Å; M255-Y259 WeakPolarHBondContact O-CD2 3.36Å; M255-Y259 WeakPolarHBondContact O-CE2 3.39Å
256	D	64.1	Low	78	Confident	127 Å²	127	46.7 Å²	46.7	68%	0.679	25%	0.252	S	S	*	.	H	α-helix	trans	-72.5	-18.5	-179.8	-73.1	-13.8	0	0	0	114.3	G254 K261	G254-D256 VanDerWaalsContact C-N 3.3Å; G254-D256 PolarHBondContact O-N 2.78Å; D256-K261 VanDerWaalsContact O-CE 3.29Å; D256-K261 WeakPolarHBondContact O-CE 3.49Å; D256-K261 PolarHBondContact O-NZ 2.91Å
257	L	65.4	Low	77.5	Confident	44 Å²	44	47.1 Å²	47.1	23%	0.23	25%	0.254	C	S	.	.	H	α-helix	trans	-81.3	-31.2	174.6	-64.6	-178.5	0	0	0	110.7	P219 L220 G250 G254 M255 Y259	P219-L257 HydrophobicContact CB-CD1 3.62Å; L220-L257 HydrophobicContact CD2-CD2 3.74Å; G250-L257 WeakPolarHBondContact CA-O 3.44Å; G250-L257 PolarHBondContact N-O 3.04Å; G254-L257 PolarHBondContact O-N 3.37Å; M255-L257 VanDerWaalsContact C-N 3.29Å; M255-L257 PolarHBondContact O-N 2.92Å; L257-Y259 PolarHBondContact O-N 3.43Å
258	L	75.2	Confident	77.1	Confident	48 Å²	48	51.5 Å²	51.5	25%	0.251	27%	0.274	S	S	.	.	H	α-helix	trans	-64.2	-24.8	-176.4	-169.8	60.2	0	0	0	114.2	L252 G254 M255 V280	L252-L258 HydrophobicContact CD2-CD1 3.62Å; L252-L258 HydrophobicContact CD2-CD2 4.34Å; L252-L258 HydrophobicContact CG-CD1 4.42Å; G254-L258 PolarHBondContact O-N 3.03Å; M255-L258 WeakPolarHBondContact O-CB 3.49Å; M255-L258 PolarHBondContact O-N 3.12Å; L258-V280 HydrophobicContact CB-CG2 4.33Å; L258-V280 HydrophobicContact CD1-CG1 3.94Å; L258-V280 HydrophobicContact CD2-CB 4.37Å; L258-V280 HydrophobicContact CD2-CG1 3.91Å; L258-V280 HydrophobicContact CD2-CG2 3.61Å; L258-V280 HydrophobicContact CG-CB 4.24Å; L258-V280 HydrophobicContact CG-CG1 3.58Å; L258-V280 HydrophobicContact CG-CG2 3.61Å
259	Y	81.8	Confident	77	Confident	70 Å²	70	48.3 Å²	48.3	28%	0.275	26%	0.263	S	S	.	.	S	Bend	trans	-80.9	138.7	179.2	-66.7	-83.6	0	0	0	112	M255 L257 T276 G277 Q278 V280	M255-Y259 WeakPolarHBondContact O-CD2 3.36Å; M255-Y259 WeakPolarHBondContact O-CE2 3.39Å; L257-Y259 PolarHBondContact O-N 3.43Å; Y259-T276 HydrophobicContact CG-CG2 4.11Å; Y259-G277 WeakPolarHBondContact CD1-O 3.29Å; Y259-Q278 WeakPolarHBondContact CE1-O 3.32Å; Y259-V280 HydrophobicContact CD1-CG2 3.94Å; Y259-V280 HydrophobicContact CE1-CG2 3.73Å; Y259-V280 HydrophobicContact CG-CG2 4.43Å
260	S	89.5	Confident	77.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.283	C	S	.	.			trans	-59.8	150.8	170	-43.4	0	0	0	0	111.3	A246 P247 G277 F284	A246-S260 WeakPolarHBondContact O-CA 3.38Å; P247-S260 VanDerWaalsContact O-CB 3.32Å; P247-S260 WeakPolarHBondContact O-CB 3.49Å; P247-S260 PolarHBondContact O-OG 3.46Å; S260-G277 PolarHBondContact O-N 2.79Å; S260-F284 VanDerWaalsContact CB-O 3.23Å; S260-F284 WeakPolarHBondContact CB-O 3.43Å
261	K	91.7	Very high	78.7	Confident	55 Å²	55	55.7 Å²	55.7	24%	0.239	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	153.3	-175.1	-63.6	177.3	-175.3	174.5	0	112.2	A246 D256 I275 T276	A246-K261 WeakPolarHBondContact CA-O 3.38Å; A246-K261 PolarHBondContact N-O 3.03Å; A246-K261 PolarHBondContact O-N 2.87Å; D256-K261 VanDerWaalsContact O-CE 3.29Å; D256-K261 WeakPolarHBondContact O-CE 3.49Å; D256-K261 PolarHBondContact O-NZ 2.91Å; K261-I275 CarbonylContact C-O 3.47Å; K261-I275 WeakPolarHBondContact CA-O 3.26Å; K261-T276 HydrophobicContact CG-CG2 4.42Å
262	V	94.1	Very high	79.9	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123.2	162	176.9	0	0	0	0	107.3	A243 I244 I275 F284 L288 L301 I303	A243-V262 HydrophobicContact CB-CG1 4.24Å; I244-V262 CarbonylContact O-C 3.48Å; I244-V262 WeakPolarHBondContact O-CA 3.41Å; V262-I275 PolarHBondContact N-O 3.19Å; V262-I275 PolarHBondContact O-N 2.95Å; V262-F284 HydrophobicContact CB-CE1 4.34Å; V262-F284 HydrophobicContact CG2-CD1 4.15Å; V262-F284 HydrophobicContact CG2-CE1 3.76Å; V262-L288 HydrophobicContact CG1-CD1 4.2Å; V262-L288 HydrophobicContact CG1-CD2 3.96Å; V262-L288 HydrophobicContact CG2-CD2 3.86Å; V262-L301 HydrophobicContact CG1-CD2 4.1Å; V262-I303 HydrophobicContact CB-CD1 4.28Å; V262-I303 HydrophobicContact CG2-CD1 4.02Å; V262-I303 HydrophobicContact CG2-CG1 4.43Å; V262-I303 HydrophobicContact CG2-CG2 3.9Å
263	A	93.4	Very high	81.5	Confident	7 Å²	7	50.3 Å²	50.3	6%	0.058	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	138.8	178.8	0	0	0	0	0	109.3	L225 I244 F265 V273 N274	L225-A263 HydrophobicContact CD1-CB 4.47Å; I244-A263 HydrophobicContact CG2-CB 3.98Å; I244-A263 WeakPolarHBondContact CG2-O 3.38Å; I244-A263 PolarHBondContact N-O 2.89Å; I244-A263 PolarHBondContact O-N 2.73Å; A263-F265 HydrophobicContact CB-CD2 4.14Å; A263-F265 HydrophobicContact CB-CE2 3.48Å; A263-F265 VanDerWaalsContact CB-CE2 3.48Å; A263-F265 HydrophobicContact CB-CZ 4.27Å; A263-V273 CarbonylContact C-O 3.59Å; A263-V273 WeakPolarHBondContact CA-O 3.47Å; A263-N274 VanDerWaalsContact CB-OD1 3.27Å; A263-N274 WeakPolarHBondContact CB-OD1 3.29Å
264	L	93.5	Very high	83.1	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	132.5	173.1	-53.2	-172.5	0	0	0	107.9	F234 V242 A243 V271 L272 V273 L301 F341	F234-L264 HydrophobicContact CB-CD1 3.99Å; F234-L264 HydrophobicContact CD1-CD1 4.06Å; F234-L264 HydrophobicContact CD2-CB 4.31Å; F234-L264 HydrophobicContact CD2-CD1 4.14Å; F234-L264 HydrophobicContact CD2-CD2 4.09Å; F234-L264 HydrophobicContact CD2-CG 4.41Å; F234-L264 HydrophobicContact CE2-CD2 3.99Å; F234-L264 HydrophobicContact CG-CD1 3.79Å; F234-L264 HydrophobicContact CG-CD2 4.48Å; F234-L264 HydrophobicContact CZ-CD2 4.25Å; V242-L264 CarbonylContact O-C 3.6Å; V242-L264 WeakPolarHBondContact O-CA 3.18Å; A243-L264 HydrophobicContact CB-CD2 3.44Å; A243-L264 VanDerWaalsContact CB-CD2 3.44Å; L264-V271 CarbonylContact O-C 3.54Å; L264-L272 HydrophobicContact CB-CB 4.14Å; L264-L272 PolarHBondContact O-N 2.83Å; L264-V273 HydrophobicContact CB-CB 4.35Å; L264-V273 HydrophobicContact CD1-CB 4Å; L264-V273 HydrophobicContact CD1-CG2 4.44Å; L264-V273 HydrophobicContact CG-CB 4.21Å; L264-V273 PolarHBondContact N-O 3.01Å; L264-L301 HydrophobicContact CD2-CD2 4.09Å; L264-F341 HydrophobicContact CD1-CD2 4.33Å; L264-F341 HydrophobicContact CD1-CE2 3.44Å; L264-F341 VanDerWaalsContact CD1-CE2 3.44Å; L264-F341 HydrophobicContact CD1-CZ 3.98Å
265	F	91.9	Very high	84.8	Confident	8 Å²	8	50 Å²	50	4%	0.035	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	147	-179.9	-73.2	-95.8	0	0	0	110.8	L199 T213 L225 D241 V242 I244 A263 A269 N270 V271	L199-F265 HydrophobicContact CD2-CB 3.73Å; L199-F265 HydrophobicContact CD2-CD1 4.27Å; L199-F265 HydrophobicContact CD2-CD2 4.28Å; L199-F265 HydrophobicContact CD2-CG 3.85Å; T213-F265 HydrophobicContact CG2-CD1 4.39Å; T213-F265 HydrophobicContact CG2-CE1 3.63Å; T213-F265 HydrophobicContact CG2-CZ 4.03Å; L225-F265 HydrophobicContact CD1-CE2 4.46Å; L225-F265 HydrophobicContact CD2-CZ 4.31Å; D241-F265 CarbonylContact C-O 3.53Å; D241-F265 VanDerWaalsContact CA-O 3.27Å; D241-F265 WeakPolarHBondContact CA-O 3.37Å; D241-F265 VanDerWaalsContact CB-O 3.31Å; D241-F265 WeakPolarHBondContact CB-O 3.19Å; V242-F265 HydrophobicContact CG2-CB 3.87Å; V242-F265 PolarHBondContact N-O 3.37Å; V242-F265 PolarHBondContact O-N 3.48Å; I244-F265 HydrophobicContact CB-CD2 4.47Å; I244-F265 HydrophobicContact CG2-CD2 3.43Å; I244-F265 VanDerWaalsContact CG2-CD2 3.43Å; I244-F265 HydrophobicContact CG2-CE2 3.24Å; I244-F265 HydrophobicContact CG2-CZ 4.45Å; A263-F265 HydrophobicContact CB-CD2 4.14Å; A263-F265 HydrophobicContact CB-CE2 3.48Å; A263-F265 VanDerWaalsContact CB-CE2 3.48Å; A263-F265 HydrophobicContact CB-CZ 4.27Å; F265-A269 WeakPolarHBondContact CD1-O 3.37Å; F265-N270 CarbonylContact C-O 3.58Å; F265-N270 WeakPolarHBondContact CA-O 3.44Å; F265-V271 HydrophobicContact CD1-CG2 4.04Å; F265-V271 HydrophobicContact CE1-CB 4.39Å; F265-V271 HydrophobicContact CE1-CG2 3.36Å; F265-V271 HydrophobicContact CE2-CG2 4.44Å; F265-V271 HydrophobicContact CZ-CG2 3.61Å
266	D	88.7	Confident	86.5	Confident	23 Å²	23	45.4 Å²	45.4	12%	0.123	24%	0.241	C	C	.	.			trans	-76.1	177.3	166.6	71.2	9.7	0	0	0	111.8	H268 A269 N270 L272	D266-H268 PolarHBondContact O-N 3.1Å; D266-H268 VanDerWaalsContact OD1-CA 3.26Å; D266-H268 WeakPolarHBondContact OD1-CA 3.44Å; D266-H268 WeakPolarHBondContact OD1-CB 3.04Å; D266-H268 PolarHBondContact OD1-N 2.73Å; D266-A269 PolarHBondContact O-N 2.91Å; D266-A269 VanDerWaalsContact O-N 3.16Å; D266-A269 PolarHBondContact OD1-N 2.91Å; D266-N270 PolarHBondContact N-O 3.01Å; D266-N270 PolarHBondContact OD1-N 2.88Å; D266-N270 PolarHBondContact OD1-ND2 3.18Å; D266-N270 WeakPolarHBondContact OD2-CB 3.16Å; D266-N270 PolarHBondContact OD2-ND2 3.44Å; D266-L272 HydrophobicContact CB-CD1 4.38Å; D266-L272 HydrophobicContact CB-CD2 4.23Å; D266-L272 HydrophobicContact CB-CG 4.39Å
267	D	84	Confident	87.7	Confident	13 Å²	13	39.7 Å²	39.7	7%	0.07	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	7.4	177.4	73.9	-43	0	0	0	114.4	K184 F186 R235	K184-D267 HydrophobicContact CD-CB 4.29Å; K184-D267 PolarHBondContact NZ-O 3.43Å; K184-D267 IonicContact NZ-OD2 3.59Å; K184-D267 PolarHBondContact NZ-OD2 3.31Å; F186-D267 HydrophobicContact CZ-CB 4.4Å; R235-D267 IonicContact NH2-OD1 3.6Å
268	H	85.5	Confident	88.8	Confident	92 Å²	92	42.2 Å²	42.2	43%	0.426	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.7	10.4	175.3	-62.7	82.5	0	0	0	112.7	Q211 D266 N270	Q211-H268 VanDerWaalsContact OE1-CA 3.27Å; Q211-H268 PolarHBondContact OE1-O 2.76Å; D266-H268 PolarHBondContact O-N 3.1Å; D266-H268 VanDerWaalsContact OD1-CA 3.26Å; D266-H268 WeakPolarHBondContact OD1-CA 3.44Å; D266-H268 WeakPolarHBondContact OD1-CB 3.04Å; D266-H268 PolarHBondContact OD1-N 2.73Å; H268-N270 VanDerWaalsContact C-N 3.3Å; H268-N270 PolarHBondContact O-N 3.18Å
269	A	86.3	Confident	89.4	Confident	14 Å²	14	40.7 Å²	40.7	12%	0.116	21%	0.213	C	C	.	.	S	Bend	trans	62.4	28.4	-176.7	0	0	0	0	0	114.9	L199 V201 T213 F265 D266	L199-A269 HydrophobicContact CD2-CB 4.36Å; V201-A269 HydrophobicContact CG2-CB 4.04Å; T213-A269 HydrophobicContact CG2-CB 4.3Å; F265-A269 WeakPolarHBondContact CD1-O 3.37Å; D266-A269 PolarHBondContact O-N 2.91Å; D266-A269 VanDerWaalsContact O-N 3.16Å; D266-A269 PolarHBondContact OD1-N 2.91Å
270	N	88.4	Confident	89.7	Confident	90 Å²	90	40.3 Å²	40.3	48%	0.481	22%	0.218	S	C	.	.			trans	-90.2	140.4	167.6	-51.7	-62.4	0	0	0	110.8	F265 D266 H268	F265-N270 CarbonylContact C-O 3.58Å; F265-N270 WeakPolarHBondContact CA-O 3.44Å; D266-N270 PolarHBondContact N-O 3.01Å; D266-N270 PolarHBondContact OD1-N 2.88Å; D266-N270 PolarHBondContact OD1-ND2 3.18Å; D266-N270 WeakPolarHBondContact OD2-CB 3.16Å; D266-N270 PolarHBondContact OD2-ND2 3.44Å; H268-N270 VanDerWaalsContact C-N 3.3Å; H268-N270 PolarHBondContact O-N 3.18Å
271	V	89	Confident	89.7	Confident	81 Å²	81	42.3 Å²	42.3	49%	0.491	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	129	178.5	-178.7	0	0	0	0	110.4	L264 F265 N274	L264-V271 CarbonylContact O-C 3.54Å; F265-V271 HydrophobicContact CD1-CG2 4.04Å; F265-V271 HydrophobicContact CE1-CB 4.39Å; F265-V271 HydrophobicContact CE1-CG2 3.36Å; F265-V271 HydrophobicContact CE2-CG2 4.44Å; F265-V271 HydrophobicContact CZ-CG2 3.61Å; V271-N274 WeakPolarHBondContact CG1-OD1 3.38Å
272	L	89.4	Confident	89.7	Confident	66 Å²	66	39.7 Å²	39.7	35%	0.346	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-55	174.5	-60.9	175.4	0	0	0	111.5	F234 D241 L264 D266	F234-L272 HydrophobicContact CB-CD1 4.35Å; D241-L272 HydrophobicContact CB-CD1 4.1Å; L264-L272 HydrophobicContact CB-CB 4.14Å; L264-L272 PolarHBondContact O-N 2.83Å; D266-L272 HydrophobicContact CB-CD1 4.38Å; D266-L272 HydrophobicContact CB-CD2 4.23Å; D266-L272 HydrophobicContact CB-CG 4.39Å
273	V	89.7	Confident	89.8	Confident	47 Å²	47	41.6 Å²	41.6	29%	0.285	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	142	-174.3	-179.2	0	0	0	0	109.5	A263 L264 I275	A263-V273 CarbonylContact C-O 3.59Å; A263-V273 WeakPolarHBondContact CA-O 3.47Å; L264-V273 HydrophobicContact CB-CB 4.35Å; L264-V273 HydrophobicContact CD1-CB 4Å; L264-V273 HydrophobicContact CD1-CG2 4.44Å; L264-V273 HydrophobicContact CG-CB 4.21Å; L264-V273 PolarHBondContact N-O 3.01Å; V273-I275 HydrophobicContact CG1-CG1 4.29Å
274	N	90.1	Very high	89.9	Confident	95 Å²	95	41.3 Å²	41.3	51%	0.508	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	129.7	169.1	-70.6	-27	0	0	0	109.9	A263 V271	A263-N274 VanDerWaalsContact CB-OD1 3.27Å; A263-N274 WeakPolarHBondContact CB-OD1 3.29Å; V271-N274 WeakPolarHBondContact CG1-OD1 3.38Å
275	I	92.8	Very high	90	Very high	12 Å²	12	41.3 Å²	41.3	6%	0.062	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	118.7	175.1	-57.9	173.6	0	0	0	107.6	K261 V262 V273 F284 L301 I303 Y333 F341	K261-I275 CarbonylContact C-O 3.47Å; K261-I275 WeakPolarHBondContact CA-O 3.26Å; V262-I275 PolarHBondContact N-O 3.19Å; V262-I275 PolarHBondContact O-N 2.95Å; V273-I275 HydrophobicContact CG1-CG1 4.29Å; I275-F284 HydrophobicContact CG2-CE1 4.2Å; I275-F284 HydrophobicContact CG2-CZ 3.88Å; I275-L301 HydrophobicContact CD1-CD2 3.74Å; I275-I303 HydrophobicContact CG2-CD1 4.35Å; I275-Y333 HydrophobicContact CD1-CD1 4.46Å; I275-Y333 HydrophobicContact CD1-CG 4.44Å; I275-Y333 HydrophobicContact CG2-CD1 4.3Å; I275-Y333 HydrophobicContact CG2-CD2 4.49Å; I275-Y333 HydrophobicContact CG2-CE1 3.72Å; I275-Y333 HydrophobicContact CG2-CE2 3.94Å; I275-F341 HydrophobicContact CD1-CD2 4.33Å; I275-F341 HydrophobicContact CD1-CG 4.42Å
276	T	91.9	Very high	90.1	Very high	62 Å²	62	41.1 Å²	41.1	38%	0.38	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	134.9	-178.2	-54.9	0	0	0	0	110.3	Y259 K261	Y259-T276 HydrophobicContact CG-CG2 4.11Å; K261-T276 HydrophobicContact CG-CG2 4.42Å
277	G	89.8	Confident	90.4	Very high	6 Å²	6	40 Å²	40	6%	0.062	23%	0.226	C	C	.	.			trans	-69.1	160.7	175.9	0	0	0	0	0	112.9	Y259 S260	Y259-G277 WeakPolarHBondContact CD1-O 3.29Å; S260-G277 PolarHBondContact O-N 2.79Å
278	Q	87.5	Confident	90.9	Very high	98 Å²	98	40 Å²	40	46%	0.458	23%	0.226	S	C	.	.	S	Bend	trans	-93.3	-16.6	-174.8	-66.4	174.9	-10.7	0	0	114.4	Y259 H344	Y259-Q278 WeakPolarHBondContact CE1-O 3.32Å; Q278-H344 PolarHBondContact NE2-NE2 2.98Å; Q278-H344 VanDerWaalsContact NE2-NE2 3.1Å
279	Q	88.7	Confident	91.3	Very high	15 Å²	15	36 Å²	36	7%	0.07	21%	0.21	C	C	.	.	S	Bend	trans	-132.9	125.8	-177.1	-177.1	-177.8	93.2	0	0	111.2	S282 Y308 S309	Q279-S282 VanDerWaalsContact O-CB 3.24Å; Q279-S282 WeakPolarHBondContact O-CB 3.13Å; Q279-S282 PolarHBondContact O-N 2.97Å; Q279-S282 PolarHBondContact O-OG 2.85Å; Q279-Y308 HydrophobicContact CB-CD2 4.14Å; Q279-Y308 HydrophobicContact CB-CE2 4.16Å; Q279-S309 PolarHBondContact NE2-O 3.38Å
280	V	88.9	Confident	91.5	Very high	62 Å²	62	36.5 Å²	36.5	38%	0.376	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	136.3	173.9	178.1	0	0	0	0	110.3	L258 Y259 S282	L258-V280 HydrophobicContact CB-CG2 4.33Å; L258-V280 HydrophobicContact CD1-CG1 3.94Å; L258-V280 HydrophobicContact CD2-CB 4.37Å; L258-V280 HydrophobicContact CD2-CG1 3.91Å; L258-V280 HydrophobicContact CD2-CG2 3.61Å; L258-V280 HydrophobicContact CG-CB 4.24Å; L258-V280 HydrophobicContact CG-CG1 3.58Å; L258-V280 HydrophobicContact CG-CG2 3.61Å; Y259-V280 HydrophobicContact CD1-CG2 3.94Å; Y259-V280 HydrophobicContact CE1-CG2 3.73Å; Y259-V280 HydrophobicContact CG-CG2 4.43Å; V280-S282 PolarHBondContact O-N 3.46Å
281	G	88.6	Confident	91.6	Very high	42 Å²	42	33.4 Å²	33.4	43%	0.433	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	0.1	179.4	0	0	0	0	0	114.8	Y283 L307	G281-Y283 PolarHBondContact O-N 2.9Å; G281-L307 VanDerWaalsContact O-CB 3.29Å; G281-L307 WeakPolarHBondContact O-CB 3.47Å
282	S	92.8	Very high	91.8	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.176	C	C	.	.	S	Bend	trans	-67	-14.1	175.6	63.4	0	0	0	0	113.8	Q279 V280 F284 A305 L307 Y308	Q279-S282 VanDerWaalsContact O-CB 3.24Å; Q279-S282 WeakPolarHBondContact O-CB 3.13Å; Q279-S282 PolarHBondContact O-N 2.97Å; Q279-S282 PolarHBondContact O-OG 2.85Å; V280-S282 PolarHBondContact O-N 3.46Å; S282-F284 PolarHBondContact O-N 2.86Å; S282-A305 CarbonylContact O-C 3.54Å; S282-A305 WeakPolarHBondContact O-CA 3.34Å; S282-L307 PolarHBondContact O-N 2.98Å; S282-Y308 PolarHBondContact O-N 3.2Å
283	Y	94.5	Very high	92	Very high	41 Å²	41	27.3 Å²	27.3	16%	0.161	16%	0.16	C	C	.	.			trans	62.3	33.1	-177.1	-132.2	-117.3	0	0	0	112.3	Y227 P247 G281 G285 A286 L307	Y227-Y283 HydrophobicContact CE1-CE1 4.11Å; Y227-Y283 HydrophobicContact CE2-CE1 4.04Å; Y227-Y283 WeakPolarHBondContact CE2-OH 3.37Å; Y227-Y283 AromaticContact CZ-CE1 3.71Å; P247-Y283 HydrophobicContact CB-CD1 3.73Å; P247-Y283 HydrophobicContact CB-CD2 3.98Å; P247-Y283 HydrophobicContact CB-CE1 3.88Å; P247-Y283 HydrophobicContact CB-CE2 4.15Å; P247-Y283 HydrophobicContact CB-CG 3.77Å; P247-Y283 HydrophobicContact CG-CD1 4.18Å; P247-Y283 HydrophobicContact CG-CE1 3.8Å; P247-Y283 HydrophobicContact CG-CE2 4.28Å; P247-Y283 WeakPolarHBondContact O-CA 3.45Å; G281-Y283 PolarHBondContact O-N 2.9Å; Y283-G285 PolarHBondContact O-N 2.83Å; Y283-A286 HydrophobicContact CD1-CB 3.79Å; Y283-A286 HydrophobicContact CE1-CB 4.5Å; Y283-A286 VanDerWaalsContact O-CB 3.27Å; Y283-A286 WeakPolarHBondContact O-CB 3.3Å; Y283-A286 PolarHBondContact O-N 3.43Å; Y283-L307 HydrophobicContact CD2-CD1 4.15Å; Y283-L307 HydrophobicContact CG-CD1 4Å; Y283-L307 HydrophobicContact CG-CG 4.42Å
284	F	95.9	Very high	92.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	128.2	179.3	171.3	-84	0	0	0	111.3	P247 S260 V262 I275 S282 I303 A305 Y331 Y333	P247-F284 WeakPolarHBondContact CA-O 3.42Å; S260-F284 VanDerWaalsContact CB-O 3.23Å; S260-F284 WeakPolarHBondContact CB-O 3.43Å; V262-F284 HydrophobicContact CB-CE1 4.34Å; V262-F284 HydrophobicContact CG2-CD1 4.15Å; V262-F284 HydrophobicContact CG2-CE1 3.76Å; I275-F284 HydrophobicContact CG2-CE1 4.2Å; I275-F284 HydrophobicContact CG2-CZ 3.88Å; S282-F284 PolarHBondContact O-N 2.86Å; F284-I303 HydrophobicContact CD1-CG2 4.18Å; F284-I303 HydrophobicContact CD2-CG2 3.79Å; F284-I303 HydrophobicContact CE1-CD1 4.03Å; F284-I303 HydrophobicContact CE1-CG2 4Å; F284-I303 HydrophobicContact CE2-CB 4.04Å; F284-I303 HydrophobicContact CE2-CD1 4.02Å; F284-I303 HydrophobicContact CE2-CG2 3.61Å; F284-I303 HydrophobicContact CG-CG2 4.08Å; F284-I303 HydrophobicContact CZ-CB 4.21Å; F284-I303 HydrophobicContact CZ-CD1 3.38Å; F284-I303 HydrophobicContact CZ-CG1 4.38Å; F284-I303 HydrophobicContact CZ-CG2 3.73Å; F284-A305 HydrophobicContact CB-CB 4.02Å; F284-A305 HydrophobicContact CD2-CB 4.33Å; F284-Y331 AromaticContact CD2-CD2 3.68Å; F284-Y331 HydrophobicContact CD2-CD2 3.68Å; F284-Y331 AromaticContact CD2-CE2 3.9Å; F284-Y331 HydrophobicContact CD2-CE2 3.9Å; F284-Y331 HydrophobicContact CD2-CG 4.27Å; F284-Y331 HydrophobicContact CE2-CD1 4.4Å; F284-Y331 AromaticContact CE2-CD2 3.68Å; F284-Y331 HydrophobicContact CE2-CD2 3.68Å; F284-Y331 HydrophobicContact CE2-CE2 4.24Å; F284-Y331 AromaticContact CE2-CG 3.79Å; F284-Y331 HydrophobicContact CE2-CG 3.79Å; F284-Y333 HydrophobicContact CE2-CE2 4.14Å; F284-Y333 AromaticContact CZ-CE2 3.96Å; F284-Y333 HydrophobicContact CZ-CE2 3.96Å
285	G	95.1	Very high	92.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.7	10.7	-170.5	0	0	0	0	0	113.7	S228 Y283 A287 G304	S228-G285 PolarHBondContact OG-O 2.87Å; Y283-G285 PolarHBondContact O-N 2.83Å; G285-A287 VanDerWaalsContact C-N 3.28Å; G285-A287 PolarHBondContact O-N 2.87Å; G285-G304 PolarHBondContact N-O 3.2Å
286	A	94.7	Very high	92.1	Very high	4 Å²	4	29.5 Å²	29.5	3%	0.033	17%	0.17	C	C	.	.	S	Bend	trans	-65.3	-32.2	175.5	0	0	0	0	0	113.1	K2 S228 Y283 G304 P306	K2-A286 WeakPolarHBondContact CE-O 3.48Å; S228-A286 WeakPolarHBondContact CB-O 3.45Å; Y283-A286 HydrophobicContact CD1-CB 3.79Å; Y283-A286 HydrophobicContact CE1-CB 4.5Å; Y283-A286 VanDerWaalsContact O-CB 3.27Å; Y283-A286 WeakPolarHBondContact O-CB 3.3Å; Y283-A286 PolarHBondContact O-N 3.43Å; A286-G304 PolarHBondContact N-O 3.29Å; A286-P306 HydrophobicContact CB-CG 3.71Å
287	A	95.2	Very high	92	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	145.9	176.2	0	0	0	0	0	109.8	G285 G304 V360	G285-A287 VanDerWaalsContact C-N 3.28Å; G285-A287 PolarHBondContact O-N 2.87Å; A287-G304 PolarHBondContact O-N 3.11Å; A287-V360 HydrophobicContact CB-CG2 4Å
288	L	95.1	Very high	92.1	Very high	13 Å²	13	30.6 Å²	30.6	7%	0.068	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	139.3	-177	-63.3	174.9	0	0	0	108.8	S228 A230 A243 V262 L301 I302 I303	S228-L288 VanDerWaalsContact OG-CD1 3.3Å; S228-L288 WeakPolarHBondContact OG-CD1 3.4Å; S228-L288 WeakPolarHBondContact OG-CG 3.27Å; A230-L288 HydrophobicContact CB-CB 3.77Å; A243-L288 HydrophobicContact CB-CD1 4.01Å; A243-L288 WeakPolarHBondContact O-CD1 3.27Å; V262-L288 HydrophobicContact CG1-CD1 4.2Å; V262-L288 HydrophobicContact CG1-CD2 3.96Å; V262-L288 HydrophobicContact CG2-CD2 3.86Å; L288-L301 HydrophobicContact CD2-CD1 4.39Å; L288-I302 WeakPolarHBondContact CA-O 3.37Å; L288-I303 HydrophobicContact CD2-CB 4.26Å; L288-I303 HydrophobicContact CD2-CG1 3.85Å; L288-I303 HydrophobicContact CD2-CG2 4.05Å
289	A	93	Very high	92.3	Very high	9 Å²	9	28.1 Å²	28.1	7%	0.074	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	156.1	166.5	0	0	0	0	0	109	I302 V360 T362	A289-I302 HydrophobicContact CB-CB 4.25Å; A289-I302 HydrophobicContact CB-CD1 4.14Å; A289-I302 PolarHBondContact N-O 2.86Å; A289-I302 PolarHBondContact O-N 3.49Å; A289-V360 HydrophobicContact CB-CB 4.49Å; A289-V360 HydrophobicContact CB-CG2 3.9Å; A289-T362 HydrophobicContact CB-CG2 3.97Å
290	V	91.6	Very high	92.5	Very high	23 Å²	23	27.4 Å²	27.4	14%	0.139	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	127.8	-175.2	179.4	0	0	0	0	108.8	A230 F234 D299 D300 L301	A230-V290 HydrophobicContact CB-CG2 3.75Å; F234-V290 HydrophobicContact CE1-CG1 4.25Å; F234-V290 HydrophobicContact CE1-CG2 4.39Å; F234-V290 HydrophobicContact CZ-CG1 4.22Å; F234-V290 HydrophobicContact CZ-CG2 3.75Å; V290-D299 HydrophobicContact CG1-CB 3.54Å; V290-D300 VanDerWaalsContact CA-O 3.31Å; V290-D300 WeakPolarHBondContact CA-O 3.39Å; V290-L301 HydrophobicContact CG2-CD1 3.79Å
291	D	89.9	Confident	92.8	Very high	25 Å²	25	24.4 Å²	24.4	13%	0.134	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	164.5	175	-154.2	-10.9	0	0	0	111	L293 D300 T362 N372	D291-L293 PolarHBondContact O-N 2.87Å; D291-D300 PolarHBondContact N-O 3.23Å; D291-D300 WeakPolarHBondContact O-CA 3.14Å; D291-D300 WeakPolarHBondContact O-CB 3.13Å; D291-D300 PolarHBondContact O-N 2.92Å; D291-T362 HydrophobicContact CB-CG2 3.44Å; D291-T362 VanDerWaalsContact CB-CG2 3.44Å; D291-T362 WeakPolarHBondContact OD2-CB 3.49Å; D291-N372 PolarHBondContact OD1-ND2 3.29Å; D291-N372 WeakPolarHBondContact OD2-CB 3.37Å; D291-N372 PolarHBondContact OD2-ND2 3Å
292	D	92.6	Very high	93.3	Very high	20 Å²	20	22.4 Å²	22.4	11%	0.107	13%	0.134	C	C	.	.			trans	-89.4	94.3	175.9	-179.2	0.3	0	0	0	110.4	N294 N295 D296 G297 L298 N372	D292-N294 PolarHBondContact OD1-N 3.46Å; D292-N294 PolarHBondContact OD1-OD1 3Å; D292-N294 VanDerWaalsContact OD1-OD1 3.13Å; D292-N295 VanDerWaalsContact CG-CA 3.5Å; D292-N295 WeakPolarHBondContact OD1-CA 3.48Å; D292-N295 PolarHBondContact OD1-N 2.72Å; D292-N295 VanDerWaalsContact OD2-CA 3.29Å; D292-N295 WeakPolarHBondContact OD2-CA 3.21Å; D292-D296 PolarHBondContact OD1-N 3.02Å; D292-D296 VanDerWaalsContact OD1-N 3.13Å; D292-D296 PolarHBondContact OD2-N 3.37Å; D292-G297 VanDerWaalsContact OD2-CA 3.26Å; D292-G297 WeakPolarHBondContact OD2-CA 3.37Å; D292-G297 PolarHBondContact OD2-N 2.89Å; D292-L298 WeakPolarHBondContact CB-O 3.5Å; D292-N372 WeakPolarHBondContact O-CB 3.28Å
293	L	93.4	Very high	93.5	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	-85.3	-15.2	-173.9	-61.4	175.9	0	0	0	113	D291 D300 I302 V332 F334 N372 F374 G394 S395 V399	D291-L293 PolarHBondContact O-N 2.87Å; L293-D300 PolarHBondContact N-OD2 3.04Å; L293-D300 VanDerWaalsContact N-OD2 3.07Å; L293-I302 HydrophobicContact CD1-CD1 4.06Å; L293-I302 HydrophobicContact CD1-CG1 4.03Å; L293-V332 HydrophobicContact CD1-CG1 3.56Å; L293-F334 HydrophobicContact CB-CE1 4.31Å; L293-N372 HydrophobicContact CD2-CB 4.42Å; L293-N372 VanDerWaalsContact CD2-O 3.22Å; L293-N372 WeakPolarHBondContact CD2-O 3.38Å; L293-F374 HydrophobicContact CD1-CD1 4.1Å; L293-F374 HydrophobicContact CD1-CE1 4.28Å; L293-F374 HydrophobicContact CD2-CD1 4.05Å; L293-G394 WeakPolarHBondContact O-CA 3.35Å; L293-S395 PolarHBondContact O-N 3.42Å; L293-V399 HydrophobicContact CB-CG2 4.44Å; L293-V399 HydrophobicContact CD1-CG2 3.7Å
294	N	93.4	Very high	93.6	Very high	26 Å²	26	20.5 Å²	20.5	14%	0.139	13%	0.127	C	C	.	.	S	Bend	trans	-111.5	-0.6	-177.9	73.9	17.6	0	0	0	113.3	D292 D296 F334 Y371 S395	D292-N294 PolarHBondContact OD1-N 3.46Å; D292-N294 PolarHBondContact OD1-OD1 3Å; D292-N294 VanDerWaalsContact OD1-OD1 3.13Å; N294-D296 VanDerWaalsContact C-N 3.34Å; N294-D296 PolarHBondContact ND2-OD2 3.5Å; N294-D296 PolarHBondContact O-N 2.82Å; N294-D296 WeakPolarHBondContact OD1-CB 3.42Å; N294-D296 PolarHBondContact OD1-N 3.39Å; N294-D296 PolarHBondContact OD1-OD1 2.86Å; N294-D296 PolarHBondContact OD1-OD2 2.6Å; N294-F334 HydrophobicContact CB-CD1 4.43Å; N294-F334 HydrophobicContact CB-CE1 4.37Å; N294-Y371 WeakPolarHBondContact O-CE1 3.43Å; N294-S395 WeakPolarHBondContact CA-O 3.38Å
295	N	90.6	Very high	93.7	Very high	95 Å²	95	20.5 Å²	20.5	51%	0.508	13%	0.127	S	C	.	.	S	Bend	trans	55.7	41.6	-179.2	-161.9	1.4	0	0	0	113.1	D292 G370 Y371	D292-N295 VanDerWaalsContact CG-CA 3.5Å; D292-N295 WeakPolarHBondContact OD1-CA 3.48Å; D292-N295 PolarHBondContact OD1-N 2.72Å; D292-N295 VanDerWaalsContact OD2-CA 3.29Å; D292-N295 WeakPolarHBondContact OD2-CA 3.21Å; N295-G370 PolarHBondContact ND2-O 3.4Å; N295-Y371 HydrophobicContact CB-CD1 3.81Å; N295-Y371 HydrophobicContact CB-CE1 3.96Å
296	D	91.9	Very high	93.8	Very high	79 Å²	79	20.7 Å²	20.7	42%	0.422	13%	0.128	S	C	.	.	S	Bend	trans	-95.5	-4.3	176.3	79.8	6.2	0	0	0	114.1	D292 N294 L298	D292-D296 PolarHBondContact OD1-N 3.02Å; D292-D296 VanDerWaalsContact OD1-N 3.13Å; D292-D296 PolarHBondContact OD2-N 3.37Å; N294-D296 VanDerWaalsContact C-N 3.34Å; N294-D296 PolarHBondContact ND2-OD2 3.5Å; N294-D296 PolarHBondContact O-N 2.82Å; N294-D296 WeakPolarHBondContact OD1-CB 3.42Å; N294-D296 PolarHBondContact OD1-N 3.39Å; N294-D296 PolarHBondContact OD1-OD1 2.86Å; N294-D296 PolarHBondContact OD1-OD2 2.6Å; D296-L298 WeakPolarHBondContact OD1-CB 3.37Å; D296-L298 PolarHBondContact OD1-N 2.92Å
297	G	89.3	Confident	93.8	Very high	62 Å²	62	22 Å²	22	64%	0.639	13%	0.134	S	C	*	.	S	Bend	trans	86.9	11.9	179.7	0	0	0	0	0	114.5	D292	D292-G297 VanDerWaalsContact OD2-CA 3.26Å; D292-G297 WeakPolarHBondContact OD2-CA 3.37Å; D292-G297 PolarHBondContact OD2-N 2.89Å
298	L	91.3	Very high	93.8	Very high	29 Å²	29	22.3 Å²	22.3	15%	0.152	14%	0.135	C	C	.	.	S	Bend	trans	-116.9	151	178	-57.5	174.1	0	0	0	110.6	D292 D296 D300 Q335 N336 K337	D292-L298 WeakPolarHBondContact CB-O 3.5Å; D296-L298 WeakPolarHBondContact OD1-CB 3.37Å; D296-L298 PolarHBondContact OD1-N 2.92Å; L298-D300 PolarHBondContact O-N 3.42Å; L298-Q335 HydrophobicContact CB-CB 4.05Å; L298-Q335 HydrophobicContact CB-CG 4.39Å; L298-N336 WeakPolarHBondContact CD1-O 3.5Å; L298-K337 HydrophobicContact CD1-CG 4.38Å
299	D	91.4	Very high	93.7	Very high	45 Å²	45	23 Å²	23	24%	0.241	14%	0.141	C	C	.	.			trans	-84.4	113.1	-175.4	-84.5	-5.1	0	0	0	110.2	G232 N233 F234 V290 Q335	G232-D299 WeakPolarHBondContact CA-OD2 3.47Å; N233-D299 PolarHBondContact N-OD2 2.89Å; F234-D299 HydrophobicContact CE1-CB 4.48Å; V290-D299 HydrophobicContact CG1-CB 3.54Å; D299-Q335 VanDerWaalsContact N-OE1 3.1Å; D299-Q335 WeakPolarHBondContact O-CB 3.45Å; D299-Q335 PolarHBondContact O-OE1 3.35Å
300	D	94.7	Very high	93.5	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	151.7	173.7	-56.6	-45.5	0	0	0	111	V290 D291 L293 L298 F334 Q335	V290-D300 VanDerWaalsContact CA-O 3.31Å; V290-D300 WeakPolarHBondContact CA-O 3.39Å; D291-D300 PolarHBondContact N-O 3.23Å; D291-D300 WeakPolarHBondContact O-CA 3.14Å; D291-D300 WeakPolarHBondContact O-CB 3.13Å; D291-D300 PolarHBondContact O-N 2.92Å; L293-D300 PolarHBondContact N-OD2 3.04Å; L293-D300 VanDerWaalsContact N-OD2 3.07Å; L298-D300 PolarHBondContact O-N 3.42Å; D300-F334 HydrophobicContact CB-CD1 4.3Å; D300-F334 VanDerWaalsContact CG-CD1 3.46Å; D300-F334 VanDerWaalsContact OD1-CA 3.23Å; D300-F334 WeakPolarHBondContact OD1-CA 3.39Å; D300-F334 WeakPolarHBondContact OD1-CD1 3.17Å; D300-F334 VanDerWaalsContact OD2-CD1 3.26Å; D300-F334 WeakPolarHBondContact OD2-CD1 3.25Å; D300-Q335 PolarHBondContact OD1-N 2.85Å; D300-Q335 VanDerWaalsContact OD1-N 3.08Å
301	L	95.3	Very high	93	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	121.3	-175.9	-176.9	67.2	0	0	0	111.6	F234 A243 V262 L264 I275 L288 V290 I303 V332 Y333 F341	F234-L301 HydrophobicContact CZ-CD1 4.41Å; A243-L301 HydrophobicContact CB-CD1 3.69Å; A243-L301 HydrophobicContact CB-CD2 4.46Å; V262-L301 HydrophobicContact CG1-CD2 4.1Å; L264-L301 HydrophobicContact CD2-CD2 4.09Å; I275-L301 HydrophobicContact CD1-CD2 3.74Å; L288-L301 HydrophobicContact CD2-CD1 4.39Å; V290-L301 HydrophobicContact CG2-CD1 3.79Å; L301-I303 HydrophobicContact CD2-CD1 3.77Å; L301-I303 HydrophobicContact CD2-CG1 4.02Å; L301-I303 HydrophobicContact CG-CD1 4.1Å; L301-I303 HydrophobicContact CG-CG1 3.82Å; L301-V332 WeakPolarHBondContact O-CA 3.31Å; L301-Y333 PolarHBondContact N-O 2.77Å; L301-Y333 PolarHBondContact O-N 3.47Å; L301-F341 HydrophobicContact CB-CE1 4.17Å
302	I	97.2	Very high	92.1	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.5	177.4	-51.8	162.5	0	0	0	108.5	L288 A289 L293 V330 Y331 V332 V360 T362 F374	L288-I302 WeakPolarHBondContact CA-O 3.37Å; A289-I302 HydrophobicContact CB-CB 4.25Å; A289-I302 HydrophobicContact CB-CD1 4.14Å; A289-I302 PolarHBondContact N-O 2.86Å; A289-I302 PolarHBondContact O-N 3.49Å; L293-I302 HydrophobicContact CD1-CD1 4.06Å; L293-I302 HydrophobicContact CD1-CG1 4.03Å; I302-V330 HydrophobicContact CG2-CG1 3.58Å; I302-Y331 CarbonylContact C-O 3.55Å; I302-Y331 WeakPolarHBondContact CA-O 3.01Å; I302-V332 HydrophobicContact CG2-CG2 4.47Å; I302-V360 HydrophobicContact CG2-CB 4.06Å; I302-V360 HydrophobicContact CG2-CG1 4.13Å; I302-V360 HydrophobicContact CG2-CG2 4.05Å; I302-T362 HydrophobicContact CD1-CG2 3.85Å; I302-F374 HydrophobicContact CD1-CB 3.81Å; I302-F374 HydrophobicContact CD1-CD1 4.34Å; I302-F374 HydrophobicContact CD1-CD2 4.25Å; I302-F374 HydrophobicContact CD1-CG 3.88Å; I302-F374 HydrophobicContact CG2-CD2 4.22Å; I302-F374 HydrophobicContact CG2-CE2 4.3Å
303	I	97.8	Very high	90.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	120.4	-172.4	-52.4	174.7	0	0	0	110.7	V262 I275 F284 L288 L301 V330 Y331 Y333	V262-I303 HydrophobicContact CB-CD1 4.28Å; V262-I303 HydrophobicContact CG2-CD1 4.02Å; V262-I303 HydrophobicContact CG2-CG1 4.43Å; V262-I303 HydrophobicContact CG2-CG2 3.9Å; I275-I303 HydrophobicContact CG2-CD1 4.35Å; F284-I303 HydrophobicContact CD1-CG2 4.18Å; F284-I303 HydrophobicContact CD2-CG2 3.79Å; F284-I303 HydrophobicContact CE1-CD1 4.03Å; F284-I303 HydrophobicContact CE1-CG2 4Å; F284-I303 HydrophobicContact CE2-CB 4.04Å; F284-I303 HydrophobicContact CE2-CD1 4.02Å; F284-I303 HydrophobicContact CE2-CG2 3.61Å; F284-I303 HydrophobicContact CG-CG2 4.08Å; F284-I303 HydrophobicContact CZ-CB 4.21Å; F284-I303 HydrophobicContact CZ-CD1 3.38Å; F284-I303 HydrophobicContact CZ-CG1 4.38Å; F284-I303 HydrophobicContact CZ-CG2 3.73Å; L288-I303 HydrophobicContact CD2-CB 4.26Å; L288-I303 HydrophobicContact CD2-CG1 3.85Å; L288-I303 HydrophobicContact CD2-CG2 4.05Å; L301-I303 HydrophobicContact CD2-CD1 3.77Å; L301-I303 HydrophobicContact CD2-CG1 4.02Å; L301-I303 HydrophobicContact CG-CD1 4.1Å; L301-I303 HydrophobicContact CG-CG1 3.82Å; I303-V330 CarbonylContact O-C 3.44Å; I303-V330 WeakPolarHBondContact O-CA 3.41Å; I303-Y331 PolarHBondContact N-O 2.64Å; I303-Y331 PolarHBondContact O-N 2.86Å; I303-Y333 HydrophobicContact CD1-CD2 3.67Å; I303-Y333 HydrophobicContact CD1-CE2 3.79Å; I303-Y333 HydrophobicContact CG1-CD2 4.43Å
304	G	97	Very high	89.3	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	136.6	173.5	0	0	0	0	0	113.4	G285 A286 A287 G357	G285-G304 PolarHBondContact N-O 3.2Å; A286-G304 PolarHBondContact N-O 3.29Å; A287-G304 PolarHBondContact O-N 3.11Å; G304-G357 WeakPolarHBondContact CA-O 3.36Å
305	A	97.2	Very high	87.4	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	71.3	174.9	0	0	0	0	0	110	S282 F284 L307 Y308 G328 A329 Y331	S282-A305 CarbonylContact O-C 3.54Å; S282-A305 WeakPolarHBondContact O-CA 3.34Å; F284-A305 HydrophobicContact CB-CB 4.02Å; F284-A305 HydrophobicContact CD2-CB 4.33Å; A305-L307 PolarHBondContact O-N 3.28Å; A305-L307 VanDerWaalsContact O-N 3.1Å; A305-Y308 WeakPolarHBondContact O-CB 3.15Å; A305-Y308 PolarHBondContact O-N 3.15Å; A305-Y308 VanDerWaalsContact O-N 3.11Å; A305-G328 WeakPolarHBondContact O-CA 3.43Å; A305-A329 HydrophobicContact CB-CB 4.49Å; A305-A329 PolarHBondContact N-O 2.88Å; A305-A329 PolarHBondContact O-N 2.87Å; A305-Y331 HydrophobicContact CB-CD2 4.38Å; A305-Y331 HydrophobicContact CB-CE2 3.97Å
306	P	96.5	Very high	85.3	Confident	4 Å²	4	41.5 Å²	41.5	3%	0.026	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-13.7	-166.9	24.6	-34.1	0	0	0	115.6	A286 R355 F356 H358	A286-P306 HydrophobicContact CB-CG 3.71Å; P306-R355 HydrophobicContact CB-CB 4.08Å; P306-R355 WeakPolarHBondContact O-CA 3.25Å; P306-F356 WeakPolarHBondContact CA-O 3.45Å; P306-H358 HydrophobicContact CB-CB 4.32Å
307	L	95.7	Very high	83.1	Confident	31 Å²	31	47.2 Å²	47.2	16%	0.162	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	8.8	178.9	-54.8	-175.1	0	0	0	112.4	G281 S282 Y283 A305 S309 E326 R355	G281-L307 VanDerWaalsContact O-CB 3.29Å; G281-L307 WeakPolarHBondContact O-CB 3.47Å; S282-L307 PolarHBondContact O-N 2.98Å; Y283-L307 HydrophobicContact CD2-CD1 4.15Å; Y283-L307 HydrophobicContact CG-CD1 4Å; Y283-L307 HydrophobicContact CG-CG 4.42Å; A305-L307 PolarHBondContact O-N 3.28Å; A305-L307 VanDerWaalsContact O-N 3.1Å; L307-S309 PolarHBondContact O-N 3.25Å; L307-E326 HydrophobicContact CD2-CG 4.29Å; L307-R355 HydrophobicContact CD2-CG 4.48Å
308	Y	95	Very high	81.1	Confident	8 Å²	8	52 Å²	52	3%	0.031	26%	0.264	C	S	.	.			trans	-55.9	136.5	173.8	-177.2	-88	0	0	0	110.8	Q279 S282 A305 E314 E326 V327 G328 A329 Y331 K346 V348	Q279-Y308 HydrophobicContact CB-CD2 4.14Å; Q279-Y308 HydrophobicContact CB-CE2 4.16Å; S282-Y308 PolarHBondContact O-N 3.2Å; A305-Y308 WeakPolarHBondContact O-CB 3.15Å; A305-Y308 PolarHBondContact O-N 3.15Å; A305-Y308 VanDerWaalsContact O-N 3.11Å; Y308-E314 PolarHBondContact OH-OE2 2.61Å; Y308-E326 CarbonylContact O-C 3.59Å; Y308-E326 WeakPolarHBondContact O-CA 3.33Å; Y308-V327 HydrophobicContact CD1-CG2 3.95Å; Y308-V327 WeakPolarHBondContact O-CG2 3.3Å; Y308-V327 PolarHBondContact O-N 3.34Å; Y308-G328 PolarHBondContact O-N 3.33Å; Y308-A329 HydrophobicContact CD1-CB 3.92Å; Y308-A329 HydrophobicContact CD2-CB 4.19Å; Y308-A329 HydrophobicContact CG-CB 3.69Å; Y308-Y331 WeakPolarHBondContact CE2-OH 3.4Å; Y308-K346 PolarHBondContact OH-NZ 2.96Å; Y308-V348 HydrophobicContact CD1-CG1 4.4Å; Y308-V348 HydrophobicContact CE1-CG1 4.2Å; Y308-V348 HydrophobicContact CE1-CG2 4.23Å
309	S	93.3	Very high	78.9	Confident	27 Å²	27	57.3 Å²	57.3	19%	0.189	29%	0.292	C	S	.	.			trans	-119.9	132.1	177.9	-59.2	0	0	0	0	109.7	Q279 L307 E324 E326	Q279-S309 PolarHBondContact NE2-O 3.38Å; L307-S309 PolarHBondContact O-N 3.25Å; S309-E324 CarbonylContact C-O 3.53Å; S309-E324 WeakPolarHBondContact CA-O 3.33Å; S309-E326 PolarHBondContact OG-N 3.46Å; S309-E326 VanDerWaalsContact OG-N 3.08Å
310	L	87.5	Confident	76.7	Confident	18 Å²	18	61 Å²	61	9%	0.094	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-81.8	123.1	178.3	-176.2	65.6	0	0	0	109.2	E314 E315 S323 E324 V327	L310-E314 HydrophobicContact CD1-CB 4.36Å; L310-E315 HydrophobicContact CD1-CB 4.36Å; L310-E315 HydrophobicContact CD1-CG 4.03Å; L310-S323 CarbonylContact O-C 3.27Å; L310-S323 VanDerWaalsContact O-CA 3.24Å; L310-S323 WeakPolarHBondContact O-CA 3.48Å; L310-S323 WeakPolarHBondContact O-CB 3.31Å; L310-E324 HydrophobicContact CB-CB 4.45Å; L310-E324 PolarHBondContact N-O 3.01Å; L310-E324 PolarHBondContact O-N 3.13Å; L310-V327 HydrophobicContact CB-CG2 4.11Å
311	R	82.7	Confident	74.9	Confident	147 Å²	147	63.6 Å²	63.6	56%	0.555	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-89.5	145.9	176.4	-61.2	-178.2	177.3	156.4	-4.4	110.6	N313 E314	R311-N313 PolarHBondContact O-N 2.84Å; R311-E314 HydrophobicContact CB-CG 4.09Å; R311-E314 WeakPolarHBondContact CD-OE1 3.46Å; R311-E314 PolarHBondContact N-OE2 3.21Å; R311-E314 IonicContact NH1-OE1 3.36Å; R311-E314 PolarHBondContact O-N 3.08Å; R311-E314 VanDerWaalsContact O-N 3.15Å
312	X	70	Confident	73.6	Confident	39 Å²	39	71.5 Å²	71.5	32%	0.322	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	131.6	167.4	0	0	0	0	0	110	V321 S323	A312-V321 WeakPolarHBondContact CA-O 3.38Å; A312-V321 VanDerWaalsContact CB-O 3.25Å; A312-V321 WeakPolarHBondContact CB-O 3.3Å; A312-S323 PolarHBondContact N-OG 3.31Å; A312-S323 VanDerWaalsContact N-OG 3.1Å
313	N	65.4	Low	72.8	Confident	150 Å²	150	73.4 Å²	73.4	80%	0.802	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	2.6	-177.4	-41.1	-25.9	0	0	0	117.1	R311	R311-N313 PolarHBondContact O-N 2.84Å
314	E	62.7	Low	72.2	Confident	80 Å²	80	76.6 Å²	76.6	37%	0.374	40%	0.402	S	S	.	.	S	Bend	trans	-82.6	-19.5	176.3	-82.1	179.3	175.7	0	0	113.9	Y308 L310 R311	Y308-E314 PolarHBondContact OH-OE2 2.61Å; L310-E314 HydrophobicContact CD1-CB 4.36Å; R311-E314 HydrophobicContact CB-CG 4.09Å; R311-E314 WeakPolarHBondContact CD-OE1 3.46Å; R311-E314 PolarHBondContact N-OE2 3.21Å; R311-E314 IonicContact NH1-OE1 3.36Å; R311-E314 PolarHBondContact O-N 3.08Å; R311-E314 VanDerWaalsContact O-N 3.15Å
315	E	53.7	Low	71.8	Confident	73 Å²	73	82.7 Å²	82.7	34%	0.341	43%	0.426	S	S	.	.	S	Bend	trans	-141.7	110.8	-180	-71.5	175.6	-175.4	0	0	109.3	L310 K346 V348	L310-E315 HydrophobicContact CD1-CB 4.36Å; L310-E315 HydrophobicContact CD1-CG 4.03Å; E315-K346 WeakPolarHBondContact OE1-CE 3.35Å; E315-K346 IonicContact OE1-NZ 3.6Å; E315-K346 PolarHBondContact OE1-NZ 3.19Å; E315-V348 VanDerWaalsContact OE1-CG2 3.23Å; E315-V348 WeakPolarHBondContact OE1-CG2 3.32Å
316	S	45.9	Very low	71.6	Confident	80 Å²	80	84.6 Å²	84.6	56%	0.559	44%	0.435	S	S	*	.			trans	75.7	120.4	178.9	61.6	0	0	0	0	118.1	E318	S316-E318 PolarHBondContact O-N 2.83Å
317	E	45.8	Very low	71.5	Confident	199 Å²	199	84.4 Å²	84.4	93%	0.93	43%	0.434	S	S	*	.	S	Bend	trans	-71.5	-6.2	168.3	-68.4	-175.3	148.5	0	0	112.9
318	E	45.9	Very low	71.5	Confident	162 Å²	162	83 Å²	83	76%	0.757	43%	0.426	S	S	*	.	S	Bend	trans	-102.3	101.3	174.4	-79.7	-173.3	142.4	0	0	111.1	S316	S316-E318 PolarHBondContact O-N 2.83Å
319	N	46.7	Very low	71.5	Confident	140 Å²	140	82.6 Å²	82.6	75%	0.749	43%	0.425	S	S	*	.	S	Bend	trans	96.5	131.3	174.9	-54.6	-59.7	0	0	0	115.3	V321	N319-V321 VanDerWaalsContact C-N 3.27Å; N319-V321 PolarHBondContact O-N 3.09Å
320	S	44.5	Very low	71.8	Confident	122 Å²	122	81.3 Å²	81.3	85%	0.853	42%	0.416	S	S	*	.			trans	-61.8	80.1	173.1	53.4	0	0	0	0	111.5	Q322	S320-Q322 PolarHBondContact O-N 3.04Å
321	V	57.1	Low	72.2	Confident	55 Å²	55	80.4 Å²	80.4	33%	0.333	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-74.2	118.3	172.5	-178	0	0	0	0	108	X312 N319	A312-V321 WeakPolarHBondContact CA-O 3.38Å; A312-V321 VanDerWaalsContact CB-O 3.25Å; A312-V321 WeakPolarHBondContact CB-O 3.3Å; N319-V321 VanDerWaalsContact C-N 3.27Å; N319-V321 PolarHBondContact O-N 3.09Å
322	Q	67.9	Low	72.9	Confident	167 Å²	167	73.4 Å²	73.4	78%	0.78	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-65.7	142.6	173.5	-177.3	173.9	-12	0	0	109.3	S320 E324	S320-Q322 PolarHBondContact O-N 3.04Å; Q322-E324 PolarHBondContact O-N 2.84Å
323	S	79.9	Confident	74.2	Confident	39 Å²	39	72.4 Å²	72.4	27%	0.273	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-55.7	132.8	175.8	-53.8	0	0	0	0	111.4	L310 X312	L310-S323 CarbonylContact O-C 3.27Å; L310-S323 VanDerWaalsContact O-CA 3.24Å; L310-S323 WeakPolarHBondContact O-CA 3.48Å; L310-S323 WeakPolarHBondContact O-CB 3.31Å; A312-S323 PolarHBondContact N-OG 3.31Å; A312-S323 VanDerWaalsContact N-OG 3.1Å
324	E	85.3	Confident	75.7	Confident	67 Å²	67	66.1 Å²	66.1	31%	0.313	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-112.7	126.7	177.3	-60.6	-167.1	169.1	0	0	110.3	S309 L310 Q322 V327 E352	S309-E324 CarbonylContact C-O 3.53Å; S309-E324 WeakPolarHBondContact CA-O 3.33Å; L310-E324 HydrophobicContact CB-CB 4.45Å; L310-E324 PolarHBondContact N-O 3.01Å; L310-E324 PolarHBondContact O-N 3.13Å; Q322-E324 PolarHBondContact O-N 2.84Å; E324-V327 HydrophobicContact CB-CG1 3.38Å; E324-V327 HydrophobicContact CG-CG1 4.47Å; E324-V327 WeakPolarHBondContact OE2-CG1 3.36Å; E324-E352 HydrophobicContact CB-CG 4.42Å
325	Y	89.6	Confident	77.1	Confident	129 Å²	129	62.5 Å²	62.5	51%	0.506	32%	0.321	S	S	.	.	S	Bend	trans	-91.9	144.9	-175.9	-57.6	-81.6	0	0	0	112.7	V327 E352 W353	Y325-V327 PolarHBondContact O-N 2.89Å; Y325-E352 WeakPolarHBondContact CD2-OE1 3.43Å; Y325-E352 WeakPolarHBondContact O-CG 3.44Å; Y325-W353 PolarHBondContact O-N 2.73Å
326	E	91.9	Very high	79	Confident	40 Å²	40	60.9 Å²	60.9	19%	0.187	32%	0.315	C	S	.	.	S	Bend	trans	47.4	37.5	177.5	-63.1	-167.6	-167.9	0	0	113.9	L307 Y308 S309 G328 W353 S354 R355	L307-E326 HydrophobicContact CD2-CG 4.29Å; Y308-E326 CarbonylContact O-C 3.59Å; Y308-E326 WeakPolarHBondContact O-CA 3.33Å; S309-E326 PolarHBondContact OG-N 3.46Å; S309-E326 VanDerWaalsContact OG-N 3.08Å; E326-G328 PolarHBondContact O-N 2.8Å; E326-W353 HydrophobicContact CB-CD2 4.38Å; E326-W353 HydrophobicContact CB-CE3 3.77Å; E326-W353 HydrophobicContact CB-CZ3 4.12Å; E326-W353 VanDerWaalsContact CD-CE3 3.44Å; E326-W353 HydrophobicContact CG-CE3 3.83Å; E326-W353 HydrophobicContact CG-CH2 4.48Å; E326-W353 HydrophobicContact CG-CZ3 3.67Å; E326-W353 CarbonylContact O-C 3.58Å; E326-W353 WeakPolarHBondContact O-CA 3.43Å; E326-W353 PolarHBondContact O-N 2.84Å; E326-W353 WeakPolarHBondContact OE1-CZ3 3.21Å; E326-S354 PolarHBondContact O-N 3.5Å; E326-R355 PolarHBondContact O-N 2.93Å; E326-R355 IonicContact OE1-NH2 3.81Å; E326-R355 IonicContact OE2-CZ 3.85Å; E326-R355 IonicContact OE2-NE 3.9Å; E326-R355 PolarHBondContact OE2-NE 2.86Å; E326-R355 IonicContact OE2-NH2 3.5Å; E326-R355 PolarHBondContact OE2-NH2 2.91Å
327	V	94.2	Very high	81.1	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	33%	0.325	C	S	.	.			trans	-65.1	-32	172.3	-63.9	0	0	0	0	110.7	Y308 L310 E324 Y325 V348 S354 F356	Y308-V327 HydrophobicContact CD1-CG2 3.95Å; Y308-V327 WeakPolarHBondContact O-CG2 3.3Å; Y308-V327 PolarHBondContact O-N 3.34Å; L310-V327 HydrophobicContact CB-CG2 4.11Å; E324-V327 HydrophobicContact CB-CG1 3.38Å; E324-V327 HydrophobicContact CG-CG1 4.47Å; E324-V327 WeakPolarHBondContact OE2-CG1 3.36Å; Y325-V327 PolarHBondContact O-N 2.89Å; V327-V348 HydrophobicContact CG2-CG1 3.78Å; V327-S354 PolarHBondContact O-OG 3.35Å; V327-F356 VanDerWaalsContact O-CB 3.23Å; V327-F356 WeakPolarHBondContact O-CB 3.49Å; V327-F356 PolarHBondContact O-N 3.38Å
328	G	95.8	Very high	83.2	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	79.7	158.9	-175.6	0	0	0	0	0	112.9	A305 Y308 E326 G349 F356	A305-G328 WeakPolarHBondContact O-CA 3.43Å; Y308-G328 PolarHBondContact O-N 3.33Å; E326-G328 PolarHBondContact O-N 2.8Å; G328-G349 PolarHBondContact O-N 2.83Å; G328-F356 CarbonylContact C-O 3.53Å; G328-F356 WeakPolarHBondContact CA-O 3.43Å
329	A	96.7	Very high	85.2	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	157.1	177.7	0	0	0	0	0	111.3	A305 Y308 Y331 L347 F356	A305-A329 HydrophobicContact CB-CB 4.49Å; A305-A329 PolarHBondContact N-O 2.88Å; A305-A329 PolarHBondContact O-N 2.87Å; Y308-A329 HydrophobicContact CD1-CB 3.92Å; Y308-A329 HydrophobicContact CD2-CB 4.19Å; Y308-A329 HydrophobicContact CG-CB 3.69Å; A329-Y331 HydrophobicContact CB-CE2 3.91Å; A329-L347 CarbonylContact C-O 3.55Å; A329-L347 WeakPolarHBondContact CA-O 3.17Å; A329-F356 PolarHBondContact N-O 2.54Å
330	V	97.7	Very high	87.3	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	133.7	169.5	174.2	0	0	0	0	108.8	I302 I303 V332 L347 F356 V360 F374 V376	I302-V330 HydrophobicContact CG2-CG1 3.58Å; I303-V330 CarbonylContact O-C 3.44Å; I303-V330 WeakPolarHBondContact O-CA 3.41Å; V330-V332 HydrophobicContact CG1-CG2 4.45Å; V330-L347 HydrophobicContact CB-CB 4.41Å; V330-L347 PolarHBondContact N-O 2.92Å; V330-L347 PolarHBondContact O-N 3.05Å; V330-F356 HydrophobicContact CB-CE1 4Å; V330-F356 HydrophobicContact CG2-CD1 4.07Å; V330-F356 HydrophobicContact CG2-CE1 3.62Å; V330-F356 HydrophobicContact CG2-CZ 4.33Å; V330-V360 HydrophobicContact CG1-CG1 4.31Å; V330-V360 HydrophobicContact CG2-CG1 3.9Å; V330-F374 HydrophobicContact CG1-CE2 4.29Å; V330-V376 HydrophobicContact CG2-CB 4.48Å; V330-V376 HydrophobicContact CG2-CG1 3.63Å; V330-V376 HydrophobicContact CG2-CG2 3.98Å
331	Y	97.5	Very high	89.6	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	132.4	176.3	-63	-103.9	0	0	0	109.1	F284 I302 I303 A305 Y308 A329 Y333 T345 K346	F284-Y331 AromaticContact CD2-CD2 3.68Å; F284-Y331 HydrophobicContact CD2-CD2 3.68Å; F284-Y331 AromaticContact CD2-CE2 3.9Å; F284-Y331 HydrophobicContact CD2-CE2 3.9Å; F284-Y331 HydrophobicContact CD2-CG 4.27Å; F284-Y331 HydrophobicContact CE2-CD1 4.4Å; F284-Y331 AromaticContact CE2-CD2 3.68Å; F284-Y331 HydrophobicContact CE2-CD2 3.68Å; F284-Y331 HydrophobicContact CE2-CE2 4.24Å; F284-Y331 AromaticContact CE2-CG 3.79Å; F284-Y331 HydrophobicContact CE2-CG 3.79Å; I302-Y331 CarbonylContact C-O 3.55Å; I302-Y331 WeakPolarHBondContact CA-O 3.01Å; I303-Y331 PolarHBondContact N-O 2.64Å; I303-Y331 PolarHBondContact O-N 2.86Å; A305-Y331 HydrophobicContact CB-CD2 4.38Å; A305-Y331 HydrophobicContact CB-CE2 3.97Å; Y308-Y331 WeakPolarHBondContact CE2-OH 3.4Å; A329-Y331 HydrophobicContact CB-CE2 3.91Å; Y331-Y333 HydrophobicContact CD1-CE2 4.49Å; Y331-Y333 HydrophobicContact CG-CE2 4.37Å; Y331-T345 CarbonylContact C-O 3.6Å; Y331-T345 WeakPolarHBondContact CA-O 3.13Å; Y331-K346 HydrophobicContact CD1-CB 4.11Å; Y331-K346 HydrophobicContact CD1-CG 4.13Å; Y331-K346 HydrophobicContact CE1-CB 3.99Å; Y331-K346 HydrophobicContact CE1-CD 3.9Å; Y331-K346 HydrophobicContact CE1-CG 3.65Å; Y331-K346 HydrophobicContact CE2-CG 4.46Å
332	V	97.4	Very high	91.2	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	112.1	176.3	-177.4	0	0	0	0	107.9	L293 L301 I302 V330 F334 H344 T345 F374 V399	L293-V332 HydrophobicContact CD1-CG1 3.56Å; L301-V332 WeakPolarHBondContact O-CA 3.31Å; I302-V332 HydrophobicContact CG2-CG2 4.47Å; V330-V332 HydrophobicContact CG1-CG2 4.45Å; V332-F334 HydrophobicContact CB-CE2 4.46Å; V332-F334 HydrophobicContact CB-CZ 4.44Å; V332-F334 HydrophobicContact CG1-CE1 4.03Å; V332-F334 HydrophobicContact CG1-CE2 3.96Å; V332-F334 HydrophobicContact CG1-CZ 3.61Å; V332-H344 CarbonylContact O-C 3.53Å; V332-H344 WeakPolarHBondContact O-CA 3.44Å; V332-H344 WeakPolarHBondContact O-CB 3.47Å; V332-T345 PolarHBondContact N-O 3.24Å; V332-T345 PolarHBondContact O-N 3.03Å; V332-F374 HydrophobicContact CG2-CZ 4.14Å; V332-V399 HydrophobicContact CB-CG2 4.46Å; V332-V399 HydrophobicContact CG1-CG2 4.04Å; V332-V399 HydrophobicContact CG2-CG2 4.2Å
333	Y	96.7	Very high	92.3	Very high	17 Å²	17	54.3 Å²	54.3	7%	0.067	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	121	180	-78	-97.8	0	0	0	109.7	I275 F284 L301 I303 Y331 F341 H344	I275-Y333 HydrophobicContact CD1-CD1 4.46Å; I275-Y333 HydrophobicContact CD1-CG 4.44Å; I275-Y333 HydrophobicContact CG2-CD1 4.3Å; I275-Y333 HydrophobicContact CG2-CD2 4.49Å; I275-Y333 HydrophobicContact CG2-CE1 3.72Å; I275-Y333 HydrophobicContact CG2-CE2 3.94Å; F284-Y333 HydrophobicContact CE2-CE2 4.14Å; F284-Y333 AromaticContact CZ-CE2 3.96Å; F284-Y333 HydrophobicContact CZ-CE2 3.96Å; L301-Y333 PolarHBondContact N-O 2.77Å; L301-Y333 PolarHBondContact O-N 3.47Å; I303-Y333 HydrophobicContact CD1-CD2 3.67Å; I303-Y333 HydrophobicContact CD1-CE2 3.79Å; I303-Y333 HydrophobicContact CG1-CD2 4.43Å; Y331-Y333 HydrophobicContact CD1-CE2 4.49Å; Y331-Y333 HydrophobicContact CG-CE2 4.37Å; Y333-F341 HydrophobicContact CD1-CB 4.04Å; Y333-H344 HydrophobicContact CD1-CB 3.7Å; Y333-H344 HydrophobicContact CD2-CB 4.18Å; Y333-H344 HydrophobicContact CE1-CB 3.78Å; Y333-H344 AromaticContact CE1-CG 3.97Å; Y333-H344 HydrophobicContact CE2-CB 4.25Å; Y333-H344 HydrophobicContact CG-CB 3.91Å
334	F	95.9	Very high	93	Very high	18 Å²	18	56.1 Å²	56.1	8%	0.079	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	126.8	-177.7	-64.9	-80.5	0	0	0	111.4	L293 N294 D300 V332 F341 R343 V399	L293-F334 HydrophobicContact CB-CE1 4.31Å; N294-F334 HydrophobicContact CB-CD1 4.43Å; N294-F334 HydrophobicContact CB-CE1 4.37Å; D300-F334 HydrophobicContact CB-CD1 4.3Å; D300-F334 VanDerWaalsContact CG-CD1 3.46Å; D300-F334 VanDerWaalsContact OD1-CA 3.23Å; D300-F334 WeakPolarHBondContact OD1-CA 3.39Å; D300-F334 WeakPolarHBondContact OD1-CD1 3.17Å; D300-F334 VanDerWaalsContact OD2-CD1 3.26Å; D300-F334 WeakPolarHBondContact OD2-CD1 3.25Å; V332-F334 HydrophobicContact CB-CE2 4.46Å; V332-F334 HydrophobicContact CB-CZ 4.44Å; V332-F334 HydrophobicContact CG1-CE1 4.03Å; V332-F334 HydrophobicContact CG1-CE2 3.96Å; V332-F334 HydrophobicContact CG1-CZ 3.61Å; F334-F341 WeakPolarHBondContact O-CA 3.44Å; F334-R343 PolarHBondContact N-O 3.08Å; F334-V399 HydrophobicContact CZ-CG2 4.17Å
335	Q	93.8	Very high	93.5	Very high	5 Å²	5	54.2 Å²	54.2	2%	0.023	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-75.7	146.8	176.9	-163.2	-176.9	19.1	0	0	109.9	N233 F234 L298 D299 D300 H339 K340 F341	N233-Q335 PolarHBondContact O-NE2 3.48Å; N233-Q335 PolarHBondContact O-OE1 2.87Å; F234-Q335 VanDerWaalsContact C-NE2 3.34Å; F234-Q335 PolarHBondContact O-NE2 3.27Å; L298-Q335 HydrophobicContact CB-CB 4.05Å; L298-Q335 HydrophobicContact CB-CG 4.39Å; D299-Q335 VanDerWaalsContact N-OE1 3.1Å; D299-Q335 WeakPolarHBondContact O-CB 3.45Å; D299-Q335 PolarHBondContact O-OE1 3.35Å; D300-Q335 PolarHBondContact OD1-N 2.85Å; D300-Q335 VanDerWaalsContact OD1-N 3.08Å; Q335-H339 PolarHBondContact NE2-ND1 3.48Å; Q335-K340 CarbonylContact C-O 3.41Å; Q335-K340 WeakPolarHBondContact CA-O 3.18Å; Q335-F341 HydrophobicContact CB-CD1 4.21Å; Q335-F341 HydrophobicContact CB-CE1 3.71Å; Q335-F341 HydrophobicContact CB-CZ 4.1Å; Q335-F341 HydrophobicContact CG-CE1 4.14Å; Q335-F341 HydrophobicContact CG-CZ 4.03Å
336	N	92.5	Very high	93.7	Very high	39 Å²	39	50.7 Å²	50.7	21%	0.209	23%	0.233	C	C	.	.			trans	-111.8	172	171	73.7	10.9	0	0	0	111.4	L298 Q338 H339 K340 P342	L298-N336 WeakPolarHBondContact CD1-O 3.5Å; N336-Q338 PolarHBondContact ND2-OE1 3.34Å; N336-Q338 PolarHBondContact O-N 3.49Å; N336-Q338 WeakPolarHBondContact OD1-CA 3.36Å; N336-Q338 WeakPolarHBondContact OD1-CB 3.44Å; N336-Q338 PolarHBondContact OD1-N 3.42Å; N336-Q338 PolarHBondContact OD1-OE1 2.77Å; N336-H339 WeakPolarHBondContact O-CA 3.25Å; N336-H339 PolarHBondContact O-N 3.34Å; N336-H339 PolarHBondContact OD1-N 3.33Å; N336-K340 PolarHBondContact N-O 2.82Å; N336-K340 PolarHBondContact OD1-N 2.71Å; N336-K340 PolarHBondContact OD1-O 2.95Å; N336-P342 HydrophobicContact CB-CG 4.33Å
337	K	91.1	Very high	93.9	Very high	177 Å²	177	49 Å²	49	77%	0.77	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-15	178.9	-64.4	-177.3	179.8	177.9	0	114.8	L298 H339	L298-K337 HydrophobicContact CD1-CG 4.38Å; K337-H339 VanDerWaalsContact C-N 3.29Å
338	Q	89.5	Confident	93.8	Very high	132 Å²	132	49.9 Å²	49.9	62%	0.617	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.7	9.6	172.5	-63.5	78.9	25.3	0	0	112.2	N336 K340	N336-Q338 PolarHBondContact ND2-OE1 3.34Å; N336-Q338 PolarHBondContact O-N 3.49Å; N336-Q338 WeakPolarHBondContact OD1-CA 3.36Å; N336-Q338 WeakPolarHBondContact OD1-CB 3.44Å; N336-Q338 PolarHBondContact OD1-N 3.42Å; N336-Q338 PolarHBondContact OD1-OE1 2.77Å; Q338-K340 PolarHBondContact O-N 3.1Å
339	H	87.8	Confident	93.6	Very high	53 Å²	53	50.1 Å²	50.1	25%	0.245	23%	0.233	C	C	.	.	S	Bend	trans	60.6	33.6	179.9	-63.4	-59.6	0	0	0	113.4	F234 R235 G236 Q335 N336 K337	F234-H339 VanDerWaalsContact O-CB 3.25Å; F234-H339 WeakPolarHBondContact O-CB 3.41Å; R235-H339 PolarHBondContact O-CD2 2.71Å; R235-H339 PolarHBondContact O-NE2 3.27Å; G236-H339 WeakPolarHBondContact CA-CE1 3.4Å; G236-H339 PolarHBondContact N-CE1 2.9Å; G236-H339 PolarHBondContact N-ND1 3.16Å; Q335-H339 PolarHBondContact NE2-ND1 3.48Å; N336-H339 WeakPolarHBondContact O-CA 3.25Å; N336-H339 PolarHBondContact O-N 3.34Å; N336-H339 PolarHBondContact OD1-N 3.33Å; K337-H339 VanDerWaalsContact C-N 3.29Å
340	K	90.4	Very high	93.1	Very high	137 Å²	137	54.8 Å²	54.8	60%	0.596	26%	0.255	S	S	*	.			trans	-116.1	163.7	174.9	-63	-174.5	178.7	-175.2	0	110.3	Q335 N336 Q338 P342	Q335-K340 CarbonylContact C-O 3.41Å; Q335-K340 WeakPolarHBondContact CA-O 3.18Å; N336-K340 PolarHBondContact N-O 2.82Å; N336-K340 PolarHBondContact OD1-N 2.71Å; N336-K340 PolarHBondContact OD1-O 2.95Å; Q338-K340 PolarHBondContact O-N 3.1Å; K340-P342 VanDerWaalsContact C-CD 3.41Å; K340-P342 WeakPolarHBondContact O-CD 3.37Å
341	F	92.4	Very high	92.7	Very high	26 Å²	26	58.1 Å²	58.1	11%	0.114	27%	0.269	C	S	.	.			trans	-115.8	71.4	-178.8	-62.7	-90	0	0	0	111.9	F234 L264 I275 L301 Y333 F334 Q335	F234-F341 HydrophobicContact CD1-CE2 4.49Å; F234-F341 AromaticContact CD1-CZ 3.78Å; F234-F341 HydrophobicContact CD1-CZ 3.78Å; F234-F341 HydrophobicContact CE1-CZ 4.18Å; L264-F341 HydrophobicContact CD1-CD2 4.33Å; L264-F341 HydrophobicContact CD1-CE2 3.44Å; L264-F341 VanDerWaalsContact CD1-CE2 3.44Å; L264-F341 HydrophobicContact CD1-CZ 3.98Å; I275-F341 HydrophobicContact CD1-CD2 4.33Å; I275-F341 HydrophobicContact CD1-CG 4.42Å; L301-F341 HydrophobicContact CB-CE1 4.17Å; Y333-F341 HydrophobicContact CD1-CB 4.04Å; F334-F341 WeakPolarHBondContact O-CA 3.44Å; Q335-F341 HydrophobicContact CB-CD1 4.21Å; Q335-F341 HydrophobicContact CB-CE1 3.71Å; Q335-F341 HydrophobicContact CB-CZ 4.1Å; Q335-F341 HydrophobicContact CG-CE1 4.14Å; Q335-F341 HydrophobicContact CG-CZ 4.03Å
342	P	90.1	Very high	92.3	Very high	87 Å²	87	61.7 Å²	61.7	57%	0.565	29%	0.286	S	S	*	.			trans	-77.2	-20.8	-173.6	32.5	-37.9	0	0	0	114.2	N336 K340	N336-P342 HydrophobicContact CB-CG 4.33Å; K340-P342 VanDerWaalsContact C-CD 3.41Å; K340-P342 WeakPolarHBondContact O-CD 3.37Å
343	R	92.9	Very high	92.1	Very high	174 Å²	174	66.6 Å²	66.6	66%	0.657	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.3	140.5	-175.7	-67.7	179.3	67.8	-161.9	-3.9	109.7	F334	F334-R343 PolarHBondContact N-O 3.08Å
344	H	94	Very high	92	Very high	78 Å²	78	65.9 Å²	65.9	36%	0.361	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	156.2	172.6	67.3	-84.3	0	0	0	111.5	Q278 V332 Y333	Q278-H344 PolarHBondContact NE2-NE2 2.98Å; Q278-H344 VanDerWaalsContact NE2-NE2 3.1Å; V332-H344 CarbonylContact O-C 3.53Å; V332-H344 WeakPolarHBondContact O-CA 3.44Å; V332-H344 WeakPolarHBondContact O-CB 3.47Å; Y333-H344 HydrophobicContact CD1-CB 3.7Å; Y333-H344 HydrophobicContact CD2-CB 4.18Å; Y333-H344 HydrophobicContact CE1-CB 3.78Å; Y333-H344 AromaticContact CE1-CG 3.97Å; Y333-H344 HydrophobicContact CE2-CB 4.25Å; Y333-H344 HydrophobicContact CG-CB 3.91Å
345	T	95	Very high	92	Very high	26 Å²	26	67.1 Å²	67.1	16%	0.16	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	135.3	171.3	-60.9	0	0	0	0	108.6	Y331 V332 L347 E401	Y331-T345 CarbonylContact C-O 3.6Å; Y331-T345 WeakPolarHBondContact CA-O 3.13Å; V332-T345 PolarHBondContact N-O 3.24Å; V332-T345 PolarHBondContact O-N 3.03Å; T345-L347 HydrophobicContact CG2-CD2 4.07Å; T345-E401 HydrophobicContact CG2-CG 3.86Å
346	K	94.9	Very high	92.2	Very high	55 Å²	55	66.9 Å²	66.9	24%	0.239	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.5	176.2	-177.9	-169.7	68.8	162	0	109	Y308 E315 Y331 V348	Y308-K346 PolarHBondContact OH-NZ 2.96Å; E315-K346 WeakPolarHBondContact OE1-CE 3.35Å; E315-K346 IonicContact OE1-NZ 3.6Å; E315-K346 PolarHBondContact OE1-NZ 3.19Å; Y331-K346 HydrophobicContact CD1-CB 4.11Å; Y331-K346 HydrophobicContact CD1-CG 4.13Å; Y331-K346 HydrophobicContact CE1-CB 3.99Å; Y331-K346 HydrophobicContact CE1-CD 3.9Å; Y331-K346 HydrophobicContact CE1-CG 3.65Å; Y331-K346 HydrophobicContact CE2-CG 4.46Å; K346-V348 HydrophobicContact CD-CG2 4Å; K346-V348 HydrophobicContact CG-CG2 4.1Å
347	L	95.3	Very high	92.4	Very high	5 Å²	5	65 Å²	65	3%	0.026	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	118.1	174.5	-54.9	175.7	0	0	0	108.3	A329 V330 T345 F356 F374 Y392 V399 E401	A329-L347 CarbonylContact C-O 3.55Å; A329-L347 WeakPolarHBondContact CA-O 3.17Å; V330-L347 HydrophobicContact CB-CB 4.41Å; V330-L347 PolarHBondContact N-O 2.92Å; V330-L347 PolarHBondContact O-N 3.05Å; T345-L347 HydrophobicContact CG2-CD2 4.07Å; L347-F356 HydrophobicContact CB-CE1 4.21Å; L347-F374 HydrophobicContact CD1-CE2 4.27Å; L347-F374 HydrophobicContact CD1-CZ 3.68Å; L347-Y392 HydrophobicContact CD1-CD1 3.8Å; L347-Y392 HydrophobicContact CD1-CD2 4.47Å; L347-Y392 HydrophobicContact CD1-CE1 3.76Å; L347-Y392 HydrophobicContact CD1-CE2 4.42Å; L347-Y392 HydrophobicContact CD1-CG 4.17Å; L347-Y392 HydrophobicContact CD2-CE1 4.19Å; L347-Y392 HydrophobicContact CG-CE1 4.45Å; L347-V399 HydrophobicContact CD1-CG1 4.27Å; L347-E401 HydrophobicContact CD2-CB 4.13Å; L347-E401 HydrophobicContact CD2-CG 4.12Å
348	V	93.3	Very high	92.6	Very high	19 Å²	19	56.9 Å²	56.9	12%	0.115	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	138.1	-178	-177.4	0	0	0	0	110.3	Y308 E315 V327 K346	Y308-V348 HydrophobicContact CD1-CG1 4.4Å; Y308-V348 HydrophobicContact CE1-CG1 4.2Å; Y308-V348 HydrophobicContact CE1-CG2 4.23Å; E315-V348 VanDerWaalsContact OE1-CG2 3.23Å; E315-V348 WeakPolarHBondContact OE1-CG2 3.32Å; V327-V348 HydrophobicContact CG2-CG1 3.78Å; K346-V348 HydrophobicContact CD-CG2 4Å; K346-V348 HydrophobicContact CG-CG2 4.1Å
349	G	91.7	Very high	92.8	Very high	5 Å²	5	51.3 Å²	51.3	5%	0.052	23%	0.234	C	C	.	.			trans	-63.1	148.4	176.2	0	0	0	0	0	112.2	G328	G328-G349 PolarHBondContact O-N 2.83Å
350	H	86	Confident	93.1	Very high	98 Å²	98	49.1 Å²	49.1	45%	0.454	22%	0.224	S	C	.	.	S	Bend	trans	-89.6	-1.8	-170.9	-54.9	-61.9	0	0	0	114.7	Y390 F403	H350-Y390 AromaticContact CD2-CE1 3.69Å; H350-F403 AromaticContact CD2-CE1 3.89Å; H350-F403 AromaticContact NE2-CD1 3.39Å; H350-F403 WeakPolarHBondContact NE2-CD1 3.22Å; H350-F403 AromaticContact NE2-CE1 3.44Å; H350-F403 WeakPolarHBondContact NE2-CE1 3.16Å
351	K	89	Confident	93.2	Very high	70 Å²	70	43 Å²	43	30%	0.304	20%	0.199	S	C	.	.	S	Bend	trans	-150.3	135.9	-172.7	-170	177	-174.9	172.5	0	112.5	S354 D381 G382	K351-S354 WeakPolarHBondContact O-CB 3.44Å; K351-S354 PolarHBondContact O-N 2.94Å; K351-S354 PolarHBondContact O-OG 2.8Å; K351-D381 VanDerWaalsContact CD-OD1 3.31Å; K351-D381 WeakPolarHBondContact CD-OD1 3.22Å; K351-G382 PolarHBondContact NZ-O 2.74Å
352	E	89.6	Confident	93	Very high	75 Å²	75	43.2 Å²	43.2	35%	0.35	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	136.5	172.6	-152.3	-166.7	175.9	0	0	112.6	E324 Y325 S354	E324-E352 HydrophobicContact CB-CG 4.42Å; Y325-E352 WeakPolarHBondContact CD2-OE1 3.43Å; Y325-E352 WeakPolarHBondContact O-CG 3.44Å; E352-S354 PolarHBondContact O-N 2.84Å; E352-S354 VanDerWaalsContact O-N 3.14Å
353	W	93	Very high	92.5	Very high	103 Å²	103	39 Å²	39	39%	0.39	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	10.6	-179	-47.8	95.1	0	0	0	115.8	Y325 E326 R355 F380	Y325-W353 PolarHBondContact O-N 2.73Å; E326-W353 HydrophobicContact CB-CD2 4.38Å; E326-W353 HydrophobicContact CB-CE3 3.77Å; E326-W353 HydrophobicContact CB-CZ3 4.12Å; E326-W353 VanDerWaalsContact CD-CE3 3.44Å; E326-W353 HydrophobicContact CG-CE3 3.83Å; E326-W353 HydrophobicContact CG-CH2 4.48Å; E326-W353 HydrophobicContact CG-CZ3 3.67Å; E326-W353 CarbonylContact O-C 3.58Å; E326-W353 WeakPolarHBondContact O-CA 3.43Å; E326-W353 PolarHBondContact O-N 2.84Å; E326-W353 WeakPolarHBondContact OE1-CZ3 3.21Å; W353-R355 VanDerWaalsContact C-N 3.26Å; W353-R355 PolarHBondContact O-N 3.32Å; W353-F380 VanDerWaalsContact O-CB 3.27Å; W353-F380 WeakPolarHBondContact O-CB 3.35Å
354	S	94.3	Very high	91.8	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.007	15%	0.145	C	C	.	.			trans	-69.7	-27	179.9	64.3	0	0	0	0	112.7	E326 V327 K351 E352 F356 A378 F380	E326-S354 PolarHBondContact O-N 3.5Å; V327-S354 PolarHBondContact O-OG 3.35Å; K351-S354 WeakPolarHBondContact O-CB 3.44Å; K351-S354 PolarHBondContact O-N 2.94Å; K351-S354 PolarHBondContact O-OG 2.8Å; E352-S354 PolarHBondContact O-N 2.84Å; E352-S354 VanDerWaalsContact O-N 3.14Å; S354-F356 VanDerWaalsContact C-N 3.31Å; S354-F356 PolarHBondContact OG-N 3.06Å; S354-A378 CarbonylContact O-C 3.55Å; S354-F380 PolarHBondContact O-N 3.34Å
355	R	95.6	Very high	91	Very high	44 Å²	44	27.2 Å²	27.2	17%	0.166	13%	0.129	C	C	.	.			trans	54.5	45.5	-172.5	-59.8	-169.3	178.2	177.8	-5.6	112.7	M1 P306 L307 E326 W353 G357 H358 F380	M1-R355 PolarHBondContact SD-NH1 3.46Å; M1-R355 VanDerWaalsContact SD-NH1 3.38Å; P306-R355 HydrophobicContact CB-CB 4.08Å; P306-R355 WeakPolarHBondContact O-CA 3.25Å; L307-R355 HydrophobicContact CD2-CG 4.48Å; E326-R355 PolarHBondContact O-N 2.93Å; E326-R355 IonicContact OE1-NH2 3.81Å; E326-R355 IonicContact OE2-CZ 3.85Å; E326-R355 IonicContact OE2-NE 3.9Å; E326-R355 PolarHBondContact OE2-NE 2.86Å; E326-R355 IonicContact OE2-NH2 3.5Å; E326-R355 PolarHBondContact OE2-NH2 2.91Å; W353-R355 VanDerWaalsContact C-N 3.26Å; W353-R355 PolarHBondContact O-N 3.32Å; R355-G357 PolarHBondContact O-N 3.1Å; R355-H358 WeakPolarHBondContact O-CB 3.5Å; R355-H358 PolarHBondContact O-N 3.39Å; R355-H358 VanDerWaalsContact O-N 3.1Å; R355-F380 HydrophobicContact CB-CD2 4.21Å; R355-F380 HydrophobicContact CG-CD2 4.04Å
356	F	97.6	Very high	89.9	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.128	C	C	.	.	B	Isolated β-bridge	trans	-52.6	134.5	172.2	179.7	-92.8	0	0	0	111	P306 V327 G328 A329 V330 L347 S354 V376 A378 Y390 Y392	P306-F356 WeakPolarHBondContact CA-O 3.45Å; V327-F356 VanDerWaalsContact O-CB 3.23Å; V327-F356 WeakPolarHBondContact O-CB 3.49Å; V327-F356 PolarHBondContact O-N 3.38Å; G328-F356 CarbonylContact C-O 3.53Å; G328-F356 WeakPolarHBondContact CA-O 3.43Å; A329-F356 PolarHBondContact N-O 2.54Å; V330-F356 HydrophobicContact CB-CE1 4Å; V330-F356 HydrophobicContact CG2-CD1 4.07Å; V330-F356 HydrophobicContact CG2-CE1 3.62Å; V330-F356 HydrophobicContact CG2-CZ 4.33Å; L347-F356 HydrophobicContact CB-CE1 4.21Å; S354-F356 VanDerWaalsContact C-N 3.31Å; S354-F356 PolarHBondContact OG-N 3.06Å; F356-V376 HydrophobicContact CD1-CG1 4.1Å; F356-V376 HydrophobicContact CD2-CB 4.5Å; F356-V376 HydrophobicContact CD2-CG1 3.79Å; F356-V376 HydrophobicContact CE1-CG1 3.87Å; F356-V376 HydrophobicContact CE2-CB 3.83Å; F356-V376 HydrophobicContact CE2-CG1 3.53Å; F356-V376 HydrophobicContact CE2-CG2 4.41Å; F356-V376 HydrophobicContact CG-CG1 4.07Å; F356-V376 HydrophobicContact CZ-CB 3.9Å; F356-V376 HydrophobicContact CZ-CG1 3.57Å; F356-V376 HydrophobicContact CZ-CG2 4Å; F356-A378 HydrophobicContact CB-CB 4.39Å; F356-A378 HydrophobicContact CD2-CB 4.41Å; F356-Y390 AromaticContact CD2-CD2 3.84Å; F356-Y390 HydrophobicContact CD2-CD2 3.84Å; F356-Y390 HydrophobicContact CD2-CE2 4.09Å; F356-Y390 HydrophobicContact CD2-CG 4.43Å; F356-Y390 AromaticContact CE2-CD2 3.75Å; F356-Y390 HydrophobicContact CE2-CD2 3.75Å; F356-Y390 HydrophobicContact CE2-CE2 4.36Å; F356-Y390 AromaticContact CE2-CG 3.9Å; F356-Y390 HydrophobicContact CE2-CG 3.9Å; F356-Y392 HydrophobicContact CE2-CE2 4.09Å; F356-Y392 AromaticContact CZ-CE2 3.76Å; F356-Y392 HydrophobicContact CZ-CE2 3.76Å; F356-Y392 AromaticContact CZ-CZ 3.91Å; F356-Y392 WeakPolarHBondContact CZ-OH 3.48Å
357	G	96.3	Very high	88.8	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.7	18.7	-173	0	0	0	0	0	113.8	G304 R355 D359 V376 G377	G304-G357 WeakPolarHBondContact CA-O 3.36Å; R355-G357 PolarHBondContact O-N 3.1Å; G357-D359 VanDerWaalsContact C-N 3.27Å; G357-D359 PolarHBondContact O-N 2.9Å; G357-V376 VanDerWaalsContact N-CG1 3.28Å; G357-G377 PolarHBondContact N-O 3.34Å; G357-G377 VanDerWaalsContact N-O 3.08Å
358	H	95.5	Very high	87.5	Confident	7 Å²	7	25.8 Å²	25.8	3%	0.032	12%	0.123	C	C	.	.	S	Bend	trans	-61.1	-41	173.2	-169.2	84.8	0	0	0	111.9	P306 R355 G377 P379 W421	P306-H358 HydrophobicContact CB-CB 4.32Å; R355-H358 WeakPolarHBondContact O-CB 3.5Å; R355-H358 PolarHBondContact O-N 3.39Å; R355-H358 VanDerWaalsContact O-N 3.1Å; H358-G377 PolarHBondContact N-O 2.9Å; H358-P379 HydrophobicContact CB-CG 3.82Å; H358-W421 AromaticContact CD2-CE3 3.94Å; H358-W421 PolarHBondContact CD2-O 3.03Å; H358-W421 AromaticContact CE1-CE3 3.91Å; H358-W421 AromaticContact CE1-CH2 3.89Å; H358-W421 AromaticContact CE1-CZ3 3.62Å; H358-W421 AromaticContact NE2-CD2 3.52Å; H358-W421 AromaticContact NE2-CE2 3.68Å; H358-W421 AromaticContact NE2-CE3 3.45Å; H358-W421 AromaticContact NE2-CH2 3.85Å; H358-W421 AromaticContact NE2-CZ2 3.92Å; H358-W421 AromaticContact NE2-CZ3 3.59Å
359	D	94.6	Very high	86.5	Confident	15 Å²	15	27.5 Å²	27.5	8%	0.08	13%	0.132	C	C	.	.	S	Bend	trans	-140.2	152.6	169.3	-153.5	30.4	0	0	0	109.7	K2 G357 G377 S422 I423	K2-D359 WeakPolarHBondContact CE-OD1 3.3Å; K2-D359 IonicContact NZ-OD1 3.99Å; K2-D359 PolarHBondContact NZ-OD1 2.55Å; G357-D359 VanDerWaalsContact C-N 3.27Å; G357-D359 PolarHBondContact O-N 2.9Å; D359-G377 PolarHBondContact O-N 3.06Å; D359-S422 VanDerWaalsContact OD2-CA 3.28Å; D359-S422 WeakPolarHBondContact OD2-CA 3.19Å; D359-I423 PolarHBondContact OD2-N 3.23Å
360	V	94.3	Very high	85.8	Confident	6 Å²	6	28 Å²	28	4%	0.036	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	140.4	178.5	-66.8	0	0	0	0	108.3	A287 A289 I302 V330 I375 V376	A287-V360 HydrophobicContact CB-CG2 4Å; A289-V360 HydrophobicContact CB-CB 4.49Å; A289-V360 HydrophobicContact CB-CG2 3.9Å; I302-V360 HydrophobicContact CG2-CB 4.06Å; I302-V360 HydrophobicContact CG2-CG1 4.13Å; I302-V360 HydrophobicContact CG2-CG2 4.05Å; V330-V360 HydrophobicContact CG1-CG1 4.31Å; V330-V360 HydrophobicContact CG2-CG1 3.9Å; V360-I375 WeakPolarHBondContact CA-O 3.3Å; V360-V376 HydrophobicContact CG1-CG1 4.34Å; V360-V376 HydrophobicContact CG1-CG2 4.28Å
361	A	90.9	Very high	85.7	Confident	9 Å²	9	26.1 Å²	26.1	7%	0.074	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	151.8	176.9	0	0	0	0	0	109.9	F374 I375 I423	A361-F374 WeakPolarHBondContact O-CA 3.45Å; A361-F374 WeakPolarHBondContact O-CB 3.48Å; A361-I375 HydrophobicContact CB-CG2 3.95Å; A361-I375 PolarHBondContact N-O 3.01Å; A361-I375 VanDerWaalsContact N-O 3.08Å; A361-I375 WeakPolarHBondContact O-CG2 3.47Å; A361-I375 PolarHBondContact O-N 3.48Å; A361-I423 HydrophobicContact CB-CB 4.01Å; A361-I423 HydrophobicContact CB-CG2 3.87Å
362	T	88.4	Confident	85.6	Confident	30 Å²	30	24.1 Å²	24.1	18%	0.184	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	150.9	177.2	56.7	0	0	0	0	109.4	A289 D291 I302 G425 G426	A289-T362 HydrophobicContact CB-CG2 3.97Å; D291-T362 HydrophobicContact CB-CG2 3.44Å; D291-T362 VanDerWaalsContact CB-CG2 3.44Å; D291-T362 WeakPolarHBondContact OD2-CB 3.49Å; I302-T362 HydrophobicContact CD1-CG2 3.85Å; T362-G425 CarbonylContact O-C 3.25Å; T362-G425 WeakPolarHBondContact O-CA 3.38Å; T362-G426 PolarHBondContact O-N 2.92Å
363	T	79.5	Confident	85.6	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	1.7	-172.1	55.4	0	0	0	0	113.2	L366 D373 I375 A453 I455	T363-L366 HydrophobicContact CG2-CD1 4.25Å; T363-L366 VanDerWaalsContact OG1-CD1 3.27Å; T363-L366 WeakPolarHBondContact OG1-CD1 3.13Å; T363-L366 WeakPolarHBondContact OG1-CG 3.31Å; T363-D373 PolarHBondContact N-O 2.86Å; T363-D373 WeakPolarHBondContact OG1-CB 3.31Å; T363-D373 PolarHBondContact OG1-O 2.88Å; T363-I375 HydrophobicContact CG2-CB 4.07Å; T363-I375 HydrophobicContact CG2-CG2 3.78Å; T363-A453 WeakPolarHBondContact O-CB 3.43Å; T363-I455 HydrophobicContact CG2-CD1 3.85Å; T363-I455 HydrophobicContact CG2-CG1 3.88Å
364	G	78.1	Confident	85.6	Confident	2 Å²	2	15.6 Å²	15.6	2%	0.021	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	63.2	-165.3	-165.5	0	0	0	0	0	111.5	L366 D373 Q451	G364-L366 PolarHBondContact O-N 2.66Å; G364-D373 WeakPolarHBondContact O-CA 3.19Å; G364-D373 VanDerWaalsContact O-CB 3.29Å; G364-D373 WeakPolarHBondContact O-CB 3.15Å; G364-D373 PolarHBondContact O-N 2.96Å; G364-Q451 CarbonylContact C-O 3.6Å
365	D	77.7	Confident	85.5	Confident	2 Å²	2	15.6 Å²	15.6	1%	0.011	8%	0.083	C	C	.	.			trans	-81.4	88.9	-178.5	176.3	6.3	0	0	0	110.9	N367 G368 D369 G370 Y371 F450 Q451 L452	D365-N367 VanDerWaalsContact C-N 3.31Å; D365-N367 PolarHBondContact O-N 3.38Å; D365-N367 PolarHBondContact OD1-OD1 2.79Å; D365-N367 VanDerWaalsContact OD1-OD1 3.1Å; D365-G368 WeakPolarHBondContact OD1-CA 3.49Å; D365-G368 PolarHBondContact OD1-N 2.74Å; D365-G368 VanDerWaalsContact OD2-C 3.28Å; D365-G368 VanDerWaalsContact OD2-CA 3.25Å; D365-G368 WeakPolarHBondContact OD2-CA 3.32Å; D365-D369 PolarHBondContact OD1-N 3.47Å; D365-D369 PolarHBondContact OD2-N 3.07Å; D365-G370 VanDerWaalsContact OD2-CA 3.31Å; D365-G370 WeakPolarHBondContact OD2-CA 3.32Å; D365-G370 PolarHBondContact OD2-N 3.46Å; D365-Y371 WeakPolarHBondContact CA-O 3.23Å; D365-Y371 VanDerWaalsContact CB-O 3.28Å; D365-Y371 WeakPolarHBondContact CB-O 3.47Å; D365-F450 WeakPolarHBondContact OD2-CD1 3.38Å; D365-Q451 PolarHBondContact N-O 2.89Å; D365-L452 WeakPolarHBondContact O-CD2 3.39Å
366	L	72.9	Confident	85.6	Confident	27 Å²	27	13.5 Å²	13.5	14%	0.141	8%	0.075	C	C	.	.	S	Bend	trans	-69.1	-28.5	-174.7	-69.7	171.9	0	0	0	112.8	T363 G364 D373 I391 L452 I455	T363-L366 HydrophobicContact CG2-CD1 4.25Å; T363-L366 VanDerWaalsContact OG1-CD1 3.27Å; T363-L366 WeakPolarHBondContact OG1-CD1 3.13Å; T363-L366 WeakPolarHBondContact OG1-CG 3.31Å; G364-L366 PolarHBondContact O-N 2.66Å; L366-D373 VanDerWaalsContact CB-OD2 3.29Å; L366-D373 WeakPolarHBondContact CB-OD2 3.31Å; L366-D373 HydrophobicContact CD1-CB 4.17Å; L366-D373 HydrophobicContact CG-CB 4.27Å; L366-D373 PolarHBondContact N-OD2 3.22Å; L366-I391 HydrophobicContact CD1-CG2 3.66Å; L366-L452 WeakPolarHBondContact O-CD2 3.41Å; L366-I455 HydrophobicContact CD1-CD1 4.11Å; L366-I455 HydrophobicContact CD2-CD1 4.26Å
367	N	70.9	Confident	85.5	Confident	24 Å²	24	13.5 Å²	13.5	13%	0.128	8%	0.075	C	C	.	.	S	Bend	trans	-101.9	-9	-172.9	74.7	17.7	0	0	0	113.2	D365 D369 H393	D365-N367 VanDerWaalsContact C-N 3.31Å; D365-N367 PolarHBondContact O-N 3.38Å; D365-N367 PolarHBondContact OD1-OD1 2.79Å; D365-N367 VanDerWaalsContact OD1-OD1 3.1Å; N367-D369 PolarHBondContact ND2-OD2 3.35Å; N367-D369 WeakPolarHBondContact OD1-CA 3.47Å; N367-D369 WeakPolarHBondContact OD1-CB 3.4Å; N367-D369 PolarHBondContact OD1-N 2.95Å; N367-D369 PolarHBondContact OD1-OD1 3.46Å; N367-D369 PolarHBondContact OD1-OD2 3.04Å; N367-H393 PolarHBondContact ND2-ND1 3.14Å
368	G	67.7	Low	85.5	Confident	4 Å²	4	13.5 Å²	13.5	4%	0.041	8%	0.075	C	C	.	.	S	Bend	trans	73.7	26.7	-178.9	0	0	0	0	0	113.9	D365 F450 K529	D365-G368 WeakPolarHBondContact OD1-CA 3.49Å; D365-G368 PolarHBondContact OD1-N 2.74Å; D365-G368 VanDerWaalsContact OD2-C 3.28Å; D365-G368 VanDerWaalsContact OD2-CA 3.25Å; D365-G368 WeakPolarHBondContact OD2-CA 3.32Å; G368-F450 WeakPolarHBondContact O-CE1 3.42Å; G368-K529 PolarHBondContact O-NZ 3.44Å
369	D	72.4	Confident	85.5	Confident	56 Å²	56	13.2 Å²	13.2	30%	0.299	7%	0.074	S	C	.	.	S	Bend	trans	-87.9	-12.8	-179.4	74.4	12.8	0	0	0	114	D365 N367 Y371	D365-D369 PolarHBondContact OD1-N 3.47Å; D365-D369 PolarHBondContact OD2-N 3.07Å; N367-D369 PolarHBondContact ND2-OD2 3.35Å; N367-D369 WeakPolarHBondContact OD1-CA 3.47Å; N367-D369 WeakPolarHBondContact OD1-CB 3.4Å; N367-D369 PolarHBondContact OD1-N 2.95Å; N367-D369 PolarHBondContact OD1-OD1 3.46Å; N367-D369 PolarHBondContact OD1-OD2 3.04Å; D369-Y371 WeakPolarHBondContact OD1-CD2 3.3Å; D369-Y371 PolarHBondContact OD1-N 3.24Å
370	G	76.7	Confident	85.5	Confident	15 Å²	15	15.1 Å²	15.1	16%	0.155	8%	0.082	C	C	.	.	S	Bend	trans	97.4	9.8	179.6	0	0	0	0	0	115	N295 D365	N295-G370 PolarHBondContact ND2-O 3.4Å; D365-G370 VanDerWaalsContact OD2-CA 3.31Å; D365-G370 WeakPolarHBondContact OD2-CA 3.32Å; D365-G370 PolarHBondContact OD2-N 3.46Å
371	Y	85.4	Confident	85.5	Confident	59 Å²	59	15.1 Å²	15.1	23%	0.231	8%	0.081	C	C	.	.	S	Bend	trans	-118.5	144.3	171.9	-57.6	-81.9	0	0	0	110	N294 N295 D365 D369 S395 K396	N294-Y371 WeakPolarHBondContact O-CE1 3.43Å; N295-Y371 HydrophobicContact CB-CD1 3.81Å; N295-Y371 HydrophobicContact CB-CE1 3.96Å; D365-Y371 WeakPolarHBondContact CA-O 3.23Å; D365-Y371 VanDerWaalsContact CB-O 3.28Å; D365-Y371 WeakPolarHBondContact CB-O 3.47Å; D369-Y371 WeakPolarHBondContact OD1-CD2 3.3Å; D369-Y371 PolarHBondContact OD1-N 3.24Å; Y371-S395 VanDerWaalsContact CD1-C 3.46Å; Y371-K396 HydrophobicContact CE1-CB 3.95Å; Y371-K396 WeakPolarHBondContact OH-CB 3.36Å
372	N	87.1	Confident	85.3	Confident	27 Å²	27	14.9 Å²	14.9	14%	0.144	8%	0.08	C	C	.	.			trans	-77.4	146.2	177.1	-67.9	-18.3	0	0	0	110.8	D291 D292 L293 G394	D291-N372 PolarHBondContact OD1-ND2 3.29Å; D291-N372 WeakPolarHBondContact OD2-CB 3.37Å; D291-N372 PolarHBondContact OD2-ND2 3Å; D292-N372 WeakPolarHBondContact O-CB 3.28Å; L293-N372 HydrophobicContact CD2-CB 4.42Å; L293-N372 VanDerWaalsContact CD2-O 3.22Å; L293-N372 WeakPolarHBondContact CD2-O 3.38Å; N372-G394 VanDerWaalsContact O-CA 3.28Å; N372-G394 WeakPolarHBondContact O-CA 3.47Å; N372-G394 PolarHBondContact O-N 2.73Å
373	D	88.9	Confident	85	Confident	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	166.2	-177.5	-55.8	-37.2	0	0	0	110.4	T363 G364 L366 Y392 H393 G394	T363-D373 PolarHBondContact N-O 2.86Å; T363-D373 WeakPolarHBondContact OG1-CB 3.31Å; T363-D373 PolarHBondContact OG1-O 2.88Å; G364-D373 WeakPolarHBondContact O-CA 3.19Å; G364-D373 VanDerWaalsContact O-CB 3.29Å; G364-D373 WeakPolarHBondContact O-CB 3.15Å; G364-D373 PolarHBondContact O-N 2.96Å; L366-D373 VanDerWaalsContact CB-OD2 3.29Å; L366-D373 WeakPolarHBondContact CB-OD2 3.31Å; L366-D373 HydrophobicContact CD1-CB 4.17Å; L366-D373 HydrophobicContact CG-CB 4.27Å; L366-D373 PolarHBondContact N-OD2 3.22Å; D373-Y392 WeakPolarHBondContact CB-O 3.4Å; D373-H393 WeakPolarHBondContact OD1-CA 3.3Å; D373-H393 IonicContact OD1-CD2 3.34Å; D373-H393 IonicContact OD1-CG 2.74Å; D373-H393 IonicContact OD2-CD2 3.8Å; D373-H393 PolarHBondContact OD2-CD2 2.88Å; D373-G394 PolarHBondContact OD1-N 2.82Å
374	F	92.6	Very high	85.4	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	163.4	175.6	71.5	-79.1	0	0	0	112.1	L293 I302 V330 V332 L347 A361 V376 Y392 V399	L293-F374 HydrophobicContact CD1-CD1 4.1Å; L293-F374 HydrophobicContact CD1-CE1 4.28Å; L293-F374 HydrophobicContact CD2-CD1 4.05Å; I302-F374 HydrophobicContact CD1-CB 3.81Å; I302-F374 HydrophobicContact CD1-CD1 4.34Å; I302-F374 HydrophobicContact CD1-CD2 4.25Å; I302-F374 HydrophobicContact CD1-CG 3.88Å; I302-F374 HydrophobicContact CG2-CD2 4.22Å; I302-F374 HydrophobicContact CG2-CE2 4.3Å; V330-F374 HydrophobicContact CG1-CE2 4.29Å; V332-F374 HydrophobicContact CG2-CZ 4.14Å; L347-F374 HydrophobicContact CD1-CE2 4.27Å; L347-F374 HydrophobicContact CD1-CZ 3.68Å; A361-F374 WeakPolarHBondContact O-CA 3.45Å; A361-F374 WeakPolarHBondContact O-CB 3.48Å; F374-V376 HydrophobicContact CD2-CG2 3.86Å; F374-V376 HydrophobicContact CE2-CG2 3.53Å; F374-Y392 VanDerWaalsContact CE1-CB 3.42Å; F374-Y392 HydrophobicContact CE1-CG 4.27Å; F374-Y392 HydrophobicContact CE2-CD2 4.08Å; F374-Y392 HydrophobicContact CE2-CG 4.24Å; F374-Y392 VanDerWaalsContact CZ-CB 3.46Å; F374-Y392 HydrophobicContact CZ-CD2 4.12Å; F374-Y392 AromaticContact CZ-CG 3.81Å; F374-Y392 HydrophobicContact CZ-CG 3.81Å; F374-Y392 PolarHBondContact N-O 3.32Å; F374-Y392 VanDerWaalsContact N-O 3.13Å; F374-Y392 PolarHBondContact O-N 3.41Å; F374-V399 HydrophobicContact CE1-CB 4.31Å; F374-V399 HydrophobicContact CE1-CG1 3.62Å; F374-V399 HydrophobicContact CE1-CG2 3.65Å; F374-V399 HydrophobicContact CZ-CG1 3.95Å; F374-V399 HydrophobicContact CZ-CG2 4.4Å
375	I	93.4	Very high	86	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	141.9	-177.9	-170.3	170.9	0	0	0	111	V360 A361 T363 V389 Y390 I391 I423 I455	V360-I375 WeakPolarHBondContact CA-O 3.3Å; A361-I375 HydrophobicContact CB-CG2 3.95Å; A361-I375 PolarHBondContact N-O 3.01Å; A361-I375 VanDerWaalsContact N-O 3.08Å; A361-I375 WeakPolarHBondContact O-CG2 3.47Å; A361-I375 PolarHBondContact O-N 3.48Å; T363-I375 HydrophobicContact CG2-CB 4.07Å; T363-I375 HydrophobicContact CG2-CG2 3.78Å; I375-V389 HydrophobicContact CD1-CB 3.75Å; I375-V389 HydrophobicContact CD1-CG1 4.38Å; I375-V389 HydrophobicContact CD1-CG2 3.76Å; I375-V389 HydrophobicContact CG1-CB 3.97Å; I375-V389 HydrophobicContact CG1-CG2 4.45Å; I375-Y390 CarbonylContact C-O 3.59Å; I375-Y390 VanDerWaalsContact CA-O 3.29Å; I375-Y390 WeakPolarHBondContact CA-O 3.49Å; I375-Y390 WeakPolarHBondContact CG1-O 3.48Å; I375-I391 HydrophobicContact CD1-CG1 4.19Å; I375-I391 HydrophobicContact CG1-CG1 4.22Å; I375-I423 HydrophobicContact CD1-CG2 4.43Å; I375-I423 HydrophobicContact CG1-CD1 4.36Å; I375-I423 HydrophobicContact CG2-CB 4.47Å; I375-I423 HydrophobicContact CG2-CD1 4.39Å; I375-I423 HydrophobicContact CG2-CG2 3.5Å; I375-I423 VanDerWaalsContact CG2-CG2 3.5Å; I375-I455 HydrophobicContact CD1-CD1 4.2Å; I375-I455 HydrophobicContact CD1-CG2 3.57Å
376	V	96.5	Very high	86.8	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.6	-178.2	-175.3	0	0	0	0	110.7	V330 F356 G357 V360 F374 V389 Y390 Y392	V330-V376 HydrophobicContact CG2-CB 4.48Å; V330-V376 HydrophobicContact CG2-CG1 3.63Å; V330-V376 HydrophobicContact CG2-CG2 3.98Å; F356-V376 HydrophobicContact CD1-CG1 4.1Å; F356-V376 HydrophobicContact CD2-CB 4.5Å; F356-V376 HydrophobicContact CD2-CG1 3.79Å; F356-V376 HydrophobicContact CE1-CG1 3.87Å; F356-V376 HydrophobicContact CE2-CB 3.83Å; F356-V376 HydrophobicContact CE2-CG1 3.53Å; F356-V376 HydrophobicContact CE2-CG2 4.41Å; F356-V376 HydrophobicContact CG-CG1 4.07Å; F356-V376 HydrophobicContact CZ-CB 3.9Å; F356-V376 HydrophobicContact CZ-CG1 3.57Å; F356-V376 HydrophobicContact CZ-CG2 4Å; G357-V376 VanDerWaalsContact N-CG1 3.28Å; V360-V376 HydrophobicContact CG1-CG1 4.34Å; V360-V376 HydrophobicContact CG1-CG2 4.28Å; F374-V376 HydrophobicContact CD2-CG2 3.86Å; F374-V376 HydrophobicContact CE2-CG2 3.53Å; V376-V389 CarbonylContact O-C 3.54Å; V376-V389 VanDerWaalsContact O-CA 3.27Å; V376-V389 WeakPolarHBondContact O-CA 3.23Å; V376-Y390 PolarHBondContact N-O 2.93Å; V376-Y390 PolarHBondContact O-N 3.05Å; V376-Y392 HydrophobicContact CB-CE2 4.49Å; V376-Y392 HydrophobicContact CG2-CD2 3.98Å; V376-Y392 HydrophobicContact CG2-CE2 4.01Å
377	G	95.1	Very high	87.8	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	134.5	175.6	0	0	0	0	0	113.4	G357 H358 D359 G420	G357-G377 PolarHBondContact N-O 3.34Å; G357-G377 VanDerWaalsContact N-O 3.08Å; H358-G377 PolarHBondContact N-O 2.9Å; D359-G377 PolarHBondContact O-N 3.06Å; G377-G420 WeakPolarHBondContact CA-O 3.42Å
378	A	97	Very high	88.9	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	78.2	173.1	0	0	0	0	0	109.2	S354 F356 F380 D381 G387 A388 Y390	S354-A378 CarbonylContact O-C 3.55Å; F356-A378 HydrophobicContact CB-CB 4.39Å; F356-A378 HydrophobicContact CD2-CB 4.41Å; A378-F380 PolarHBondContact O-N 3.36Å; A378-D381 HydrophobicContact CB-CB 3.73Å; A378-D381 WeakPolarHBondContact O-CB 3.44Å; A378-D381 PolarHBondContact O-N 3.37Å; A378-G387 WeakPolarHBondContact O-CA 3.36Å; A378-A388 PolarHBondContact N-O 3.32Å; A378-A388 PolarHBondContact O-N 2.98Å; A378-Y390 HydrophobicContact CB-CD2 4.33Å; A378-Y390 HydrophobicContact CB-CE2 3.95Å
379	P	95	Very high	90.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-12.9	-164.9	23.6	-33.8	0	0	0	115.3	H358 K386 G387 T418 F419 W421	H358-P379 HydrophobicContact CB-CG 3.82Å; P379-K386 CarbonylContact O-C 3.56Å; P379-G387 VanDerWaalsContact C-CA 3.47Å; P379-G387 WeakPolarHBondContact O-CA 3.33Å; P379-G387 PolarHBondContact O-N 3.03Å; P379-T418 WeakPolarHBondContact O-CA 3.37Å; P379-F419 WeakPolarHBondContact CA-O 3.27Å; P379-W421 HydrophobicContact CB-CB 4.41Å; P379-W421 HydrophobicContact CB-CE3 3.98Å; P379-W421 HydrophobicContact CG-CE3 3.95Å
380	F	95.5	Very high	91.1	Very high	55 Å²	55	24.5 Å²	24.5	24%	0.241	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.5	12.2	-179.3	-55.2	-63.2	0	0	0	113.2	W353 S354 R355 A378 K385 T418 W421	W353-F380 VanDerWaalsContact O-CB 3.27Å; W353-F380 WeakPolarHBondContact O-CB 3.35Å; S354-F380 PolarHBondContact O-N 3.34Å; R355-F380 HydrophobicContact CB-CD2 4.21Å; R355-F380 HydrophobicContact CG-CD2 4.04Å; A378-F380 PolarHBondContact O-N 3.36Å; F380-K385 VanDerWaalsContact O-CA 3.23Å; F380-K385 WeakPolarHBondContact O-CA 3.18Å; F380-K385 WeakPolarHBondContact O-CB 3.49Å; F380-T418 HydrophobicContact CE1-CG2 4.07Å; F380-W421 HydrophobicContact CE2-CZ3 4.08Å; F380-W421 HydrophobicContact CZ-CE3 4.42Å; F380-W421 AromaticContact CZ-CZ3 3.8Å; F380-W421 HydrophobicContact CZ-CZ3 3.8Å
381	D	93.8	Very high	91.8	Very high	6 Å²	6	24.3 Å²	24.3	3%	0.032	13%	0.125	C	C	.	.			trans	-84	-178.2	178.2	-153.1	-8.6	0	0	0	112.9	K351 A378 K385 K386 G387 A388 Y390	K351-D381 VanDerWaalsContact CD-OD1 3.31Å; K351-D381 WeakPolarHBondContact CD-OD1 3.22Å; A378-D381 HydrophobicContact CB-CB 3.73Å; A378-D381 WeakPolarHBondContact O-CB 3.44Å; A378-D381 PolarHBondContact O-N 3.37Å; D381-K385 CarbonylContact O-C 3.51Å; D381-K385 VanDerWaalsContact O-CA 3.29Å; D381-K385 WeakPolarHBondContact O-CA 3.39Å; D381-K386 PolarHBondContact O-N 3.17Å; D381-K386 VanDerWaalsContact O-N 3.1Å; D381-G387 PolarHBondContact O-N 3.43Å; D381-A388 HydrophobicContact CB-CB 3.97Å; D381-Y390 WeakPolarHBondContact OD2-CE2 3.41Å; D381-Y390 PolarHBondContact OD2-OH 3.41Å
382	G	86.7	Confident	92.2	Very high	5 Å²	5	21.6 Å²	21.6	5%	0.052	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	169.7	-177	0	0	0	0	0	112.6	K351 S384 K385	K351-G382 PolarHBondContact NZ-O 2.74Å; G382-S384 PolarHBondContact O-N 2.99Å; G382-K385 PolarHBondContact O-N 2.8Å; G382-K385 VanDerWaalsContact O-N 3.15Å
383	P	82.8	Confident	92.4	Very high	76 Å²	76	21.3 Å²	21.3	49%	0.494	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-26.4	-176.7	17.1	-23.4	0	0	0	113	R410	P383-R410 VanDerWaalsContact CG-CZ 3.43Å
384	S	86.4	Confident	92.5	Very high	73 Å²	73	21.5 Å²	21.5	51%	0.51	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	7.8	177.3	-51.7	0	0	0	0	114.2	G382 K386	G382-S384 PolarHBondContact O-N 2.99Å; S384-K386 PolarHBondContact O-N 2.93Å
385	K	92	Very high	92.5	Very high	118 Å²	118	23.1 Å²	23.1	51%	0.513	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	38.1	-174	-57.2	-171.1	177.7	-167.7	0	113.8	F380 D381 G382	F380-K385 VanDerWaalsContact O-CA 3.23Å; F380-K385 WeakPolarHBondContact O-CA 3.18Å; F380-K385 WeakPolarHBondContact O-CB 3.49Å; D381-K385 CarbonylContact O-C 3.51Å; D381-K385 VanDerWaalsContact O-CA 3.29Å; D381-K385 WeakPolarHBondContact O-CA 3.39Å; G382-K385 PolarHBondContact O-N 2.8Å; G382-K385 VanDerWaalsContact O-N 3.15Å
386	K	93.7	Very high	92.4	Very high	67 Å²	67	31 Å²	31	29%	0.291	16%	0.16	S	C	.	.	S	Bend	trans	-97.5	-12.5	-175.8	-76.7	-176.1	171	-177.8	0	113.1	P379 D381 S384 A409 P414 L416 T417 T418 F419	P379-K386 CarbonylContact O-C 3.56Å; D381-K386 PolarHBondContact O-N 3.17Å; D381-K386 VanDerWaalsContact O-N 3.1Å; S384-K386 PolarHBondContact O-N 2.93Å; K386-A409 HydrophobicContact CB-CB 3.88Å; K386-P414 PolarHBondContact NZ-O 3.32Å; K386-L416 WeakPolarHBondContact CB-O 3.44Å; K386-L416 WeakPolarHBondContact CD-O 3.31Å; K386-T417 HydrophobicContact CG-CG2 4.31Å; K386-T417 CarbonylContact O-C 3.51Å; K386-T417 WeakPolarHBondContact O-CA 3.25Å; K386-T418 PolarHBondContact O-N 3.03Å; K386-F419 PolarHBondContact O-N 2.92Å; K386-F419 VanDerWaalsContact O-N 3.11Å
387	G	93.8	Very high	92.1	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.01	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	115.9	153.1	178.3	0	0	0	0	0	113.3	A378 P379 D381 A409 F419	A378-G387 WeakPolarHBondContact O-CA 3.36Å; P379-G387 VanDerWaalsContact C-CA 3.47Å; P379-G387 WeakPolarHBondContact O-CA 3.33Å; P379-G387 PolarHBondContact O-N 3.03Å; D381-G387 PolarHBondContact O-N 3.43Å; G387-A409 WeakPolarHBondContact O-CB 3.44Å; G387-A409 PolarHBondContact O-N 2.78Å; G387-F419 CarbonylContact C-O 3.55Å; G387-F419 VanDerWaalsContact CA-O 3.24Å; G387-F419 WeakPolarHBondContact CA-O 3.5Å
388	A	93.7	Very high	91.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	161.7	173.8	0	0	0	0	0	110.4	A378 D381 Y390 V406 I407 F419	A378-A388 PolarHBondContact N-O 3.32Å; A378-A388 PolarHBondContact O-N 2.98Å; D381-A388 HydrophobicContact CB-CB 3.97Å; A388-Y390 HydrophobicContact CB-CE2 4.13Å; A388-V406 HydrophobicContact CB-CG2 4.17Å; A388-I407 VanDerWaalsContact CA-O 3.27Å; A388-I407 WeakPolarHBondContact CA-O 3.48Å; A388-F419 PolarHBondContact N-O 3.41Å
389	V	92.8	Very high	91.7	Very high	1 Å²	1	41 Å²	41	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	144.7	167.1	-61.7	0	0	0	0	110.1	I375 V376 V406 I407 F419 I423 V457	I375-V389 HydrophobicContact CD1-CB 3.75Å; I375-V389 HydrophobicContact CD1-CG1 4.38Å; I375-V389 HydrophobicContact CD1-CG2 3.76Å; I375-V389 HydrophobicContact CG1-CB 3.97Å; I375-V389 HydrophobicContact CG1-CG2 4.45Å; V376-V389 CarbonylContact O-C 3.54Å; V376-V389 VanDerWaalsContact O-CA 3.27Å; V376-V389 WeakPolarHBondContact O-CA 3.23Å; V389-V406 WeakPolarHBondContact O-CA 3.42Å; V389-I407 HydrophobicContact CG2-CB 3.83Å; V389-I407 HydrophobicContact CG2-CD1 4.29Å; V389-I407 HydrophobicContact CG2-CG1 4.41Å; V389-I407 PolarHBondContact N-O 2.84Å; V389-I407 PolarHBondContact O-N 3.45Å; V389-F419 HydrophobicContact CB-CE1 4.44Å; V389-F419 HydrophobicContact CG1-CD1 4.38Å; V389-F419 HydrophobicContact CG1-CE1 3.91Å; V389-F419 HydrophobicContact CG1-CZ 4.44Å; V389-F419 HydrophobicContact CG2-CE1 3.91Å; V389-F419 HydrophobicContact CG2-CZ 4.29Å; V389-I423 HydrophobicContact CG1-CD1 3.91Å; V389-V457 HydrophobicContact CG1-CG1 3.79Å; V389-V457 HydrophobicContact CG1-CG2 4.18Å
390	Y	94.3	Very high	91.5	Very high	11 Å²	11	43.6 Å²	43.6	4%	0.043	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	131	-176.5	-68.3	-95.8	0	0	0	110.2	H350 F356 I375 V376 A378 D381 A388 F403 V406	H350-Y390 AromaticContact CD2-CE1 3.69Å; F356-Y390 AromaticContact CD2-CD2 3.84Å; F356-Y390 HydrophobicContact CD2-CD2 3.84Å; F356-Y390 HydrophobicContact CD2-CE2 4.09Å; F356-Y390 HydrophobicContact CD2-CG 4.43Å; F356-Y390 AromaticContact CE2-CD2 3.75Å; F356-Y390 HydrophobicContact CE2-CD2 3.75Å; F356-Y390 HydrophobicContact CE2-CE2 4.36Å; F356-Y390 AromaticContact CE2-CG 3.9Å; F356-Y390 HydrophobicContact CE2-CG 3.9Å; I375-Y390 CarbonylContact C-O 3.59Å; I375-Y390 VanDerWaalsContact CA-O 3.29Å; I375-Y390 WeakPolarHBondContact CA-O 3.49Å; I375-Y390 WeakPolarHBondContact CG1-O 3.48Å; V376-Y390 PolarHBondContact N-O 2.93Å; V376-Y390 PolarHBondContact O-N 3.05Å; A378-Y390 HydrophobicContact CB-CD2 4.33Å; A378-Y390 HydrophobicContact CB-CE2 3.95Å; D381-Y390 WeakPolarHBondContact OD2-CE2 3.41Å; D381-Y390 PolarHBondContact OD2-OH 3.41Å; A388-Y390 HydrophobicContact CB-CE2 4.13Å; Y390-F403 HydrophobicContact CD1-CB 4.24Å; Y390-F403 AromaticContact CD1-CD1 3.91Å; Y390-F403 HydrophobicContact CD1-CD1 3.91Å; Y390-F403 HydrophobicContact CD1-CD2 4.34Å; Y390-F403 HydrophobicContact CD1-CE1 4.35Å; Y390-F403 AromaticContact CD1-CG 3.92Å; Y390-F403 HydrophobicContact CD1-CG 3.92Å; Y390-F403 HydrophobicContact CE1-CD1 4.18Å; Y390-F403 HydrophobicContact CE1-CE1 4.17Å; Y390-F403 HydrophobicContact CE1-CZ 4.49Å; Y390-V406 HydrophobicContact CD1-CB 3.86Å; Y390-V406 HydrophobicContact CD1-CG2 3.79Å; Y390-V406 HydrophobicContact CD2-CG2 4.44Å; Y390-V406 HydrophobicContact CE1-CB 3.8Å; Y390-V406 HydrophobicContact CE1-CG2 3.46Å; Y390-V406 VanDerWaalsContact CE1-CG2 3.46Å; Y390-V406 HydrophobicContact CE2-CG2 4.16Å; Y390-V406 HydrophobicContact CG-CG2 4.27Å
391	I	90.8	Very high	91.3	Very high	11 Å²	11	47.5 Å²	47.5	6%	0.056	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	132.1	179	-60.5	168.7	0	0	0	108.9	L366 I375 F403 S404 Q405 I407 I455	L366-I391 HydrophobicContact CD1-CG2 3.66Å; I375-I391 HydrophobicContact CD1-CG1 4.19Å; I375-I391 HydrophobicContact CG1-CG1 4.22Å; I391-F403 CarbonylContact O-C 3.58Å; I391-F403 WeakPolarHBondContact O-CA 3.17Å; I391-F403 WeakPolarHBondContact O-CB 3.5Å; I391-S404 WeakPolarHBondContact CG2-OG 3.25Å; I391-S404 PolarHBondContact O-N 2.94Å; I391-S404 PolarHBondContact O-OG 3.32Å; I391-Q405 HydrophobicContact CD1-CB 4.34Å; I391-Q405 PolarHBondContact N-O 2.85Å; I391-I407 HydrophobicContact CD1-CD1 4.39Å; I391-I455 HydrophobicContact CD1-CD1 4.36Å
392	Y	94.2	Very high	91.1	Very high	1 Å²	1	54.8 Å²	54.8	0%	0.004	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130.7	179.2	-73.7	-92.4	0	0	0	109.6	L347 F356 D373 F374 V376 V399 N400 E401 F403	L347-Y392 HydrophobicContact CD1-CD1 3.8Å; L347-Y392 HydrophobicContact CD1-CD2 4.47Å; L347-Y392 HydrophobicContact CD1-CE1 3.76Å; L347-Y392 HydrophobicContact CD1-CE2 4.42Å; L347-Y392 HydrophobicContact CD1-CG 4.17Å; L347-Y392 HydrophobicContact CD2-CE1 4.19Å; L347-Y392 HydrophobicContact CG-CE1 4.45Å; F356-Y392 HydrophobicContact CE2-CE2 4.09Å; F356-Y392 AromaticContact CZ-CE2 3.76Å; F356-Y392 HydrophobicContact CZ-CE2 3.76Å; F356-Y392 AromaticContact CZ-CZ 3.91Å; F356-Y392 WeakPolarHBondContact CZ-OH 3.48Å; D373-Y392 WeakPolarHBondContact CB-O 3.4Å; F374-Y392 VanDerWaalsContact CE1-CB 3.42Å; F374-Y392 HydrophobicContact CE1-CG 4.27Å; F374-Y392 HydrophobicContact CE2-CD2 4.08Å; F374-Y392 HydrophobicContact CE2-CG 4.24Å; F374-Y392 VanDerWaalsContact CZ-CB 3.46Å; F374-Y392 HydrophobicContact CZ-CD2 4.12Å; F374-Y392 AromaticContact CZ-CG 3.81Å; F374-Y392 HydrophobicContact CZ-CG 3.81Å; F374-Y392 PolarHBondContact N-O 3.32Å; F374-Y392 VanDerWaalsContact N-O 3.13Å; F374-Y392 PolarHBondContact O-N 3.41Å; V376-Y392 HydrophobicContact CB-CE2 4.49Å; V376-Y392 HydrophobicContact CG2-CD2 3.98Å; V376-Y392 HydrophobicContact CG2-CE2 4.01Å; Y392-V399 HydrophobicContact CD1-CG1 4.29Å; Y392-N400 WeakPolarHBondContact CD1-O 3.48Å; Y392-E401 WeakPolarHBondContact CE1-O 3.43Å; Y392-F403 HydrophobicContact CD1-CB 4.34Å; Y392-F403 HydrophobicContact CE1-CB 3.91Å; Y392-F403 HydrophobicContact CE2-CB 4.13Å
393	H	91	Very high	91.3	Very high	22 Å²	22	57.5 Å²	57.5	10%	0.102	28%	0.28	C	S	.	.			trans	-87.1	138.5	177.7	-61.6	155.5	0	0	0	112.1	N367 D373 N400 S404 Y640	N367-H393 PolarHBondContact ND2-ND1 3.14Å; D373-H393 WeakPolarHBondContact OD1-CA 3.3Å; D373-H393 IonicContact OD1-CD2 3.34Å; D373-H393 IonicContact OD1-CG 2.74Å; D373-H393 IonicContact OD2-CD2 3.8Å; D373-H393 PolarHBondContact OD2-CD2 2.88Å; H393-N400 PolarHBondContact O-N 3.48Å; H393-S404 WeakPolarHBondContact CE1-CB 3.26Å; H393-S404 PolarHBondContact CE1-OG 3.48Å; H393-S404 WeakPolarHBondContact NE2-CB 3.4Å; H393-S404 PolarHBondContact NE2-OG 3.46Å; H393-Y640 AromaticContact ND1-CE2 3.76Å; H393-Y640 AromaticContact ND1-CZ 3.75Å; H393-Y640 PolarHBondContact ND1-OH 3.36Å
394	G	91.6	Very high	91.5	Very high	3 Å²	3	56.3 Å²	56.3	3%	0.031	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	167.2	166	0	0	0	0	0	111.8	L293 N372 D373	L293-G394 WeakPolarHBondContact O-CA 3.35Å; N372-G394 VanDerWaalsContact O-CA 3.28Å; N372-G394 WeakPolarHBondContact O-CA 3.47Å; N372-G394 PolarHBondContact O-N 2.73Å; D373-G394 PolarHBondContact OD1-N 2.82Å
395	S	92.6	Very high	91.5	Very high	34 Å²	34	57.9 Å²	57.9	24%	0.238	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	164.2	176.3	82.2	0	0	0	0	110.9	L293 N294 Y371 K397 G398	L293-S395 PolarHBondContact O-N 3.42Å; N294-S395 WeakPolarHBondContact CA-O 3.38Å; Y371-S395 VanDerWaalsContact CD1-C 3.46Å; S395-K397 PolarHBondContact O-N 2.89Å; S395-K397 PolarHBondContact OG-N 3.35Å; S395-G398 CarbonylContact C-O 3.47Å; S395-G398 WeakPolarHBondContact CA-O 3.4Å; S395-G398 WeakPolarHBondContact CB-O 3.34Å; S395-G398 PolarHBondContact N-O 3.36Å; S395-G398 PolarHBondContact O-N 2.94Å; S395-G398 PolarHBondContact OG-N 2.97Å; S395-G398 PolarHBondContact OG-O 3.33Å
396	K	91.7	Very high	91.4	Very high	168 Å²	168	54 Å²	54	73%	0.73	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-29.3	173.3	-160.9	177	175.3	-177.9	0	114.2	Y371	Y371-K396 HydrophobicContact CE1-CB 3.95Å; Y371-K396 WeakPolarHBondContact OH-CB 3.36Å
397	K	89.4	Confident	91.1	Very high	192 Å²	192	51.6 Å²	51.6	84%	0.835	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-5.5	-177.7	-69.4	-171.8	177.4	-174.3	0	112.8	S395	S395-K397 PolarHBondContact O-N 2.89Å; S395-K397 PolarHBondContact OG-N 3.35Å
398	G	90.8	Very high	90.9	Very high	3 Å²	3	53 Å²	53	3%	0.031	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	118.4	-140.8	-167.7	0	0	0	0	0	110.3	S395	S395-G398 CarbonylContact C-O 3.47Å; S395-G398 WeakPolarHBondContact CA-O 3.4Å; S395-G398 WeakPolarHBondContact CB-O 3.34Å; S395-G398 PolarHBondContact N-O 3.36Å; S395-G398 PolarHBondContact O-N 2.94Å; S395-G398 PolarHBondContact OG-N 2.97Å; S395-G398 PolarHBondContact OG-O 3.33Å
399	V	93.5	Very high	90.6	Very high	13 Å²	13	53 Å²	53	8%	0.079	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	145.2	-179.2	171.5	0	0	0	0	111.5	L293 V332 F334 L347 F374 Y392 E401	L293-V399 HydrophobicContact CB-CG2 4.44Å; L293-V399 HydrophobicContact CD1-CG2 3.7Å; V332-V399 HydrophobicContact CB-CG2 4.46Å; V332-V399 HydrophobicContact CG1-CG2 4.04Å; V332-V399 HydrophobicContact CG2-CG2 4.2Å; F334-V399 HydrophobicContact CZ-CG2 4.17Å; L347-V399 HydrophobicContact CD1-CG1 4.27Å; F374-V399 HydrophobicContact CE1-CB 4.31Å; F374-V399 HydrophobicContact CE1-CG1 3.62Å; F374-V399 HydrophobicContact CE1-CG2 3.65Å; F374-V399 HydrophobicContact CZ-CG1 3.95Å; F374-V399 HydrophobicContact CZ-CG2 4.4Å; Y392-V399 HydrophobicContact CD1-CG1 4.29Å; V399-E401 PolarHBondContact O-N 2.9Å
400	N	91.4	Very high	90.3	Very high	56 Å²	56	59 Å²	59	30%	0.299	28%	0.277	S	S	.	.			trans	-73.4	111.5	167.5	-171	-16.6	0	0	0	110.3	Y392 H393 K402 Y640	Y392-N400 WeakPolarHBondContact CD1-O 3.48Å; H393-N400 PolarHBondContact O-N 3.48Å; N400-K402 PolarHBondContact O-N 3.34Å; N400-K402 VanDerWaalsContact O-N 3.13Å; N400-K402 PolarHBondContact OD1-N 3.39Å; N400-K402 PolarHBondContact OD1-O 2.82Å; N400-Y640 WeakPolarHBondContact ND2-CE1 3.23Å; N400-Y640 PolarHBondContact ND2-OH 2.88Å
401	E	90.3	Very high	89.7	Confident	136 Å²	136	62.9 Å²	62.9	64%	0.636	30%	0.296	S	S	*	.	S	Bend	trans	-61.7	-23.8	-175.1	-65.8	-179.4	-159.1	0	0	114	T345 L347 Y392 V399	T345-E401 HydrophobicContact CG2-CG 3.86Å; L347-E401 HydrophobicContact CD2-CB 4.13Å; L347-E401 HydrophobicContact CD2-CG 4.12Å; Y392-E401 WeakPolarHBondContact CE1-O 3.43Å; V399-E401 PolarHBondContact O-N 2.9Å
402	K	90.1	Very high	89.2	Confident	160 Å²	160	64.4 Å²	64.4	70%	0.696	31%	0.306	S	S	*	.	S	Bend	trans	-88.1	120.7	171.8	-173.5	176.7	-179.8	177.5	0	109.5	N400	N400-K402 PolarHBondContact O-N 3.34Å; N400-K402 VanDerWaalsContact O-N 3.13Å; N400-K402 PolarHBondContact OD1-N 3.39Å; N400-K402 PolarHBondContact OD1-O 2.82Å
403	F	90	Very high	88.7	Confident	62 Å²	62	66.5 Å²	66.5	27%	0.272	32%	0.317	S	S	.	.			trans	-54.3	142.4	174	62.7	-96.8	0	0	0	111.2	H350 Y390 I391 Y392 V406	H350-F403 AromaticContact CD2-CE1 3.89Å; H350-F403 AromaticContact NE2-CD1 3.39Å; H350-F403 WeakPolarHBondContact NE2-CD1 3.22Å; H350-F403 AromaticContact NE2-CE1 3.44Å; H350-F403 WeakPolarHBondContact NE2-CE1 3.16Å; Y390-F403 HydrophobicContact CD1-CB 4.24Å; Y390-F403 AromaticContact CD1-CD1 3.91Å; Y390-F403 HydrophobicContact CD1-CD1 3.91Å; Y390-F403 HydrophobicContact CD1-CD2 4.34Å; Y390-F403 HydrophobicContact CD1-CE1 4.35Å; Y390-F403 AromaticContact CD1-CG 3.92Å; Y390-F403 HydrophobicContact CD1-CG 3.92Å; Y390-F403 HydrophobicContact CE1-CD1 4.18Å; Y390-F403 HydrophobicContact CE1-CE1 4.17Å; Y390-F403 HydrophobicContact CE1-CZ 4.49Å; I391-F403 CarbonylContact O-C 3.58Å; I391-F403 WeakPolarHBondContact O-CA 3.17Å; I391-F403 WeakPolarHBondContact O-CB 3.5Å; Y392-F403 HydrophobicContact CD1-CB 4.34Å; Y392-F403 HydrophobicContact CE1-CB 3.91Å; Y392-F403 HydrophobicContact CE2-CB 4.13Å; F403-V406 HydrophobicContact CD2-CB 4.38Å; F403-V406 HydrophobicContact CE2-CB 4.15Å; F403-V406 HydrophobicContact CE2-CG1 4.04Å
404	S	87.2	Confident	88.4	Confident	50 Å²	50	69.3 Å²	69.3	35%	0.35	34%	0.337	S	S	.	.	S	Bend	trans	-80.6	-33.8	177.8	62.3	0	0	0	0	111.9	I391 H393	I391-S404 WeakPolarHBondContact CG2-OG 3.25Å; I391-S404 PolarHBondContact O-N 2.94Å; I391-S404 PolarHBondContact O-OG 3.32Å; H393-S404 WeakPolarHBondContact CE1-CB 3.26Å; H393-S404 PolarHBondContact CE1-OG 3.48Å; H393-S404 WeakPolarHBondContact NE2-CB 3.4Å; H393-S404 PolarHBondContact NE2-OG 3.46Å
405	Q	85.7	Confident	88.3	Confident	107 Å²	107	73.1 Å²	73.1	50%	0.5	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	147.9	178.7	-175.3	173.9	-4.8	0	0	111.2	I391 I407	I391-Q405 HydrophobicContact CD1-CB 4.34Å; I391-Q405 PolarHBondContact N-O 2.85Å; Q405-I407 HydrophobicContact CG-CG1 4.28Å
406	V	89.9	Confident	88	Confident	36 Å²	36	71.6 Å²	71.6	22%	0.218	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	140	165.9	60.8	0	0	0	0	108.5	A388 V389 Y390 F403	A388-V406 HydrophobicContact CB-CG2 4.17Å; V389-V406 WeakPolarHBondContact O-CA 3.42Å; Y390-V406 HydrophobicContact CD1-CB 3.86Å; Y390-V406 HydrophobicContact CD1-CG2 3.79Å; Y390-V406 HydrophobicContact CD2-CG2 4.44Å; Y390-V406 HydrophobicContact CE1-CB 3.8Å; Y390-V406 HydrophobicContact CE1-CG2 3.46Å; Y390-V406 VanDerWaalsContact CE1-CG2 3.46Å; Y390-V406 HydrophobicContact CE2-CG2 4.16Å; Y390-V406 HydrophobicContact CG-CG2 4.27Å; F403-V406 HydrophobicContact CD2-CB 4.38Å; F403-V406 HydrophobicContact CE2-CB 4.15Å; F403-V406 HydrophobicContact CE2-CG1 4.04Å
407	I	88.5	Confident	88	Confident	17 Å²	17	65.4 Å²	65.4	9%	0.087	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	113.6	175.6	-56	170.2	0	0	0	107.8	A388 V389 I391 Q405 V412 F419 F468	A388-I407 VanDerWaalsContact CA-O 3.27Å; A388-I407 WeakPolarHBondContact CA-O 3.48Å; V389-I407 HydrophobicContact CG2-CB 3.83Å; V389-I407 HydrophobicContact CG2-CD1 4.29Å; V389-I407 HydrophobicContact CG2-CG1 4.41Å; V389-I407 PolarHBondContact N-O 2.84Å; V389-I407 PolarHBondContact O-N 3.45Å; I391-I407 HydrophobicContact CD1-CD1 4.39Å; Q405-I407 HydrophobicContact CG-CG1 4.28Å; I407-V412 HydrophobicContact CG2-CG2 3.75Å; I407-F419 HydrophobicContact CG2-CE1 4.47Å; I407-F468 HydrophobicContact CD1-CD1 4.44Å; I407-F468 HydrophobicContact CD1-CE1 4.15Å; I407-F468 HydrophobicContact CD1-CZ 4.29Å; I407-F468 HydrophobicContact CG2-CE1 4.15Å; I407-F468 HydrophobicContact CG2-CZ 3.93Å
408	H	88.8	Confident	88.1	Confident	30 Å²	30	56.6 Å²	56.6	14%	0.139	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	145.6	177.3	-66.1	-66.3	0	0	0	111.4	R410 E411	H408-R410 HydrophobicContact CB-CG 4.03Å; H408-R410 PolarHBondContact O-N 3.39Å; H408-E411 HydrophobicContact CB-CG 4.5Å; H408-E411 IonicContact CD2-OE1 3.47Å; H408-E411 PolarHBondContact CD2-OE1 2.86Å; H408-E411 IonicContact CD2-OE2 3.81Å; H408-E411 IonicContact CG-OE1 2.95Å; H408-E411 PolarHBondContact N-OE2 3.47Å; H408-E411 WeakPolarHBondContact O-CB 3.48Å; H408-E411 PolarHBondContact O-N 2.91Å
409	A	87.9	Confident	88.1	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-49.5	-39.9	176.4	0	0	0	0	0	113.1	K386 G387 E411 V412 D413 L416 F419	K386-A409 HydrophobicContact CB-CB 3.88Å; G387-A409 WeakPolarHBondContact O-CB 3.44Å; G387-A409 PolarHBondContact O-N 2.78Å; A409-E411 VanDerWaalsContact C-N 3.26Å; A409-E411 PolarHBondContact O-N 3.35Å; A409-V412 PolarHBondContact O-N 2.89Å; A409-V412 VanDerWaalsContact O-N 3.15Å; A409-D413 CarbonylContact O-C 3.58Å; A409-D413 VanDerWaalsContact O-C 3.32Å; A409-D413 PolarHBondContact O-N 3.15Å; A409-L416 HydrophobicContact CB-CB 4.11Å; A409-F419 HydrophobicContact CB-CB 3.72Å; A409-F419 HydrophobicContact CB-CD1 4.21Å; A409-F419 HydrophobicContact CB-CG 4.09Å
410	R	86.3	Confident	88	Confident	126 Å²	126	55.8 Å²	55.8	48%	0.475	28%	0.282	S	S	.	.	H	α-helix	trans	-63.2	-26.3	-179.7	73.9	-180	179.2	166.3	-3	114.5	P383 H408 V412	P383-R410 VanDerWaalsContact CG-CZ 3.43Å; H408-R410 HydrophobicContact CB-CG 4.03Å; H408-R410 PolarHBondContact O-N 3.39Å; R410-V412 VanDerWaalsContact C-N 3.34Å
411	E	81.2	Confident	88	Confident	93 Å²	93	53.8 Å²	53.8	44%	0.435	27%	0.27	S	S	.	.	H	α-helix	trans	-82.9	-18.7	-179.8	-72.4	150.9	-163.8	0	0	111.5	H408 A409 N482	H408-E411 HydrophobicContact CB-CG 4.5Å; H408-E411 IonicContact CD2-OE1 3.47Å; H408-E411 PolarHBondContact CD2-OE1 2.86Å; H408-E411 IonicContact CD2-OE2 3.81Å; H408-E411 IonicContact CG-OE1 2.95Å; H408-E411 PolarHBondContact N-OE2 3.47Å; H408-E411 WeakPolarHBondContact O-CB 3.48Å; H408-E411 PolarHBondContact O-N 2.91Å; A409-E411 VanDerWaalsContact C-N 3.26Å; A409-E411 PolarHBondContact O-N 3.35Å; E411-N482 PolarHBondContact O-ND2 3.34Å
412	V	81.8	Confident	88	Confident	44 Å²	44	47.7 Å²	47.7	27%	0.267	24%	0.243	S	C	.	.	H	α-helix	trans	-92.5	-63	175.2	-178.3	0	0	0	0	109.6	I407 A409 R410 L416 F419 V466 F468	I407-V412 HydrophobicContact CG2-CG2 3.75Å; A409-V412 PolarHBondContact O-N 2.89Å; A409-V412 VanDerWaalsContact O-N 3.15Å; R410-V412 VanDerWaalsContact C-N 3.34Å; V412-L416 HydrophobicContact CB-CD1 4.04Å; V412-L416 HydrophobicContact CG1-CD1 3.83Å; V412-F419 HydrophobicContact CG2-CZ 4.33Å; V412-V466 HydrophobicContact CG1-CG1 3.8Å; V412-V466 HydrophobicContact CG1-CG2 4.08Å; V412-F468 HydrophobicContact CG2-CE1 4.07Å; V412-F468 HydrophobicContact CG2-CZ 3.74Å
413	D	82.5	Confident	88	Confident	44 Å²	44	40.6 Å²	40.6	24%	0.235	21%	0.213	C	C	.	.			trans	-155	118.2	175.7	179.1	-23.2	0	0	0	108.5	A409 T415 L416 R464	A409-D413 CarbonylContact O-C 3.58Å; A409-D413 VanDerWaalsContact O-C 3.32Å; A409-D413 PolarHBondContact O-N 3.15Å; D413-T415 PolarHBondContact O-N 3.05Å; D413-T415 WeakPolarHBondContact OD1-CB 3.15Å; D413-T415 WeakPolarHBondContact OD1-CG2 3.2Å; D413-T415 PolarHBondContact OD1-N 2.9Å; D413-T415 PolarHBondContact OD1-OG1 2.88Å; D413-T415 PolarHBondContact OD2-OG1 2.75Å; D413-L416 HydrophobicContact CB-CD1 3.93Å; D413-L416 HydrophobicContact CB-CG 3.97Å; D413-L416 WeakPolarHBondContact O-CB 3.42Å; D413-L416 PolarHBondContact O-N 2.93Å; D413-R464 IonicContact OD2-CZ 2.62Å; D413-R464 IonicContact OD2-NH1 3.97Å; D413-R464 PolarHBondContact OD2-NH1 3.07Å
414	P	85.4	Confident	87.7	Confident	82 Å²	82	38.4 Å²	38.4	53%	0.532	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-17.8	178.8	-25.9	34	0	0	0	115.5	K386	K386-P414 PolarHBondContact NZ-O 3.32Å
415	T	88.4	Confident	87	Confident	83 Å²	83	36.8 Å²	36.8	51%	0.509	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-13.3	178.2	67.9	0	0	0	0	113.8	D413 S462	D413-T415 PolarHBondContact O-N 3.05Å; D413-T415 WeakPolarHBondContact OD1-CB 3.15Å; D413-T415 WeakPolarHBondContact OD1-CG2 3.2Å; D413-T415 PolarHBondContact OD1-N 2.9Å; D413-T415 PolarHBondContact OD1-OG1 2.88Å; D413-T415 PolarHBondContact OD2-OG1 2.75Å; T415-S462 PolarHBondContact O-OG 3.28Å
416	L	87	Confident	86	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.01	19%	0.19	C	C	.	.			trans	-66.1	140.1	176.6	-69.3	169.6	0	0	0	111.1	K386 A409 V412 D413 F419 A459 S462 R464 V466	K386-L416 WeakPolarHBondContact CB-O 3.44Å; K386-L416 WeakPolarHBondContact CD-O 3.31Å; A409-L416 HydrophobicContact CB-CB 4.11Å; V412-L416 HydrophobicContact CB-CD1 4.04Å; V412-L416 HydrophobicContact CG1-CD1 3.83Å; D413-L416 HydrophobicContact CB-CD1 3.93Å; D413-L416 HydrophobicContact CB-CG 3.97Å; D413-L416 WeakPolarHBondContact O-CB 3.42Å; D413-L416 PolarHBondContact O-N 2.93Å; L416-F419 HydrophobicContact CD1-CD2 4.11Å; L416-A459 HydrophobicContact CD2-CB 3.84Å; L416-S462 WeakPolarHBondContact CA-OG 3.44Å; L416-R464 HydrophobicContact CD2-CB 3.89Å; L416-V466 HydrophobicContact CD1-CG2 3.92Å
417	T	92.2	Very high	84.7	Confident	38 Å²	38	33 Å²	33	23%	0.233	19%	0.186	C	C	.	.			trans	-139	147.3	174.7	60.5	0	0	0	0	108.2	K386 F419 A459 K461 S462	K386-T417 HydrophobicContact CG-CG2 4.31Å; K386-T417 CarbonylContact O-C 3.51Å; K386-T417 WeakPolarHBondContact O-CA 3.25Å; T417-F419 PolarHBondContact O-N 2.78Å; T417-A459 WeakPolarHBondContact O-CB 3.49Å; T417-K461 WeakPolarHBondContact OG1-CB 3.36Å; T417-S462 PolarHBondContact N-OG 2.62Å; T417-S462 PolarHBondContact OG1-OG 3.49Å
418	T	92.1	Very high	83	Confident	6 Å²	6	32.3 Å²	32.3	4%	0.037	18%	0.183	C	C	.	.	S	Bend	trans	62	26.4	-174.6	65.3	0	0	0	0	113.7	P379 F380 K386 G420 W421 Y460 K461	P379-T418 WeakPolarHBondContact O-CA 3.37Å; F380-T418 HydrophobicContact CE1-CG2 4.07Å; K386-T418 PolarHBondContact O-N 3.03Å; T418-G420 PolarHBondContact O-N 3.04Å; T418-W421 VanDerWaalsContact O-CB 3.28Å; T418-W421 WeakPolarHBondContact O-CB 3.4Å; T418-W421 PolarHBondContact O-N 2.91Å; T418-Y460 HydrophobicContact CG2-CD1 4.1Å; T418-Y460 HydrophobicContact CG2-CE1 3.54Å; T418-Y460 VanDerWaalsContact OG1-CD1 3.23Å; T418-Y460 WeakPolarHBondContact OG1-CD1 3.22Å; T418-Y460 PolarHBondContact OG1-N 3.03Å; T418-K461 HydrophobicContact CG2-CB 3.79Å; T418-K461 HydrophobicContact CG2-CD 4.22Å; T418-K461 WeakPolarHBondContact OG1-CB 3.31Å; T418-K461 PolarHBondContact OG1-N 2.97Å; T418-K461 VanDerWaalsContact OG1-N 3.11Å
419	F	90.8	Very high	81.1	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-65.8	125.8	179.1	177.1	-100.6	0	0	0	111	P379 K386 G387 A388 V389 I407 A409 V412 L416 T417 V457 A459 V466 F468	P379-F419 WeakPolarHBondContact CA-O 3.27Å; K386-F419 PolarHBondContact O-N 2.92Å; K386-F419 VanDerWaalsContact O-N 3.11Å; G387-F419 CarbonylContact C-O 3.55Å; G387-F419 VanDerWaalsContact CA-O 3.24Å; G387-F419 WeakPolarHBondContact CA-O 3.5Å; A388-F419 PolarHBondContact N-O 3.41Å; V389-F419 HydrophobicContact CB-CE1 4.44Å; V389-F419 HydrophobicContact CG1-CD1 4.38Å; V389-F419 HydrophobicContact CG1-CE1 3.91Å; V389-F419 HydrophobicContact CG1-CZ 4.44Å; V389-F419 HydrophobicContact CG2-CE1 3.91Å; V389-F419 HydrophobicContact CG2-CZ 4.29Å; I407-F419 HydrophobicContact CG2-CE1 4.47Å; A409-F419 HydrophobicContact CB-CB 3.72Å; A409-F419 HydrophobicContact CB-CD1 4.21Å; A409-F419 HydrophobicContact CB-CG 4.09Å; V412-F419 HydrophobicContact CG2-CZ 4.33Å; L416-F419 HydrophobicContact CD1-CD2 4.11Å; T417-F419 PolarHBondContact O-N 2.78Å; F419-V457 HydrophobicContact CD1-CG1 4.35Å; F419-V457 HydrophobicContact CD2-CB 4.37Å; F419-V457 HydrophobicContact CD2-CG1 3.71Å; F419-V457 HydrophobicContact CE1-CG1 4.11Å; F419-V457 HydrophobicContact CE2-CB 3.67Å; F419-V457 HydrophobicContact CE2-CG1 3.41Å; F419-V457 VanDerWaalsContact CE2-CG1 3.41Å; F419-V457 HydrophobicContact CE2-CG2 4.43Å; F419-V457 HydrophobicContact CG-CG1 4.17Å; F419-V457 HydrophobicContact CZ-CB 3.93Å; F419-V457 HydrophobicContact CZ-CG1 3.63Å; F419-V457 HydrophobicContact CZ-CG2 4.22Å; F419-A459 HydrophobicContact CB-CB 4.41Å; F419-V466 HydrophobicContact CE2-CB 4.16Å; F419-V466 HydrophobicContact CE2-CG2 4.1Å; F419-F468 HydrophobicContact CE2-CE2 4.31Å; F419-F468 HydrophobicContact CE2-CZ 4.41Å; F419-F468 AromaticContact CZ-CE2 3.85Å; F419-F468 HydrophobicContact CZ-CE2 3.85Å; F419-F468 AromaticContact CZ-CZ 3.84Å; F419-F468 HydrophobicContact CZ-CZ 3.84Å
420	G	90	Very high	79.3	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.6	15	-172.3	0	0	0	0	0	113.5	G377 T418 V457 G458	G377-G420 WeakPolarHBondContact CA-O 3.42Å; T418-G420 PolarHBondContact O-N 3.04Å; G420-V457 VanDerWaalsContact N-CG1 3.34Å; G420-G458 PolarHBondContact N-O 2.95Å; G420-G458 VanDerWaalsContact N-O 3.07Å
421	W	91.7	Very high	77.4	Confident	13 Å²	13	29.7 Å²	29.7	5%	0.049	19%	0.189	C	C	.	.	S	Bend	trans	-71.7	-39.6	175.6	-176.2	-90.8	0	0	0	113.2	M1 H358 P379 F380 T418 G458 Y460	M1-W421 WeakPolarHBondContact O-CZ2 3.22Å; H358-W421 AromaticContact CD2-CE3 3.94Å; H358-W421 PolarHBondContact CD2-O 3.03Å; H358-W421 AromaticContact CE1-CE3 3.91Å; H358-W421 AromaticContact CE1-CH2 3.89Å; H358-W421 AromaticContact CE1-CZ3 3.62Å; H358-W421 AromaticContact NE2-CD2 3.52Å; H358-W421 AromaticContact NE2-CE2 3.68Å; H358-W421 AromaticContact NE2-CE3 3.45Å; H358-W421 AromaticContact NE2-CH2 3.85Å; H358-W421 AromaticContact NE2-CZ2 3.92Å; H358-W421 AromaticContact NE2-CZ3 3.59Å; P379-W421 HydrophobicContact CB-CB 4.41Å; P379-W421 HydrophobicContact CB-CE3 3.98Å; P379-W421 HydrophobicContact CG-CE3 3.95Å; F380-W421 HydrophobicContact CE2-CZ3 4.08Å; F380-W421 HydrophobicContact CZ-CE3 4.42Å; F380-W421 AromaticContact CZ-CZ3 3.8Å; F380-W421 HydrophobicContact CZ-CZ3 3.8Å; T418-W421 VanDerWaalsContact O-CB 3.28Å; T418-W421 WeakPolarHBondContact O-CB 3.4Å; T418-W421 PolarHBondContact O-N 2.91Å; W421-G458 PolarHBondContact N-O 3.45Å; W421-Y460 HydrophobicContact CB-CD1 4.1Å; W421-Y460 AromaticContact CD1-CD1 3.89Å; W421-Y460 AromaticContact CD2-CD1 3.59Å; W421-Y460 HydrophobicContact CD2-CD1 3.59Å; W421-Y460 AromaticContact CD2-CE1 3.56Å; W421-Y460 HydrophobicContact CD2-CE1 3.56Å; W421-Y460 AromaticContact CE2-CD1 3.78Å; W421-Y460 AromaticContact CE2-CE1 3.7Å; W421-Y460 HydrophobicContact CE3-CD1 4.11Å; W421-Y460 AromaticContact CE3-CE1 3.66Å; W421-Y460 HydrophobicContact CE3-CE1 3.66Å; W421-Y460 AromaticContact CG-CD1 3.6Å; W421-Y460 HydrophobicContact CG-CD1 3.6Å; W421-Y460 HydrophobicContact CG-CE1 4.09Å; W421-Y460 AromaticContact CH2-CE1 3.93Å; W421-Y460 HydrophobicContact CH2-CE1 3.93Å; W421-Y460 HydrophobicContact CZ2-CD1 4.32Å; W421-Y460 AromaticContact CZ2-CE1 3.81Å; W421-Y460 HydrophobicContact CZ2-CE1 3.81Å; W421-Y460 AromaticContact CZ3-CE1 3.88Å; W421-Y460 HydrophobicContact CZ3-CE1 3.88Å; W421-Y460 AromaticContact NE1-CD1 3.99Å
422	S	90.8	Very high	75.7	Confident	8 Å²	8	26 Å²	26	6%	0.056	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	140.8	169.7	50.8	0	0	0	0	109.7	F5 D359 G458	F5-S422 WeakPolarHBondContact O-CB 3.41Å; F5-S422 PolarHBondContact O-OG 2.68Å; F5-S422 VanDerWaalsContact O-OG 3.08Å; D359-S422 VanDerWaalsContact OD2-CA 3.28Å; D359-S422 WeakPolarHBondContact OD2-CA 3.19Å; S422-G458 PolarHBondContact O-N 3.28Å
423	I	88.8	Confident	74	Confident	12 Å²	12	27.7 Å²	27.7	6%	0.062	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	139.1	-178.9	-48.1	172.7	0	0	0	109.2	D359 A361 I375 V389 I455 F456 V457	D359-I423 PolarHBondContact OD2-N 3.23Å; A361-I423 HydrophobicContact CB-CB 4.01Å; A361-I423 HydrophobicContact CB-CG2 3.87Å; I375-I423 HydrophobicContact CD1-CG2 4.43Å; I375-I423 HydrophobicContact CG1-CD1 4.36Å; I375-I423 HydrophobicContact CG2-CB 4.47Å; I375-I423 HydrophobicContact CG2-CD1 4.39Å; I375-I423 HydrophobicContact CG2-CG2 3.5Å; I375-I423 VanDerWaalsContact CG2-CG2 3.5Å; V389-I423 HydrophobicContact CG1-CD1 3.91Å; I423-I455 HydrophobicContact CG2-CG2 4.2Å; I423-F456 CarbonylContact C-O 3.59Å; I423-F456 WeakPolarHBondContact CA-O 3.2Å; I423-V457 HydrophobicContact CG2-CG2 4.33Å
424	S	84.2	Confident	71.8	Confident	16 Å²	16	27.4 Å²	27.4	11%	0.112	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	138.9	170.6	176.5	0	0	0	0	108.4	Q9 F456	Q9-S424 PolarHBondContact N-OG 2.72Å; S424-F456 PolarHBondContact N-O 3.07Å; S424-F456 PolarHBondContact O-N 2.87Å
425	G	72.7	Confident	69	Low	16 Å²	16	26.1 Å²	26.1	17%	0.165	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	-170.9	176.6	0	0	0	0	0	110.4	T362 D454	T362-G425 CarbonylContact O-C 3.25Å; T362-G425 WeakPolarHBondContact O-CA 3.38Å; G425-D454 WeakPolarHBondContact CA-O 3.46Å
426	G	64.4	Low	66.2	Low	35 Å²	35	25.2 Å²	25.2	36%	0.361	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	89.4	-0.6	177.1	0	0	0	0	0	114.9	T362 A453	T362-G426 PolarHBondContact O-N 2.92Å; G426-A453 VanDerWaalsContact N-CB 3.27Å
427	I	62.7	Low	63.4	Low	29 Å²	29	33.8 Å²	33.8	15%	0.149	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	130.9	176.6	-61.1	173.2	0	0	0	110.7	Q9 N11 V429 D454	Q9-I427 HydrophobicContact CB-CB 3.87Å; Q9-I427 HydrophobicContact CB-CD1 3.88Å; Q9-I427 HydrophobicContact CB-CG1 4.35Å; Q9-I427 HydrophobicContact CB-CG2 4.26Å; Q9-I427 VanDerWaalsContact O-CD1 3.26Å; Q9-I427 WeakPolarHBondContact O-CD1 3.46Å; N11-I427 VanDerWaalsContact OD1-CG2 3.31Å; N11-I427 WeakPolarHBondContact OD1-CG2 3.24Å; I427-V429 PolarHBondContact O-N 2.78Å; I427-D454 PolarHBondContact O-N 2.96Å
428	D	53.9	Low	60.4	Low	2 Å²	2	38.3 Å²	38.3	1%	0.011	24%	0.236	C	C	.	.			trans	-76.9	108.8	171.4	172.7	13.9	0	0	0	109.7	D430 G431 N432 E433 Y434 P435	D428-D430 PolarHBondContact OD1-N 2.91Å; D428-G431 PolarHBondContact OD1-N 3.42Å; D428-N432 PolarHBondContact OD1-N 3.38Å; D428-N432 PolarHBondContact OD1-ND2 2.89Å; D428-N432 PolarHBondContact OD2-N 3Å; D428-N432 VanDerWaalsContact OD2-N 3.16Å; D428-E433 PolarHBondContact OD2-N 3.24Å; D428-E433 VanDerWaalsContact OD2-N 3.16Å; D428-Y434 PolarHBondContact OD2-N 2.98Å; D428-P435 HydrophobicContact CB-CG 3.96Å
429	V	48.7	Very low	57.3	Low	4 Å²	4	43.8 Å²	43.8	2%	0.024	27%	0.274	C	S	.	.	S	Bend	trans	-91.2	-19.3	-171.1	-178.7	0	0	0	0	112.7	Q9 P42 L44 P69 I427 D454 L467	Q9-V429 HydrophobicContact CB-CG2 4.35Å; Q9-V429 HydrophobicContact CG-CG2 3.94Å; P42-V429 WeakPolarHBondContact CD-O 3.38Å; P42-V429 HydrophobicContact CG-CB 4.22Å; P42-V429 HydrophobicContact CG-CG1 4.05Å; P42-V429 WeakPolarHBondContact CG-O 3.35Å; L44-V429 HydrophobicContact CD2-CG1 4.05Å; L44-V429 HydrophobicContact CD2-CG2 3.96Å; L44-V429 HydrophobicContact CG-CG1 4.3Å; P69-V429 HydrophobicContact CB-CG1 4.4Å; P69-V429 HydrophobicContact CG-CG1 3.5Å; P69-V429 VanDerWaalsContact CG-CG1 3.5Å; I427-V429 PolarHBondContact O-N 2.78Å; V429-D454 VanDerWaalsContact CA-OD2 3.31Å; V429-D454 WeakPolarHBondContact CA-OD2 3.26Å; V429-D454 HydrophobicContact CB-CB 4.3Å; V429-D454 WeakPolarHBondContact CB-OD2 3.34Å; V429-D454 HydrophobicContact CG2-CB 4.01Å; V429-D454 PolarHBondContact N-OD2 2.82Å; V429-L467 HydrophobicContact CG2-CD1 4.48Å
430	D	49.5	Very low	54.3	Low	52 Å²	52	50.9 Å²	50.9	28%	0.278	31%	0.311	S	S	.	.	S	Bend	trans	-99.5	4	177.2	68.2	6.8	0	0	0	113.2	D428 N432	D428-D430 PolarHBondContact OD1-N 2.91Å; D430-N432 PolarHBondContact O-N 2.82Å; D430-N432 VanDerWaalsContact OD1-CB 3.22Å; D430-N432 WeakPolarHBondContact OD1-CB 3.26Å; D430-N432 VanDerWaalsContact OD1-CG 3.23Å; D430-N432 PolarHBondContact OD1-N 2.61Å; D430-N432 PolarHBondContact OD1-ND2 2.78Å
431	G	46.5	Very low	51.4	Low	44 Å²	44	57 Å²	57	45%	0.454	35%	0.348	S	S	.	.			trans	60.9	32	175.1	0	0	0	0	0	111.4	D428 E433	D428-G431 PolarHBondContact OD1-N 3.42Å; G431-E433 PolarHBondContact O-N 3.13Å
432	N	44.9	Very low	48.3	Very low	15 Å²	15	68 Å²	68	8%	0.08	39%	0.39	C	S	.	.	S	Bend	trans	-68.8	8.9	176.7	72.1	54	0	0	0	113.6	D428 D430 Y470 K472	D428-N432 PolarHBondContact OD1-N 3.38Å; D428-N432 PolarHBondContact OD1-ND2 2.89Å; D428-N432 PolarHBondContact OD2-N 3Å; D428-N432 VanDerWaalsContact OD2-N 3.16Å; D430-N432 PolarHBondContact O-N 2.82Å; D430-N432 VanDerWaalsContact OD1-CB 3.22Å; D430-N432 WeakPolarHBondContact OD1-CB 3.26Å; D430-N432 VanDerWaalsContact OD1-CG 3.23Å; D430-N432 PolarHBondContact OD1-N 2.61Å; D430-N432 PolarHBondContact OD1-ND2 2.78Å; N432-Y470 PolarHBondContact ND2-O 3.36Å; N432-K472 HydrophobicContact CB-CB 3.79Å; N432-K472 HydrophobicContact CB-CD 4.39Å; N432-K472 WeakPolarHBondContact O-CD 3.26Å; N432-K472 PolarHBondContact O-NZ 3.3Å
433	E	46	Very low	45.5	Very low	81 Å²	81	75.9 Å²	75.9	38%	0.379	42%	0.424	S	S	.	.	S	Bend	trans	84.4	57.2	174.3	-79	-166.9	179.6	0	0	115.5	D428 G431 T536	D428-E433 PolarHBondContact OD2-N 3.24Å; D428-E433 VanDerWaalsContact OD2-N 3.16Å; G431-E433 PolarHBondContact O-N 3.13Å; E433-T536 HydrophobicContact CB-CG2 4.11Å; E433-T536 HydrophobicContact CG-CG2 3.47Å; E433-T536 VanDerWaalsContact CG-CG2 3.47Å; E433-T536 WeakPolarHBondContact OE1-CB 3.29Å; E433-T536 WeakPolarHBondContact OE1-CG2 3.39Å; E433-T536 WeakPolarHBondContact OE2-CA 3.49Å; E433-T536 VanDerWaalsContact OE2-CB 3.29Å; E433-T536 WeakPolarHBondContact OE2-CB 3.47Å; E433-T536 WeakPolarHBondContact OE2-CG2 3.45Å
434	Y	37.2	Very low	43	Very low	38 Å²	38	84.5 Å²	84.5	15%	0.149	46%	0.461	C	S	.	.			trans	-135.2	36.3	163.4	-78.2	-63.5	0	0	0	117.3	D428 F450 L452 C534	D428-Y434 PolarHBondContact OD2-N 2.98Å; Y434-F450 HydrophobicContact CD1-CB 4.27Å; Y434-F450 WeakPolarHBondContact CD1-O 3.41Å; Y434-F450 HydrophobicContact CE1-CB 3.56Å; Y434-F450 VanDerWaalsContact CE1-O 3.25Å; Y434-F450 WeakPolarHBondContact CE1-O 3.34Å; Y434-L452 HydrophobicContact CD2-CB 3.87Å; Y434-L452 HydrophobicContact CD2-CD1 3.49Å; Y434-L452 VanDerWaalsContact CD2-CD1 3.49Å; Y434-L452 HydrophobicContact CD2-CG 3.99Å; Y434-L452 HydrophobicContact CE2-CD1 3.37Å; Y434-L452 HydrophobicContact CE2-CG 4.23Å; Y434-L452 HydrophobicContact CG-CB 4.18Å; Y434-L452 HydrophobicContact CG-CD1 4.4Å; Y434-L452 HydrophobicContact CG-CG 4.48Å; Y434-C534 HydrophobicContact CE2-CB 4.39Å; Y434-C534 PolarHBondContact OH-SG 2.93Å
435	P	27.6	Very low	40.5	Very low	54 Å²	54	92 Å²	92	35%	0.351	50%	0.5	S	S	.	.	S	Bend	trans	-145.9	99.8	139.2	28.1	-4.9	0	0	0	111.2	D428	D428-P435 HydrophobicContact CB-CG 3.96Å
436	G	27.6	Very low	38.5	Very low	64 Å²	64	102 Å²	102	66%	0.66	53%	0.532	S	S	*	.			trans	151.7	18.7	170.6	0	0	0	0	0	120.6	I438	G436-I438 PolarHBondContact O-N 3.5Å; G436-I438 VanDerWaalsContact O-N 3.12Å
437	M	29	Very low	36.9	Very low	182 Å²	182	106.1 Å²	106.1	90%	0.897	55%	0.553	S	S	*	*			trans	-82.8	100.6	175.8	-149	179.5	78.7	0	0	112.7	S439	M437-S439 PolarHBondContact O-N 3.08Å
438	I	29.8	Very low	35.4	Very low	134 Å²	134	109.1 Å²	109.1	69%	0.687	57%	0.573	S	S	*	*			trans	-34.7	125	165.6	-70.1	157.8	0	0	0	112.7	G436 L440	G436-I438 PolarHBondContact O-N 3.5Å; G436-I438 VanDerWaalsContact O-N 3.12Å; I438-L440 HydrophobicContact CG2-CB 4.44Å; I438-L440 HydrophobicContact CG2-CD1 4.12Å; I438-L440 HydrophobicContact CG2-CG 4.12Å; I438-L440 PolarHBondContact O-N 3.49Å
439	S	26.7	Very low	34.4	Very low	120 Å²	120	114.2 Å²	114.2	84%	0.839	60%	0.604	S	S	*	*	S	Bend	trans	-55.9	89.7	168.5	-170.4	0	0	0	0	111.7	M437	M437-S439 PolarHBondContact O-N 3.08Å
440	L	26.8	Very low	33.7	Very low	149 Å²	149	117.4 Å²	117.4	78%	0.78	62%	0.618	S	S	*	*			trans	-146	45.5	171.3	-87.8	179.1	0	0	0	112.9	I438	I438-L440 HydrophobicContact CG2-CB 4.44Å; I438-L440 HydrophobicContact CG2-CD1 4.12Å; I438-L440 HydrophobicContact CG2-CG 4.12Å; I438-L440 PolarHBondContact O-N 3.49Å
441	V	29.7	Very low	33.2	Very low	128 Å²	128	119 Å²	119	78%	0.776	62%	0.623	S	S	*	*			trans	-140.6	90.1	156.3	-171.4	0	0	0	0	110.3	F443	V441-F443 VanDerWaalsContact C-N 3.34Å; V441-F443 HydrophobicContact CG1-CB 4.28Å; V441-F443 PolarHBondContact O-N 3.21Å
442	R	27.6	Very low	33	Very low	244 Å²	244	117.2 Å²	117.2	92%	0.921	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	86.5	161.5	-73.8	-178.7	175.1	178.6	-1.6	108.7
443	F	32.4	Very low	33.5	Very low	174 Å²	174	116.7 Å²	116.7	76%	0.763	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.1	-5.7	162.9	-113.4	-78.3	0	0	0	117.4	V441	V441-F443 VanDerWaalsContact C-N 3.34Å; V441-F443 HydrophobicContact CG1-CB 4.28Å; V441-F443 PolarHBondContact O-N 3.21Å
444	F	34.8	Very low	34.5	Very low	194 Å²	194	112.9 Å²	112.9	85%	0.851	58%	0.584	S	S	*	*	S	Bend	trans	-144.8	132.9	164.8	-78.7	-82.2	0	0	0	110.3	R446	F444-R446 PolarHBondContact O-N 3.3Å
445	N	31.3	Very low	36.3	Very low	172 Å²	172	111.7 Å²	111.7	92%	0.92	58%	0.58	S	S	*	*	S	Bend	trans	-64.2	103.9	178.6	-80.8	-27.9	0	0	0	110.4
446	R	32.2	Very low	39	Very low	226 Å²	226	109.5 Å²	109.5	85%	0.853	57%	0.565	S	S	*	*			trans	121.4	105.5	166.2	-69.7	-175.4	-174.2	-148.8	1	112.3	F444 V448	F444-R446 PolarHBondContact O-N 3.3Å; R446-V448 PolarHBondContact O-N 2.95Å
447	P	30.1	Very low	41.8	Very low	122 Å²	122	106.5 Å²	106.5	79%	0.792	53%	0.533	S	S	*	.			trans	-70.4	121.6	168.5	28.5	-29.3	0	0	0	109.3
448	V	31.1	Very low	44.5	Very low	93 Å²	93	97.8 Å²	97.8	56%	0.564	49%	0.49	S	S	*	.			trans	-90.3	105.8	166.3	179.5	0	0	0	0	106.4	R446 F450	R446-V448 PolarHBondContact O-N 2.95Å; V448-F450 HydrophobicContact CG1-CD2 4.47Å; V448-F450 HydrophobicContact CG1-CE2 4Å; V448-F450 HydrophobicContact CG1-CZ 4.06Å
449	T	32.6	Very low	47.3	Very low	109 Å²	109	91.4 Å²	91.4	67%	0.669	46%	0.458	S	S	*	.			trans	-88.9	109.2	176.3	-26	0	0	0	0	107.3
450	F	34.8	Very low	50.2	Low	71 Å²	71	88.4 Å²	88.4	31%	0.311	43%	0.428	S	S	.	.			trans	-73.8	135.8	165.2	-63.5	-87.4	0	0	0	106.8	D365 G368 Y434 V448	D365-F450 WeakPolarHBondContact OD2-CD1 3.38Å; G368-F450 WeakPolarHBondContact O-CE1 3.42Å; Y434-F450 HydrophobicContact CD1-CB 4.27Å; Y434-F450 WeakPolarHBondContact CD1-O 3.41Å; Y434-F450 HydrophobicContact CE1-CB 3.56Å; Y434-F450 VanDerWaalsContact CE1-O 3.25Å; Y434-F450 WeakPolarHBondContact CE1-O 3.34Å; V448-F450 HydrophobicContact CG1-CD2 4.47Å; V448-F450 HydrophobicContact CG1-CE2 4Å; V448-F450 HydrophobicContact CG1-CZ 4.06Å
451	Q	37.9	Very low	53.2	Low	84 Å²	84	88.2 Å²	88.2	39%	0.393	42%	0.421	S	S	.	.			trans	-125.8	104.5	175.2	-80.7	178.7	-14.5	0	0	107.4	G364 D365	G364-Q451 CarbonylContact C-O 3.6Å; D365-Q451 PolarHBondContact N-O 2.89Å
452	L	42.8	Very low	55.9	Low	8 Å²	8	83.3 Å²	83.3	4%	0.042	39%	0.393	C	S	.	.	B	Isolated β-bridge	trans	-96.8	123.6	173.3	-70.9	162.7	0	0	0	107.8	D365 L366 Y434 Y470	D365-L452 WeakPolarHBondContact O-CD2 3.39Å; L366-L452 WeakPolarHBondContact O-CD2 3.41Å; Y434-L452 HydrophobicContact CD2-CB 3.87Å; Y434-L452 HydrophobicContact CD2-CD1 3.49Å; Y434-L452 VanDerWaalsContact CD2-CD1 3.49Å; Y434-L452 HydrophobicContact CD2-CG 3.99Å; Y434-L452 HydrophobicContact CE2-CD1 3.37Å; Y434-L452 HydrophobicContact CE2-CG 4.23Å; Y434-L452 HydrophobicContact CG-CB 4.18Å; Y434-L452 HydrophobicContact CG-CD1 4.4Å; Y434-L452 HydrophobicContact CG-CG 4.48Å; L452-Y470 HydrophobicContact CB-CD1 4.05Å; L452-Y470 HydrophobicContact CB-CE1 4.28Å; L452-Y470 HydrophobicContact CB-CG 4.26Å; L452-Y470 HydrophobicContact CD1-CD1 3.91Å; L452-Y470 HydrophobicContact CD1-CE1 3.29Å; L452-Y470 HydrophobicContact CD1-CE2 4.4Å; L452-Y470 HydrophobicContact CD2-CD1 4.38Å; L452-Y470 HydrophobicContact CD2-CD2 3.97Å; L452-Y470 HydrophobicContact CD2-CE1 3.99Å; L452-Y470 HydrophobicContact CD2-CE2 3.56Å; L452-Y470 HydrophobicContact CD2-CG 4.42Å; L452-Y470 HydrophobicContact CG-CD1 4.33Å; L452-Y470 HydrophobicContact CG-CE1 4.05Å; L452-Y470 HydrophobicContact CG-CE2 4.46Å
453	A	55.5	Low	58.7	Low	4 Å²	4	78.1 Å²	78.1	3%	0.033	38%	0.383	C	S	.	.			trans	-119.2	150.5	-177.8	0	0	0	0	0	113.1	T363 G426	T363-A453 WeakPolarHBondContact O-CB 3.43Å; G426-A453 VanDerWaalsContact N-CB 3.27Å
454	D	66.4	Low	61.3	Low	1 Å²	1	75.5 Å²	75.5	1%	0.005	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	152.5	168.4	-66	-31.5	0	0	0	110.3	Q9 G425 I427 V429 L467 F468 K469 Y470	Q9-D454 PolarHBondContact NE2-O 3.42Å; Q9-D454 PolarHBondContact OE1-O 3.33Å; G425-D454 WeakPolarHBondContact CA-O 3.46Å; I427-D454 PolarHBondContact O-N 2.96Å; V429-D454 VanDerWaalsContact CA-OD2 3.31Å; V429-D454 WeakPolarHBondContact CA-OD2 3.26Å; V429-D454 HydrophobicContact CB-CB 4.3Å; V429-D454 WeakPolarHBondContact CB-OD2 3.34Å; V429-D454 HydrophobicContact CG2-CB 4.01Å; V429-D454 PolarHBondContact N-OD2 2.82Å; D454-L467 HydrophobicContact CB-CD1 3.98Å; D454-F468 WeakPolarHBondContact CA-O 3.31Å; D454-K469 VanDerWaalsContact OD1-CA 3.27Å; D454-K469 WeakPolarHBondContact OD1-CA 3.13Å; D454-Y470 PolarHBondContact OD1-N 3.31Å
455	I	76.4	Confident	63.6	Low	13 Å²	13	68 Å²	68	7%	0.067	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	129.1	-177.3	-55.7	175.4	0	0	0	109	T363 L366 I375 I391 I423 V457 L467 F468	T363-I455 HydrophobicContact CG2-CD1 3.85Å; T363-I455 HydrophobicContact CG2-CG1 3.88Å; L366-I455 HydrophobicContact CD1-CD1 4.11Å; L366-I455 HydrophobicContact CD2-CD1 4.26Å; I375-I455 HydrophobicContact CD1-CD1 4.2Å; I375-I455 HydrophobicContact CD1-CG2 3.57Å; I391-I455 HydrophobicContact CD1-CD1 4.36Å; I423-I455 HydrophobicContact CG2-CG2 4.2Å; I455-V457 HydrophobicContact CG2-CG2 3.95Å; I455-L467 WeakPolarHBondContact O-CA 3.47Å; I455-F468 HydrophobicContact CB-CB 4.34Å; I455-F468 PolarHBondContact N-O 3.28Å; I455-F468 VanDerWaalsContact N-O 3.08Å; I455-F468 PolarHBondContact O-N 2.74Å
456	F	83.8	Confident	66.1	Low	8 Å²	8	61 Å²	61	4%	0.035	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	119.3	-178.7	-165.2	-145.2	0	0	0	111	L7 Q9 L44 V46 I423 S424 A465 V466 L467	L7-F456 HydrophobicContact CB-CD1 3.59Å; L7-F456 HydrophobicContact CB-CE1 3.85Å; L7-F456 HydrophobicContact CB-CG 4.45Å; L7-F456 HydrophobicContact CD1-CD1 3.72Å; L7-F456 HydrophobicContact CD1-CD2 4.31Å; L7-F456 HydrophobicContact CD1-CE1 3.92Å; L7-F456 HydrophobicContact CD1-CE2 4.48Å; L7-F456 HydrophobicContact CD1-CG 3.91Å; L7-F456 HydrophobicContact CD1-CZ 4.29Å; L7-F456 HydrophobicContact CD2-CD1 4.06Å; L7-F456 HydrophobicContact CD2-CE1 3.48Å; L7-F456 VanDerWaalsContact CD2-CE1 3.48Å; L7-F456 HydrophobicContact CD2-CZ 3.85Å; L7-F456 HydrophobicContact CG-CD1 3.99Å; L7-F456 HydrophobicContact CG-CE1 3.94Å; Q9-F456 HydrophobicContact CG-CB 4.42Å; L44-F456 HydrophobicContact CB-CE1 4.39Å; L44-F456 HydrophobicContact CD1-CE2 4.24Å; L44-F456 HydrophobicContact CD1-CZ 4.25Å; L44-F456 HydrophobicContact CD2-CD1 4.44Å; V46-F456 HydrophobicContact CG2-CE1 3.79Å; V46-F456 HydrophobicContact CG2-CZ 3.64Å; I423-F456 CarbonylContact C-O 3.59Å; I423-F456 WeakPolarHBondContact CA-O 3.2Å; S424-F456 PolarHBondContact N-O 3.07Å; S424-F456 PolarHBondContact O-N 2.87Å; F456-A465 HydrophobicContact CD2-CB 4.28Å; F456-A465 HydrophobicContact CE1-CB 4.23Å; F456-A465 HydrophobicContact CE2-CB 3.36Å; F456-A465 HydrophobicContact CZ-CB 3.31Å; F456-V466 WeakPolarHBondContact CA-O 3.31Å; F456-V466 WeakPolarHBondContact CD2-O 3.38Å; F456-L467 HydrophobicContact CB-CD1 4.24Å; F456-L467 HydrophobicContact CD2-CB 4.01Å; F456-L467 HydrophobicContact CD2-CD1 4.21Å; F456-L467 HydrophobicContact CE2-CB 4.4Å; F456-L467 HydrophobicContact CG-CD1 4.47Å
457	V	86.6	Confident	68.4	Low	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	129.7	-170.6	-174.5	0	0	0	0	111.7	V389 F419 G420 I423 I455 A465 V466 F468	V389-V457 HydrophobicContact CG1-CG1 3.79Å; V389-V457 HydrophobicContact CG1-CG2 4.18Å; F419-V457 HydrophobicContact CD1-CG1 4.35Å; F419-V457 HydrophobicContact CD2-CB 4.37Å; F419-V457 HydrophobicContact CD2-CG1 3.71Å; F419-V457 HydrophobicContact CE1-CG1 4.11Å; F419-V457 HydrophobicContact CE2-CB 3.67Å; F419-V457 HydrophobicContact CE2-CG1 3.41Å; F419-V457 VanDerWaalsContact CE2-CG1 3.41Å; F419-V457 HydrophobicContact CE2-CG2 4.43Å; F419-V457 HydrophobicContact CG-CG1 4.17Å; F419-V457 HydrophobicContact CZ-CB 3.93Å; F419-V457 HydrophobicContact CZ-CG1 3.63Å; F419-V457 HydrophobicContact CZ-CG2 4.22Å; G420-V457 VanDerWaalsContact N-CG1 3.34Å; I423-V457 HydrophobicContact CG2-CG2 4.33Å; I455-V457 HydrophobicContact CG2-CG2 3.95Å; V457-A465 CarbonylContact O-C 3.47Å; V457-A465 VanDerWaalsContact O-CA 3.32Å; V457-A465 WeakPolarHBondContact O-CA 3.06Å; V457-V466 PolarHBondContact N-O 3.22Å; V457-V466 PolarHBondContact O-N 2.95Å; V457-F468 HydrophobicContact CB-CE2 4.39Å; V457-F468 HydrophobicContact CG2-CD2 4.2Å; V457-F468 HydrophobicContact CG2-CE2 3.88Å
458	G	86.1	Confident	70.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	143.2	-175.9	0	0	0	0	0	113	L7 G420 W421 S422	L7-G458 VanDerWaalsContact CD1-CA 3.41Å; G420-G458 PolarHBondContact N-O 2.95Å; G420-G458 VanDerWaalsContact N-O 3.07Å; W421-G458 PolarHBondContact N-O 3.45Å; S422-G458 PolarHBondContact O-N 3.28Å
459	A	88.6	Confident	71.9	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	76.8	176.9	0	0	0	0	0	109	L416 T417 F419 K461 S462 D463 R464	L416-A459 HydrophobicContact CD2-CB 3.84Å; T417-A459 WeakPolarHBondContact O-CB 3.49Å; F419-A459 HydrophobicContact CB-CB 4.41Å; A459-K461 VanDerWaalsContact C-N 3.31Å; A459-K461 PolarHBondContact O-N 2.8Å; A459-S462 PolarHBondContact O-N 2.87Å; A459-D463 PolarHBondContact O-N 3.19Å; A459-R464 PolarHBondContact N-O 2.96Å; A459-R464 PolarHBondContact O-N 3.03Å
460	Y	87.8	Confident	72.8	Confident	56 Å²	56	40.5 Å²	40.5	22%	0.22	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-58.6	-39.8	-166.4	82.6	-91.2	0	0	0	113.7	D4 F5 T418 W421 S462 D463	D4-Y460 HydrophobicContact CB-CD2 3.64Å; D4-Y460 HydrophobicContact CB-CE2 3.91Å; D4-Y460 HydrophobicContact CB-CG 4.03Å; F5-Y460 VanDerWaalsContact CB-CB 3.46Å; T418-Y460 HydrophobicContact CG2-CD1 4.1Å; T418-Y460 HydrophobicContact CG2-CE1 3.54Å; T418-Y460 VanDerWaalsContact OG1-CD1 3.23Å; T418-Y460 WeakPolarHBondContact OG1-CD1 3.22Å; T418-Y460 PolarHBondContact OG1-N 3.03Å; W421-Y460 HydrophobicContact CB-CD1 4.1Å; W421-Y460 AromaticContact CD1-CD1 3.89Å; W421-Y460 AromaticContact CD2-CD1 3.59Å; W421-Y460 HydrophobicContact CD2-CD1 3.59Å; W421-Y460 AromaticContact CD2-CE1 3.56Å; W421-Y460 HydrophobicContact CD2-CE1 3.56Å; W421-Y460 AromaticContact CE2-CD1 3.78Å; W421-Y460 AromaticContact CE2-CE1 3.7Å; W421-Y460 HydrophobicContact CE3-CD1 4.11Å; W421-Y460 AromaticContact CE3-CE1 3.66Å; W421-Y460 HydrophobicContact CE3-CE1 3.66Å; W421-Y460 AromaticContact CG-CD1 3.6Å; W421-Y460 HydrophobicContact CG-CD1 3.6Å; W421-Y460 HydrophobicContact CG-CE1 4.09Å; W421-Y460 AromaticContact CH2-CE1 3.93Å; W421-Y460 HydrophobicContact CH2-CE1 3.93Å; W421-Y460 HydrophobicContact CZ2-CD1 4.32Å; W421-Y460 AromaticContact CZ2-CE1 3.81Å; W421-Y460 HydrophobicContact CZ2-CE1 3.81Å; W421-Y460 AromaticContact CZ3-CE1 3.88Å; W421-Y460 HydrophobicContact CZ3-CE1 3.88Å; W421-Y460 AromaticContact NE1-CD1 3.99Å; Y460-S462 PolarHBondContact O-N 3.08Å; Y460-D463 PolarHBondContact O-N 3.2Å
461	K	88	Confident	72.9	Confident	146 Å²	146	40.4 Å²	40.4	64%	0.635	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	-69	-18.1	-178.1	-171.7	173.9	-177	178	0	112.7	T417 T418 A459	T417-K461 WeakPolarHBondContact OG1-CB 3.36Å; T418-K461 HydrophobicContact CG2-CB 3.79Å; T418-K461 HydrophobicContact CG2-CD 4.22Å; T418-K461 WeakPolarHBondContact OG1-CB 3.31Å; T418-K461 PolarHBondContact OG1-N 2.97Å; T418-K461 VanDerWaalsContact OG1-N 3.11Å; A459-K461 VanDerWaalsContact C-N 3.31Å; A459-K461 PolarHBondContact O-N 2.8Å
462	S	87.3	Confident	72.7	Confident	25 Å²	25	37.8 Å²	37.8	18%	0.175	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-99.8	2	174.9	-64.4	0	0	0	0	113	T415 L416 T417 A459 Y460 R464	T415-S462 PolarHBondContact O-OG 3.28Å; L416-S462 WeakPolarHBondContact CA-OG 3.44Å; T417-S462 PolarHBondContact N-OG 2.62Å; T417-S462 PolarHBondContact OG1-OG 3.49Å; A459-S462 PolarHBondContact O-N 2.87Å; Y460-S462 PolarHBondContact O-N 3.08Å; S462-R464 WeakPolarHBondContact O-CG 3.29Å; S462-R464 PolarHBondContact O-N 2.93Å
463	D	87	Confident	72.3	Confident	135 Å²	135	39.7 Å²	39.7	72%	0.722	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.5	37.5	-174.7	-61.1	-52	0	0	0	113.2	A459 Y460	A459-D463 PolarHBondContact O-N 3.19Å; Y460-D463 PolarHBondContact O-N 3.2Å
464	R	85.8	Confident	71.3	Confident	119 Å²	119	47.6 Å²	47.6	45%	0.449	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	152.9	-173.6	-75.9	178.6	-176.6	-165.3	4.2	112.5	D413 L416 A459 S462	D413-R464 IonicContact OD2-CZ 2.62Å; D413-R464 IonicContact OD2-NH1 3.97Å; D413-R464 PolarHBondContact OD2-NH1 3.07Å; L416-R464 HydrophobicContact CD2-CB 3.89Å; A459-R464 PolarHBondContact N-O 2.96Å; A459-R464 PolarHBondContact O-N 3.03Å; S462-R464 WeakPolarHBondContact O-CG 3.29Å; S462-R464 PolarHBondContact O-N 2.93Å
465	A	83.8	Confident	69.5	Low	36 Å²	36	54.4 Å²	54.4	30%	0.298	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	146.1	168.7	0	0	0	0	0	109	L7 F456 V457	L7-A465 HydrophobicContact CD1-CB 3.91Å; L7-A465 HydrophobicContact CD2-CB 3.59Å; L7-A465 HydrophobicContact CG-CB 4.44Å; F456-A465 HydrophobicContact CD2-CB 4.28Å; F456-A465 HydrophobicContact CE1-CB 4.23Å; F456-A465 HydrophobicContact CE2-CB 3.36Å; F456-A465 HydrophobicContact CZ-CB 3.31Å; V457-A465 CarbonylContact O-C 3.47Å; V457-A465 VanDerWaalsContact O-CA 3.32Å; V457-A465 WeakPolarHBondContact O-CA 3.06Å
466	V	84.7	Confident	67.4	Low	24 Å²	24	63 Å²	63	15%	0.145	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	124.3	-174.4	-179.3	0	0	0	0	108.6	V412 L416 F419 F456 V457 F468	V412-V466 HydrophobicContact CG1-CG1 3.8Å; V412-V466 HydrophobicContact CG1-CG2 4.08Å; L416-V466 HydrophobicContact CD1-CG2 3.92Å; F419-V466 HydrophobicContact CE2-CB 4.16Å; F419-V466 HydrophobicContact CE2-CG2 4.1Å; F456-V466 WeakPolarHBondContact CA-O 3.31Å; F456-V466 WeakPolarHBondContact CD2-O 3.38Å; V457-V466 PolarHBondContact N-O 3.22Å; V457-V466 PolarHBondContact O-N 2.95Å; V466-F468 HydrophobicContact CB-CE2 4.34Å; V466-F468 HydrophobicContact CG1-CD2 4.31Å; V466-F468 HydrophobicContact CG1-CE1 4.35Å; V466-F468 HydrophobicContact CG1-CE2 3.77Å; V466-F468 HydrophobicContact CG1-CZ 3.8Å
467	L	80	Confident	64.6	Low	29 Å²	29	67.6 Å²	67.6	15%	0.152	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	123.8	173	-177.7	75.6	0	0	0	109.5	L44 P69 V429 D454 I455 F456 K469	L44-L467 HydrophobicContact CD1-CD1 4.23Å; L44-L467 HydrophobicContact CD1-CD2 4.09Å; L44-L467 HydrophobicContact CD2-CD1 4.33Å; P69-L467 HydrophobicContact CB-CD2 4.14Å; V429-L467 HydrophobicContact CG2-CD1 4.48Å; D454-L467 HydrophobicContact CB-CD1 3.98Å; I455-L467 WeakPolarHBondContact O-CA 3.47Å; F456-L467 HydrophobicContact CB-CD1 4.24Å; F456-L467 HydrophobicContact CD2-CB 4.01Å; F456-L467 HydrophobicContact CD2-CD1 4.21Å; F456-L467 HydrophobicContact CE2-CB 4.4Å; F456-L467 HydrophobicContact CG-CD1 4.47Å; L467-K469 HydrophobicContact CD2-CD 4.23Å; L467-K469 HydrophobicContact CD2-CG 3.69Å; L467-K469 HydrophobicContact CG-CG 4.06Å
468	F	73.2	Confident	62.1	Low	23 Å²	23	75 Å²	75	10%	0.101	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	115	167.3	-61.6	-86.2	0	0	0	108.1	I407 V412 F419 D454 I455 V457 V466 N482	I407-F468 HydrophobicContact CD1-CD1 4.44Å; I407-F468 HydrophobicContact CD1-CE1 4.15Å; I407-F468 HydrophobicContact CD1-CZ 4.29Å; I407-F468 HydrophobicContact CG2-CE1 4.15Å; I407-F468 HydrophobicContact CG2-CZ 3.93Å; V412-F468 HydrophobicContact CG2-CE1 4.07Å; V412-F468 HydrophobicContact CG2-CZ 3.74Å; F419-F468 HydrophobicContact CE2-CE2 4.31Å; F419-F468 HydrophobicContact CE2-CZ 4.41Å; F419-F468 AromaticContact CZ-CE2 3.85Å; F419-F468 HydrophobicContact CZ-CE2 3.85Å; F419-F468 AromaticContact CZ-CZ 3.84Å; F419-F468 HydrophobicContact CZ-CZ 3.84Å; D454-F468 WeakPolarHBondContact CA-O 3.31Å; I455-F468 HydrophobicContact CB-CB 4.34Å; I455-F468 PolarHBondContact N-O 3.28Å; I455-F468 VanDerWaalsContact N-O 3.08Å; I455-F468 PolarHBondContact O-N 2.74Å; V457-F468 HydrophobicContact CB-CE2 4.39Å; V457-F468 HydrophobicContact CG2-CD2 4.2Å; V457-F468 HydrophobicContact CG2-CE2 3.88Å; V466-F468 HydrophobicContact CB-CE2 4.34Å; V466-F468 HydrophobicContact CG1-CD2 4.31Å; V466-F468 HydrophobicContact CG1-CE1 4.35Å; V466-F468 HydrophobicContact CG1-CE2 3.77Å; V466-F468 HydrophobicContact CG1-CZ 3.8Å; F468-N482 HydrophobicContact CD1-CB 4.44Å; F468-N482 HydrophobicContact CE1-CB 4.4Å
469	K	61.6	Low	59.4	Low	43 Å²	43	83.5 Å²	83.5	19%	0.187	41%	0.407	C	S	.	.			trans	-91.5	140.9	-177.4	-62.9	-176.3	-178.2	-178.4	0	111.9	P69 D454 L467 F471 S484	P69-K469 PolarHBondContact O-NZ 2.87Å; D454-K469 VanDerWaalsContact OD1-CA 3.27Å; D454-K469 WeakPolarHBondContact OD1-CA 3.13Å; L467-K469 HydrophobicContact CD2-CD 4.23Å; L467-K469 HydrophobicContact CD2-CG 3.69Å; L467-K469 HydrophobicContact CG-CG 4.06Å; K469-F471 PolarHBondContact O-N 2.55Å; K469-S484 PolarHBondContact O-N 3.5Å
470	Y	50	Low	56.6	Low	25 Å²	25	87.2 Å²	87.2	10%	0.098	45%	0.445	C	S	.	.			trans	-89	80.5	168.9	-168.8	-85.2	0	0	0	110.7	N432 L452 D454 K472 S484	N432-Y470 PolarHBondContact ND2-O 3.36Å; L452-Y470 HydrophobicContact CB-CD1 4.05Å; L452-Y470 HydrophobicContact CB-CE1 4.28Å; L452-Y470 HydrophobicContact CB-CG 4.26Å; L452-Y470 HydrophobicContact CD1-CD1 3.91Å; L452-Y470 HydrophobicContact CD1-CE1 3.29Å; L452-Y470 HydrophobicContact CD1-CE2 4.4Å; L452-Y470 HydrophobicContact CD2-CD1 4.38Å; L452-Y470 HydrophobicContact CD2-CD2 3.97Å; L452-Y470 HydrophobicContact CD2-CE1 3.99Å; L452-Y470 HydrophobicContact CD2-CE2 3.56Å; L452-Y470 HydrophobicContact CD2-CG 4.42Å; L452-Y470 HydrophobicContact CG-CD1 4.33Å; L452-Y470 HydrophobicContact CG-CE1 4.05Å; L452-Y470 HydrophobicContact CG-CE2 4.46Å; D454-Y470 PolarHBondContact OD1-N 3.31Å; Y470-K472 PolarHBondContact O-N 2.92Å; Y470-S484 VanDerWaalsContact CA-OG 3.22Å; Y470-S484 WeakPolarHBondContact CA-OG 3.49Å; Y470-S484 WeakPolarHBondContact CD2-OG 3.28Å; Y470-S484 VanDerWaalsContact CE2-OG 3.28Å; Y470-S484 WeakPolarHBondContact CE2-OG 3.36Å; Y470-S484 VanDerWaalsContact CG-OG 3.26Å
471	F	36.8	Very low	53.9	Low	69 Å²	69	88.7 Å²	88.7	30%	0.303	46%	0.456	S	S	.	.			trans	-79.8	119.4	-170.5	-158.2	-102.1	0	0	0	113.7	K469 K474 L633	K469-F471 PolarHBondContact O-N 2.55Å; F471-K474 WeakPolarHBondContact CZ-O 3.42Å; F471-L633 HydrophobicContact CB-CD1 3.66Å; F471-L633 HydrophobicContact CD1-CD1 4.34Å; F471-L633 HydrophobicContact CG-CD1 4.49Å; F471-L633 VanDerWaalsContact O-CD1 3.3Å; F471-L633 WeakPolarHBondContact O-CD1 3.33Å
472	K	35.6	Very low	51.3	Low	30 Å²	30	86.4 Å²	86.4	13%	0.13	45%	0.451	C	S	.	.			trans	-92.7	94.3	165.7	-166.1	-159.1	-134.9	142.6	0	109.5	N432 Y470 K474 V533 C534	N432-K472 HydrophobicContact CB-CB 3.79Å; N432-K472 HydrophobicContact CB-CD 4.39Å; N432-K472 WeakPolarHBondContact O-CD 3.26Å; N432-K472 PolarHBondContact O-NZ 3.3Å; Y470-K472 PolarHBondContact O-N 2.92Å; K472-K474 PolarHBondContact O-N 3.49Å; K472-V533 HydrophobicContact CD-CB 4.46Å; K472-V533 HydrophobicContact CD-CG1 3.72Å; K472-V533 HydrophobicContact CG-CB 3.96Å; K472-V533 HydrophobicContact CG-CG1 3.38Å; K472-V533 HydrophobicContact CG-CG2 3.89Å; K472-C534 WeakPolarHBondContact CE-O 3.42Å; K472-C534 PolarHBondContact NZ-O 2.78Å
473	S	33.6	Very low	49.4	Very low	47 Å²	47	88.2 Å²	88.2	33%	0.329	46%	0.457	S	S	.	.			trans	-14.4	96.6	177.5	-179.2	0	0	0	0	115.6
474	K	33.5	Very low	47.3	Very low	170 Å²	170	83.7 Å²	83.7	74%	0.739	44%	0.436	S	S	*	.			trans	-123.1	116.1	155.2	-137.4	178.7	-172.9	179.4	0	107.8	F471 K472 F476	F471-K474 WeakPolarHBondContact CZ-O 3.42Å; K472-K474 PolarHBondContact O-N 3.49Å; K474-F476 PolarHBondContact O-N 3.46Å; K474-F476 VanDerWaalsContact O-N 3.09Å
475	L	29.8	Very low	46	Very low	145 Å²	145	83.3 Å²	83.3	76%	0.759	43%	0.434	S	S	*	.			trans	-46.6	102.4	-178.9	-165.7	83.5	0	0	0	112.4
476	F	31.6	Very low	44.8	Very low	194 Å²	194	82.7 Å²	82.7	85%	0.851	43%	0.427	S	S	*	.			trans	-174.7	141.6	140.4	-119.9	-97.8	0	0	0	112.4	K474	K474-F476 PolarHBondContact O-N 3.46Å; K474-F476 VanDerWaalsContact O-N 3.09Å
477	T	25.9	Very low	43.7	Very low	104 Å²	104	83.1 Å²	83.1	64%	0.638	43%	0.43	S	S	*	.			trans	-57	135.4	-170.4	-37.4	0	0	0	0	115.8
478	I	32.6	Very low	43.1	Very low	156 Å²	156	81.8 Å²	81.8	80%	0.8	42%	0.423	S	S	*	.			trans	-172.2	143.2	133	-86	145.1	0	0	0	109.1
479	H	29.7	Very low	42.8	Very low	178 Å²	178	81.2 Å²	81.2	82%	0.824	42%	0.422	S	S	*	.			trans	-55.4	134	-171.3	-76.9	-117.6	0	0	0	116.6
480	G	30.6	Very low	43.1	Very low	77 Å²	77	79.2 Å²	79.2	79%	0.794	41%	0.414	S	S	*	.				91.1	29.8	128.4	0	0	0	0	0	120.3
481	L	31.6	Very low	44	Very low	87 Å²	87	80 Å²	80	46%	0.455	42%	0.423	S	S	.	.			trans	-108.7	139	174.4	-70.6	165	0	0	0	111.7	E483	L481-E483 HydrophobicContact CB-CG 4.5Å; L481-E483 WeakPolarHBondContact O-CG 3.46Å; L481-E483 PolarHBondContact O-N 3.44Å
482	N	33.8	Very low	45.6	Very low	99 Å²	99	77.5 Å²	77.5	53%	0.529	42%	0.416	S	S	.	.			trans	-68.7	96.4	177	-75.3	-28.7	0	0	0	109.3	E411 F468	E411-N482 PolarHBondContact O-ND2 3.34Å; F468-N482 HydrophobicContact CD1-CB 4.44Å; F468-N482 HydrophobicContact CE1-CB 4.4Å
483	E	46.9	Very low	47.6	Very low	63 Å²	63	79.5 Å²	79.5	29%	0.294	43%	0.425	S	S	.	.			trans	-104.1	143.5	-173.7	-70.9	162.2	-162.3	0	0	111.5	L481 L633	L481-E483 HydrophobicContact CB-CG 4.5Å; L481-E483 WeakPolarHBondContact O-CG 3.46Å; L481-E483 PolarHBondContact O-N 3.44Å; E483-L633 HydrophobicContact CB-CD1 4.33Å; E483-L633 HydrophobicContact CB-CD2 3.85Å
484	S	43.1	Very low	49.7	Very low	40 Å²	40	78 Å²	78	28%	0.28	41%	0.414	S	S	.	.			trans	-65	147.7	-178.6	84.5	0	0	0	0	111.9	K469 Y470 L633	K469-S484 PolarHBondContact O-N 3.5Å; Y470-S484 VanDerWaalsContact CA-OG 3.22Å; Y470-S484 WeakPolarHBondContact CA-OG 3.49Å; Y470-S484 WeakPolarHBondContact CD2-OG 3.28Å; Y470-S484 VanDerWaalsContact CE2-OG 3.28Å; Y470-S484 WeakPolarHBondContact CE2-OG 3.36Å; Y470-S484 VanDerWaalsContact CG-OG 3.26Å; S484-L633 WeakPolarHBondContact O-CD1 3.35Å
485	R	57.7	Low	51.8	Low	110 Å²	110	76.2 Å²	76.2	42%	0.415	41%	0.406	S	S	.	.			trans	-109.1	137.3	-172.4	-65.4	170.9	67.5	-164.4	-7.3	111.1	V487 R634 P635 V636	R485-V487 PolarHBondContact O-N 2.83Å; R485-R634 WeakPolarHBondContact CB-O 3.47Å; R485-R634 WeakPolarHBondContact CG-O 3.35Å; R485-R634 PolarHBondContact NE-O 3.41Å; R485-R634 PolarHBondContact NH2-O 2.77Å; R485-P635 PolarHBondContact NH2-O 2.8Å; R485-V636 HydrophobicContact CB-CB 4.35Å; R485-V636 HydrophobicContact CB-CG2 3.54Å; R485-V636 HydrophobicContact CG-CG2 4.15Å
486	P	58.4	Low	53.9	Low	23 Å²	23	70.1 Å²	70.1	15%	0.149	38%	0.377	C	S	.	.			trans	-63.9	135.8	179.4	22.1	-29.4	0	0	0	111.7	P635 V636	P486-P635 HydrophobicContact CG-CB 4.13Å; P486-P635 HydrophobicContact CG-CG 4.24Å; P486-P635 CarbonylContact O-C 3.49Å; P486-P635 WeakPolarHBondContact O-CA 3.23Å; P486-P635 WeakPolarHBondContact O-CB 3.16Å; P486-V636 PolarHBondContact O-N 3.06Å
487	V	61.8	Low	55.9	Low	33 Å²	33	65.3 Å²	65.3	20%	0.2	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	132.9	-176.8	-174.6	0	0	0	0	111.8	R485 S531 V636 D638	R485-V487 PolarHBondContact O-N 2.83Å; V487-S531 WeakPolarHBondContact O-CB 2.86Å; V487-S531 PolarHBondContact O-N 3.12Å; V487-V636 CarbonylContact C-O 3.55Å; V487-V636 WeakPolarHBondContact CA-O 3.44Å; V487-D638 HydrophobicContact CG1-CB 3.85Å
488	V	67.8	Low	58.2	Low	1 Å²	1	63.1 Å²	63.1	1%	0.006	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	120.1	179.6	-168.3	0	0	0	0	110.3	V490 L527 L530 F556 I623 P635 V636 K637 D638	V488-V490 HydrophobicContact CG1-CG2 3.87Å; V488-L527 HydrophobicContact CG1-CD1 4.32Å; V488-L530 HydrophobicContact CB-CD1 4.03Å; V488-L530 HydrophobicContact CG1-CD1 3.65Å; V488-L530 HydrophobicContact CG2-CD1 3.55Å; V488-F556 HydrophobicContact CG1-CZ 4.08Å; V488-I623 HydrophobicContact CG2-CD1 4.29Å; V488-P635 HydrophobicContact CG2-CB 3.46Å; V488-P635 VanDerWaalsContact CG2-CB 3.46Å; V488-P635 HydrophobicContact CG2-CG 4.47Å; V488-V636 PolarHBondContact N-O 2.92Å; V488-K637 WeakPolarHBondContact O-CA 3.26Å; V488-D638 PolarHBondContact O-N 3.08Å
489	S	66.8	Low	59.9	Low	12 Å²	12	61 Å²	61	8%	0.084	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	112.1	175.4	-44.6	0	0	0	0	110.1	H528 K529 D638	S489-H528 PolarHBondContact O-N 2.96Å; S489-K529 PolarHBondContact N-O 3.19Å; S489-K529 PolarHBondContact O-N 3.47Å; S489-D638 PolarHBondContact OG-OD2 3.15Å
490	V	68	Low	61.9	Low	1 Å²	1	55.5 Å²	55.5	1%	0.006	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	133.5	178.2	-176.4	0	0	0	0	109.8	V488 F525 L527 F556 Y621	V488-V490 HydrophobicContact CG1-CG2 3.87Å; V490-F525 HydrophobicContact CG1-CD1 3.82Å; V490-L527 HydrophobicContact CG2-CD1 3.68Å; V490-L527 HydrophobicContact CG2-CG 4.09Å; V490-F556 HydrophobicContact CG2-CE1 3.78Å; V490-F556 HydrophobicContact CG2-CE2 4.13Å; V490-F556 HydrophobicContact CG2-CZ 3.34Å; V490-Y621 HydrophobicContact CB-CE2 4.17Å; V490-Y621 HydrophobicContact CG1-CE2 4.45Å; V490-Y621 PolarHBondContact O-OH 2.99Å; V490-Y621 VanDerWaalsContact O-OH 3.08Å
491	S	69.1	Low	64.1	Low	41 Å²	41	52 Å²	52	29%	0.287	28%	0.28	S	S	.	.			trans	-116.6	155.8	166.4	99	0	0	0	0	109	P526 H528	S491-P526 WeakPolarHBondContact O-CD 3.45Å; S491-H528 VanDerWaalsContact CB-CD2 3.49Å; S491-H528 WeakPolarHBondContact CB-CD2 3.44Å; S491-H528 PolarHBondContact OG-CD2 3.36Å; S491-H528 PolarHBondContact OG-NE2 3.4Å
492	G	70	Confident	66	Low	17 Å²	17	49.5 Å²	49.5	18%	0.175	27%	0.267	C	S	.	.			trans	-157.3	165.3	178.3	0	0	0	0	0	111.6	L524 I645	G492-L524 CarbonylContact C-O 3.53Å; G492-L524 WeakPolarHBondContact CA-O 3.42Å; G492-I645 VanDerWaalsContact CA-CD1 3.44Å; G492-I645 WeakPolarHBondContact O-CG2 3.26Å
493	F	77.5	Confident	67.8	Low	72 Å²	72	46.5 Å²	46.5	32%	0.316	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	151.5	179.3	60	-85.4	0	0	0	110.2	K495 L524	F493-K495 HydrophobicContact CD2-CD 4.23Å; F493-K495 HydrophobicContact CD2-CG 4Å; F493-K495 HydrophobicContact CE2-CD 4Å; F493-K495 HydrophobicContact CE2-CG 4.22Å; F493-L524 HydrophobicContact CD1-CB 4.2Å; F493-L524 HydrophobicContact CD2-CB 4.13Å; F493-L524 HydrophobicContact CD2-CD1 4.1Å; F493-L524 HydrophobicContact CE1-CB 3.76Å; F493-L524 HydrophobicContact CE2-CB 3.72Å; F493-L524 HydrophobicContact CE2-CD1 3.43Å; F493-L524 VanDerWaalsContact CE2-CD1 3.43Å; F493-L524 HydrophobicContact CE2-CD2 4.44Å; F493-L524 HydrophobicContact CE2-CG 4.03Å; F493-L524 HydrophobicContact CG-CB 4.37Å; F493-L524 HydrophobicContact CZ-CB 3.49Å; F493-L524 VanDerWaalsContact CZ-CB 3.49Å; F493-L524 HydrophobicContact CZ-CD1 3.91Å; F493-L524 HydrophobicContact CZ-CD2 4.08Å; F493-L524 HydrophobicContact CZ-CG 4.01Å; F493-L524 PolarHBondContact N-O 2.9Å; F493-L524 PolarHBondContact O-N 3.08Å
494	V	78.4	Confident	68.7	Low	16 Å²	16	51.6 Å²	51.6	10%	0.097	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	129.9	179.4	178.4	0	0	0	0	108.5	V523 I617 V619 I645	V494-V523 HydrophobicContact CG2-CG1 4.37Å; V494-V523 HydrophobicContact CG2-CG2 4.4Å; V494-I617 HydrophobicContact CG1-CB 4.27Å; V494-I617 HydrophobicContact CG1-CD1 4.13Å; V494-I617 HydrophobicContact CG1-CG2 4.01Å; V494-V619 HydrophobicContact CG2-CB 4.37Å; V494-V619 HydrophobicContact CG2-CG2 3.52Å; V494-I645 HydrophobicContact CG2-CG2 4.01Å
495	K	77.3	Confident	70	Confident	131 Å²	131	53.4 Å²	53.4	57%	0.57	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.9	137.5	175	-72.5	-171.3	176.4	-167.8	0	110.6	F493 K522	F493-K495 HydrophobicContact CD2-CD 4.23Å; F493-K495 HydrophobicContact CD2-CG 4Å; F493-K495 HydrophobicContact CE2-CD 4Å; F493-K495 HydrophobicContact CE2-CG 4.22Å; K495-K522 PolarHBondContact N-O 2.89Å; K495-K522 WeakPolarHBondContact O-CA 3.41Å; K495-K522 PolarHBondContact O-N 3.41Å
496	A	73.7	Confident	70.6	Confident	18 Å²	18	51.3 Å²	51.3	15%	0.149	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	150.6	170.3	0	0	0	0	0	111.3	P498 V520 L521 V649	A496-P498 CarbonylContact C-O 3.57Å; A496-V520 CarbonylContact C-O 3.5Å; A496-V520 WeakPolarHBondContact CA-O 3.5Å; A496-L521 HydrophobicContact CB-CD2 3.85Å; A496-V649 HydrophobicContact CB-CB 4.4Å; A496-V649 HydrophobicContact CB-CG1 4.23Å; A496-V649 HydrophobicContact CB-CG2 3.48Å; A496-V649 VanDerWaalsContact CB-CG2 3.48Å
497	N	73.9	Confident	71	Confident	93 Å²	93	57.6 Å²	57.6	50%	0.497	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	114.8	173.5	-175.8	32.9	0	0	0	110.5	V520	N497-V520 PolarHBondContact N-O 3.48Å; N497-V520 PolarHBondContact O-N 2.91Å
498	P	72.9	Confident	71	Confident	57 Å²	57	57.1 Å²	57.1	37%	0.37	30%	0.298	S	S	.	.	S	Bend	cis	-63.4	154.2	-8.8	31	-36.1	0	0	0	111	A496 V500	A496-P498 CarbonylContact C-O 3.57Å; P498-V500 VanDerWaalsContact C-N 3.26Å; P498-V500 WeakPolarHBondContact CB-O 3.36Å; P498-V500 WeakPolarHBondContact CG-O 3.06Å
499	D	69	Low	70.8	Confident	111 Å²	111	65.9 Å²	65.9	59%	0.594	33%	0.331	S	S	*	.	S	Bend	trans	-74.7	-18.2	172.2	51.7	-7.9	0	0	0	112.5	N650	D499-N650 PolarHBondContact O-N 3.45Å
500	V	71.9	Confident	70.7	Confident	63 Å²	63	65.9 Å²	65.9	38%	0.382	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	125.2	171	-173.1	0	0	0	0	110.8	P498 N650 Q652	P498-V500 VanDerWaalsContact C-N 3.26Å; P498-V500 WeakPolarHBondContact CB-O 3.36Å; P498-V500 WeakPolarHBondContact CG-O 3.06Å; V500-N650 CarbonylContact C-O 3.57Å; V500-N650 WeakPolarHBondContact CA-O 3.47Å; V500-N650 HydrophobicContact CG2-CB 4.29Å; V500-Q652 HydrophobicContact CG1-CB 4.11Å
501	I	75.8	Confident	70.3	Confident	4 Å²	4	74.4 Å²	74.4	2%	0.021	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	120.8	176.7	-64.1	178	0	0	0	109.7	L503 P517 C519 V604 V649 N650 I651 Q652	I501-L503 HydrophobicContact CG2-CD2 4.43Å; I501-P517 HydrophobicContact CG2-CB 3.86Å; I501-C519 HydrophobicContact CD1-CB 3.94Å; I501-C519 HydrophobicContact CG1-CB 4.06Å; I501-V604 HydrophobicContact CD1-CG2 3.52Å; I501-V604 HydrophobicContact CG2-CG2 4.21Å; I501-V649 HydrophobicContact CD1-CG1 3.6Å; I501-V649 HydrophobicContact CG1-CG1 3.68Å; I501-N650 PolarHBondContact N-O 3.36Å; I501-I651 CarbonylContact O-C 3.59Å; I501-I651 WeakPolarHBondContact O-CA 3.49Å; I501-Q652 PolarHBondContact O-N 2.59Å
502	N	72.4	Confident	69.9	Low	35 Å²	35	80.8 Å²	80.8	19%	0.187	40%	0.395	C	S	.	.			trans	-85.6	119.3	165.6	-174.6	-24.1	0	0	0	109.6	E504 N505 Q652	N502-E504 VanDerWaalsContact C-N 3.25Å; N502-E504 PolarHBondContact O-N 2.84Å; N502-E504 WeakPolarHBondContact OD1-CA 3.5Å; N502-E504 VanDerWaalsContact OD1-CB 3.3Å; N502-E504 WeakPolarHBondContact OD1-CB 3.4Å; N502-E504 PolarHBondContact OD1-N 2.79Å; N502-N505 HydrophobicContact CB-CB 4.09Å; N502-N505 PolarHBondContact O-N 3.49Å; N502-Q652 HydrophobicContact CB-CB 4.3Å; N502-Q652 PolarHBondContact ND2-OE1 2.79Å
503	L	71.8	Confident	69.4	Low	36 Å²	36	84 Å²	84	19%	0.188	41%	0.414	C	S	.	.	S	Bend	trans	-69.5	-20.5	-179.7	-62.5	176.4	0	0	0	113.5	I501 K506 P517 V604 I608 K611 I651	I501-L503 HydrophobicContact CG2-CD2 4.43Å; L503-K506 WeakPolarHBondContact O-CE 2.92Å; L503-P517 HydrophobicContact CD2-CG 4.09Å; L503-V604 HydrophobicContact CD2-CB 4.38Å; L503-V604 HydrophobicContact CD2-CG1 3.95Å; L503-I608 HydrophobicContact CD1-CD1 4.21Å; L503-I608 HydrophobicContact CD1-CG1 4.36Å; L503-I608 HydrophobicContact CD2-CD1 4.26Å; L503-K611 HydrophobicContact CD1-CD 3.88Å; L503-K611 HydrophobicContact CD1-CG 4.02Å; L503-I651 HydrophobicContact CD1-CG2 3.7Å; L503-I651 HydrophobicContact CD2-CG2 4.23Å; L503-I651 HydrophobicContact CG-CG2 3.71Å
504	E	66.5	Low	68.7	Low	169 Å²	169	86.7 Å²	86.7	79%	0.79	43%	0.428	S	S	*	.	S	Bend	trans	-79.1	-27.5	176.4	-56	-173.4	158.7	0	0	111.9	N502 K506	N502-E504 VanDerWaalsContact C-N 3.25Å; N502-E504 PolarHBondContact O-N 2.84Å; N502-E504 WeakPolarHBondContact OD1-CA 3.5Å; N502-E504 VanDerWaalsContact OD1-CB 3.3Å; N502-E504 WeakPolarHBondContact OD1-CB 3.4Å; N502-E504 PolarHBondContact OD1-N 2.79Å; E504-K506 PolarHBondContact O-N 3.3Å
505	N	69.3	Low	68.2	Low	78 Å²	78	90 Å²	90	42%	0.417	45%	0.445	S	S	.	.			trans	-81.8	78.5	179.4	-91.2	-20.6	0	0	0	112	N502 F507	N502-N505 HydrophobicContact CB-CB 4.09Å; N502-N505 PolarHBondContact O-N 3.49Å; N505-F507 HydrophobicContact CB-CD2 3.94Å; N505-F507 HydrophobicContact CB-CE2 3.46Å; N505-F507 VanDerWaalsContact CB-CE2 3.46Å; N505-F507 HydrophobicContact CB-CZ 4.1Å; N505-F507 PolarHBondContact O-N 2.84Å; N505-F507 WeakPolarHBondContact OD1-CE2 3.19Å; N505-F507 VanDerWaalsContact OD1-CZ 3.26Å; N505-F507 WeakPolarHBondContact OD1-CZ 3.3Å
506	K	70.7	Confident	67.8	Low	67 Å²	67	84 Å²	84	29%	0.291	42%	0.419	S	S	.	.			trans	-90.3	69.5	-178.8	-60.2	-177.3	169.3	-177.5	0	112.2	L503 E504 N515 D606	L503-K506 WeakPolarHBondContact O-CE 2.92Å; E504-K506 PolarHBondContact O-N 3.3Å; K506-N515 HydrophobicContact CB-CB 3.79Å; K506-N515 WeakPolarHBondContact CD-O 3.38Å; K506-N515 WeakPolarHBondContact O-CB 3.34Å; K506-D606 IonicContact NZ-OD1 2.64Å; K506-D606 PolarHBondContact NZ-OD1 3.03Å; K506-D606 IonicContact NZ-OD2 3.59Å; K506-D606 PolarHBondContact NZ-OD2 2.82Å
507	F	65.8	Low	67.2	Low	154 Å²	154	83.2 Å²	83.2	68%	0.675	41%	0.413	S	S	*	.			trans	-83.8	-12.9	-174.7	-63.1	-62.6	0	0	0	115.7	N505	N505-F507 HydrophobicContact CB-CD2 3.94Å; N505-F507 HydrophobicContact CB-CE2 3.46Å; N505-F507 VanDerWaalsContact CB-CE2 3.46Å; N505-F507 HydrophobicContact CB-CZ 4.1Å; N505-F507 PolarHBondContact O-N 2.84Å; N505-F507 WeakPolarHBondContact OD1-CE2 3.19Å; N505-F507 VanDerWaalsContact OD1-CZ 3.26Å; N505-F507 WeakPolarHBondContact OD1-CZ 3.3Å
508	C	63.4	Low	66.9	Low	24 Å²	24	83.2 Å²	83.2	16%	0.162	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	130.6	-177.1	-179.1	0	0	0	0	111.3	N515 V516 W518	C508-N515 CarbonylContact O-C 3.54Å; C508-N515 VanDerWaalsContact O-CA 3.3Å; C508-N515 WeakPolarHBondContact O-CA 3.22Å; C508-V516 HydrophobicContact CB-CG2 4.41Å; C508-V516 PolarHBondContact N-O 3.41Å; C508-V516 PolarHBondContact O-N 2.88Å; C508-W518 HydrophobicContact CB-CB 3.97Å; C508-W518 HydrophobicContact CB-CD2 4.43Å; C508-W518 HydrophobicContact CB-CG 3.61Å
509	R	62.2	Low	66.3	Low	184 Å²	184	80.5 Å²	80.5	69%	0.694	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	116.9	179.6	-166.5	176.5	-175.3	-175.8	-0.4	110.4
510	L	64.8	Low	66	Low	12 Å²	12	76 Å²	76	6%	0.063	37%	0.365	C	S	.	.			trans	-70	156.8	171.4	-67.5	173.2	0	0	0	110.5	K512 S513 E514 V516 L575 Y603	L510-K512 PolarHBondContact O-N 3.3Å; L510-S513 PolarHBondContact O-N 3.2Å; L510-E514 PolarHBondContact N-O 2.75Å; L510-V516 HydrophobicContact CD1-CB 4.39Å; L510-V516 HydrophobicContact CD1-CG1 3.49Å; L510-V516 VanDerWaalsContact CD1-CG1 3.49Å; L510-V516 HydrophobicContact CD1-CG2 4.01Å; L510-V516 HydrophobicContact CD2-CG2 4.09Å; L510-V516 HydrophobicContact CG-CG1 4.06Å; L510-V516 HydrophobicContact CG-CG2 3.73Å; L510-L575 HydrophobicContact CD2-CD1 3.79Å; L510-Y603 HydrophobicContact CD1-CD2 4.37Å; L510-Y603 HydrophobicContact CD1-CE2 3.96Å; L510-Y603 HydrophobicContact CD2-CD1 4.26Å; L510-Y603 HydrophobicContact CD2-CE1 4.13Å; L510-Y603 HydrophobicContact CD2-CG 4.5Å
511	M	60.8	Low	65.5	Low	180 Å²	180	73 Å²	73	89%	0.887	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-17.3	-178.9	-70.6	-112.5	-79	0	0	113.9
512	K	59.3	Low	65	Low	176 Å²	176	76.5 Å²	76.5	77%	0.765	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	19.4	176.2	-73	-173.1	174.7	-177.6	0	115.1	L510 E514	L510-K512 PolarHBondContact O-N 3.3Å; K512-E514 VanDerWaalsContact C-N 3.28Å; K512-E514 PolarHBondContact O-N 3.21Å
513	S	60	Low	64.3	Low	84 Å²	84	75 Å²	75	59%	0.587	35%	0.354	S	S	*	.	S	Bend	trans	67.8	12.2	177.7	65.4	0	0	0	0	117.4	L510	L510-S513 PolarHBondContact O-N 3.2Å
514	E	63.7	Low	63.8	Low	129 Å²	129	74.7 Å²	74.7	60%	0.603	35%	0.352	S	S	*	.			trans	-86.9	128.9	168.6	-74.6	171.6	178.6	0	0	110.5	L510 K512	L510-E514 PolarHBondContact N-O 2.75Å; K512-E514 VanDerWaalsContact C-N 3.28Å; K512-E514 PolarHBondContact O-N 3.21Å
515	N	67.7	Low	63.4	Low	85 Å²	85	66.7 Å²	66.7	46%	0.455	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	132.6	169.9	-73.2	-21.4	0	0	0	108.7	K506 C508	K506-N515 HydrophobicContact CB-CB 3.79Å; K506-N515 WeakPolarHBondContact CD-O 3.38Å; K506-N515 WeakPolarHBondContact O-CB 3.34Å; C508-N515 CarbonylContact O-C 3.54Å; C508-N515 VanDerWaalsContact O-CA 3.3Å; C508-N515 WeakPolarHBondContact O-CA 3.22Å
516	V	67.5	Low	62.7	Low	4 Å²	4	63.7 Å²	63.7	2%	0.024	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	150.3	-178.3	-66.5	0	0	0	0	111.8	C508 L510 Y603	C508-V516 HydrophobicContact CB-CG2 4.41Å; C508-V516 PolarHBondContact N-O 3.41Å; C508-V516 PolarHBondContact O-N 2.88Å; L510-V516 HydrophobicContact CD1-CB 4.39Å; L510-V516 HydrophobicContact CD1-CG1 3.49Å; L510-V516 VanDerWaalsContact CD1-CG1 3.49Å; L510-V516 HydrophobicContact CD1-CG2 4.01Å; L510-V516 HydrophobicContact CD2-CG2 4.09Å; L510-V516 HydrophobicContact CG-CG1 4.06Å; L510-V516 HydrophobicContact CG-CG2 3.73Å; V516-Y603 HydrophobicContact CB-CD2 4.08Å; V516-Y603 HydrophobicContact CG1-CD2 4.15Å; V516-Y603 HydrophobicContact CG2-CD2 3.94Å; V516-Y603 HydrophobicContact CG2-CG 4.01Å
517	P	62.1	Low	61.6	Low	3 Å²	3	60.9 Å²	60.9	2%	0.019	29%	0.288	C	S	.	.			trans	-72.3	135.9	169.2	31.3	-30.8	0	0	0	109.4	I501 L503 Y603 V604	I501-P517 HydrophobicContact CG2-CB 3.86Å; L503-P517 HydrophobicContact CD2-CG 4.09Å; P517-Y603 WeakPolarHBondContact O-CA 3.49Å; P517-Y603 WeakPolarHBondContact O-CB 3.13Å; P517-V604 HydrophobicContact CG-CB 4.16Å; P517-V604 PolarHBondContact O-N 2.62Å
518	W	67	Low	61	Low	92 Å²	92	59.4 Å²	59.4	35%	0.348	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	155.4	-174.2	69.2	-77.6	0	0	0	111.2	C508 V520 Y601 I602	C508-W518 HydrophobicContact CB-CB 3.97Å; C508-W518 HydrophobicContact CB-CD2 4.43Å; C508-W518 HydrophobicContact CB-CG 3.61Å; W518-V520 HydrophobicContact CE3-CG2 4.22Å; W518-V520 HydrophobicContact CH2-CG2 4.26Å; W518-V520 HydrophobicContact CZ3-CG2 3.42Å; W518-V520 VanDerWaalsContact CZ3-CG2 3.42Å; W518-Y601 AromaticContact CE3-CD1 3.86Å; W518-Y601 HydrophobicContact CE3-CD1 3.86Å; W518-Y601 HydrophobicContact CE3-CE1 4.38Å; W518-Y601 AromaticContact CZ3-CD1 3.66Å; W518-Y601 HydrophobicContact CZ3-CD1 3.66Å; W518-Y601 AromaticContact CZ3-CE1 3.71Å; W518-Y601 HydrophobicContact CZ3-CE1 3.71Å; W518-I602 CarbonylContact C-O 3.51Å; W518-I602 VanDerWaalsContact CA-O 3.31Å; W518-I602 WeakPolarHBondContact CA-O 3.2Å
519	C	59.8	Low	60.2	Low	0 Å²	0	62.5 Å²	62.5	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	162	167.8	77.4	0	0	0	0	111.6	I501 I602	I501-C519 HydrophobicContact CD1-CB 3.94Å; I501-C519 HydrophobicContact CG1-CB 4.06Å; C519-I602 PolarHBondContact N-O 3.27Å; C519-I602 PolarHBondContact O-N 2.84Å; C519-I602 VanDerWaalsContact SG-CD1 3.55Å; C519-I602 WeakPolarHBondContact SG-CG1 3.12Å
520	V	63.5	Low	59.4	Low	16 Å²	16	54.7 Å²	54.7	10%	0.097	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	117	174.7	-173.6	0	0	0	0	109.2	A496 N497 W518 K522 R599 Y601	A496-V520 CarbonylContact C-O 3.5Å; A496-V520 WeakPolarHBondContact CA-O 3.5Å; N497-V520 PolarHBondContact N-O 3.48Å; N497-V520 PolarHBondContact O-N 2.91Å; W518-V520 HydrophobicContact CE3-CG2 4.22Å; W518-V520 HydrophobicContact CH2-CG2 4.26Å; W518-V520 HydrophobicContact CZ3-CG2 3.42Å; W518-V520 VanDerWaalsContact CZ3-CG2 3.42Å; V520-K522 HydrophobicContact CG1-CG 4.5Å; V520-R599 HydrophobicContact CG1-CB 4.39Å; V520-R599 HydrophobicContact CG1-CG 4.5Å; V520-Y601 HydrophobicContact CG2-CD1 3.85Å; V520-Y601 HydrophobicContact CG2-CE1 3.6Å
521	L	61.6	Low	58.3	Low	1 Å²	1	55.2 Å²	55.2	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	129.1	165.7	-57.3	-171.1	0	0	0	109.9	A496 L562 R599 R600 I602 I617 V649	A496-L521 HydrophobicContact CB-CD2 3.85Å; L521-L562 HydrophobicContact CD1-CD2 3.73Å; L521-R599 CarbonylContact O-C 3.45Å; L521-R599 VanDerWaalsContact O-CA 3.3Å; L521-R599 WeakPolarHBondContact O-CA 3.34Å; L521-R600 WeakPolarHBondContact CB-O 3.35Å; L521-R600 PolarHBondContact N-O 2.92Å; L521-R600 PolarHBondContact O-N 3.27Å; L521-I602 HydrophobicContact CD1-CB 4.5Å; L521-I602 HydrophobicContact CD1-CD1 3.95Å; L521-I602 HydrophobicContact CD1-CG1 4.21Å; L521-I602 HydrophobicContact CD1-CG2 3.52Å; L521-I602 HydrophobicContact CD2-CD1 3.76Å; L521-I602 HydrophobicContact CD2-CG1 4.09Å; L521-I602 HydrophobicContact CG-CD1 3.93Å; L521-I602 HydrophobicContact CG-CG1 3.9Å; L521-I602 HydrophobicContact CG-CG2 3.88Å; L521-I617 HydrophobicContact CD1-CD1 3.74Å; L521-I617 HydrophobicContact CD1-CG1 4.08Å; L521-I617 HydrophobicContact CD1-CG2 4.23Å; L521-I617 HydrophobicContact CD2-CD1 3.33Å; L521-I617 HydrophobicContact CD2-CG1 4.45Å; L521-I617 HydrophobicContact CG-CD1 4.15Å; L521-V649 HydrophobicContact CD2-CG2 4.2Å
522	K	64.6	Low	57	Low	77 Å²	77	55.4 Å²	55.4	34%	0.335	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	112.1	167.8	-62.2	-172.4	178.9	173.5	0	108.5	K495 V520 L524 E598 R599	K495-K522 PolarHBondContact N-O 2.89Å; K495-K522 WeakPolarHBondContact O-CA 3.41Å; K495-K522 PolarHBondContact O-N 3.41Å; V520-K522 HydrophobicContact CG1-CG 4.5Å; K522-L524 HydrophobicContact CB-CD1 3.98Å; K522-E598 WeakPolarHBondContact CA-O 3.27Å; K522-R599 HydrophobicContact CG-CG 4.16Å
523	V	59	Low	55.8	Low	4 Å²	4	50.3 Å²	50.3	2%	0.024	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	120.9	172.7	-176.6	0	0	0	0	107.7	V494 F525 I560 C597 E598 V619	V494-V523 HydrophobicContact CG2-CG1 4.37Å; V494-V523 HydrophobicContact CG2-CG2 4.4Å; V523-F525 HydrophobicContact CG1-CD2 3.89Å; V523-F525 HydrophobicContact CG1-CE2 3.39Å; V523-F525 HydrophobicContact CG1-CZ 4.31Å; V523-I560 HydrophobicContact CG2-CD1 4.12Å; V523-C597 CarbonylContact O-C 3.46Å; V523-C597 VanDerWaalsContact O-CA 3.31Å; V523-C597 WeakPolarHBondContact O-CA 3.39Å; V523-E598 PolarHBondContact N-O 2.95Å; V523-E598 PolarHBondContact O-N 3.19Å; V523-V619 HydrophobicContact CG1-CG1 4.33Å; V523-V619 HydrophobicContact CG1-CG2 4.27Å; V523-V619 HydrophobicContact CG2-CG2 4.34Å
524	L	60.7	Low	54.4	Low	29 Å²	29	48.2 Å²	48.2	15%	0.152	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	127.7	-175.9	-70.6	118.9	0	0	0	111	G492 F493 K522 C597	G492-L524 CarbonylContact C-O 3.53Å; G492-L524 WeakPolarHBondContact CA-O 3.42Å; F493-L524 HydrophobicContact CD1-CB 4.2Å; F493-L524 HydrophobicContact CD2-CB 4.13Å; F493-L524 HydrophobicContact CD2-CD1 4.1Å; F493-L524 HydrophobicContact CE1-CB 3.76Å; F493-L524 HydrophobicContact CE2-CB 3.72Å; F493-L524 HydrophobicContact CE2-CD1 3.43Å; F493-L524 VanDerWaalsContact CE2-CD1 3.43Å; F493-L524 HydrophobicContact CE2-CD2 4.44Å; F493-L524 HydrophobicContact CE2-CG 4.03Å; F493-L524 HydrophobicContact CG-CB 4.37Å; F493-L524 HydrophobicContact CZ-CB 3.49Å; F493-L524 VanDerWaalsContact CZ-CB 3.49Å; F493-L524 HydrophobicContact CZ-CD1 3.91Å; F493-L524 HydrophobicContact CZ-CD2 4.08Å; F493-L524 HydrophobicContact CZ-CG 4.01Å; F493-L524 PolarHBondContact N-O 2.9Å; F493-L524 PolarHBondContact O-N 3.08Å; K522-L524 HydrophobicContact CB-CD1 3.98Å; L524-C597 HydrophobicContact CD2-CB 3.87Å; L524-C597 HydrophobicContact CG-CB 4.15Å
525	F	57.7	Low	52.7	Low	2 Å²	2	49.5 Å²	49.5	1%	0.009	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	102.3	176	-75.1	-86.1	0	0	0	110.7	V490 V523 L558 I590 W596 V619 Y621 I645	V490-F525 HydrophobicContact CG1-CD1 3.82Å; V523-F525 HydrophobicContact CG1-CD2 3.89Å; V523-F525 HydrophobicContact CG1-CE2 3.39Å; V523-F525 HydrophobicContact CG1-CZ 4.31Å; F525-L558 HydrophobicContact CD2-CD1 4.27Å; F525-L558 HydrophobicContact CE1-CD2 4.25Å; F525-L558 HydrophobicContact CE2-CD1 3.74Å; F525-L558 HydrophobicContact CE2-CD2 3.62Å; F525-L558 HydrophobicContact CE2-CG 4.35Å; F525-L558 HydrophobicContact CZ-CD1 4.46Å; F525-L558 HydrophobicContact CZ-CD2 3.48Å; F525-L558 VanDerWaalsContact CZ-CD2 3.48Å; F525-I590 HydrophobicContact CB-CD1 3.82Å; F525-I590 HydrophobicContact CG-CD1 4.25Å; F525-W596 HydrophobicContact CB-CE3 4.5Å; F525-W596 AromaticContact CD2-CE3 3.94Å; F525-W596 HydrophobicContact CD2-CE3 3.94Å; F525-W596 AromaticContact CD2-CZ3 3.96Å; F525-W596 HydrophobicContact CD2-CZ3 3.96Å; F525-W596 HydrophobicContact CE2-CZ3 4.43Å; F525-W596 PolarHBondContact N-O 3.48Å; F525-W596 PolarHBondContact O-N 3.48Å; F525-W596 VanDerWaalsContact O-N 3.08Å; F525-V619 HydrophobicContact CE2-CG1 4.12Å; F525-V619 HydrophobicContact CZ-CG1 3.77Å; F525-Y621 HydrophobicContact CE1-CD1 4.02Å; F525-Y621 HydrophobicContact CE1-CD2 4.46Å; F525-Y621 HydrophobicContact CE1-CE1 4.46Å; F525-Y621 AromaticContact CE1-CG 3.99Å; F525-Y621 HydrophobicContact CE1-CG 3.99Å; F525-Y621 HydrophobicContact CZ-CD1 4.41Å; F525-Y621 HydrophobicContact CZ-CG 4.42Å; F525-I645 HydrophobicContact CD1-CD1 3.99Å; F525-I645 HydrophobicContact CE1-CD1 3.2Å; F525-I645 HydrophobicContact CZ-CD1 3.69Å
526	P	54.4	Low	51	Low	15 Å²	15	47.7 Å²	47.7	10%	0.097	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	124.7	160.2	27.5	-32.3	0	0	0	112	S491 H528 R595	S491-P526 WeakPolarHBondContact O-CD 3.45Å; P526-H528 WeakPolarHBondContact CG-NE2 2.82Å; P526-H528 PolarHBondContact O-CD2 3.36Å; P526-H528 VanDerWaalsContact O-CD2 3.23Å; P526-H528 PolarHBondContact O-N 3.37Å; P526-R595 HydrophobicContact CB-CG 4.18Å
527	L	48	Very low	49.1	Very low	7 Å²	7	54.3 Å²	54.3	4%	0.037	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	106.6	170.3	-155.2	124.2	0	0	0	109.8	V488 V490 L530 F556 I590 K592 G593	V488-L527 HydrophobicContact CG1-CD1 4.32Å; V490-L527 HydrophobicContact CG2-CD1 3.68Å; V490-L527 HydrophobicContact CG2-CG 4.09Å; L527-L530 HydrophobicContact CD2-CB 4.06Å; L527-F556 HydrophobicContact CD1-CE2 3.85Å; L527-F556 HydrophobicContact CD1-CZ 4.15Å; L527-I590 HydrophobicContact CB-CG2 3.78Å; L527-I590 HydrophobicContact CD1-CB 3.97Å; L527-I590 HydrophobicContact CD1-CG2 3.73Å; L527-I590 HydrophobicContact CG-CG2 4.41Å; L527-K592 HydrophobicContact CD2-CB 4.04Å; L527-K592 HydrophobicContact CD2-CG 4.31Å; L527-G593 PolarHBondContact O-N 3.36Å
528	H	52.4	Low	47.6	Very low	124 Å²	124	60.8 Å²	60.8	57%	0.574	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	-51.5	-170.2	-74.9	-88.1	0	0	0	113.4	S489 S491 P526	S489-H528 PolarHBondContact O-N 2.96Å; S491-H528 VanDerWaalsContact CB-CD2 3.49Å; S491-H528 WeakPolarHBondContact CB-CD2 3.44Å; S491-H528 PolarHBondContact OG-CD2 3.36Å; S491-H528 PolarHBondContact OG-NE2 3.4Å; P526-H528 WeakPolarHBondContact CG-NE2 2.82Å; P526-H528 PolarHBondContact O-CD2 3.36Å; P526-H528 VanDerWaalsContact O-CD2 3.23Å; P526-H528 PolarHBondContact O-N 3.37Å
529	K	47.7	Very low	45.7	Very low	89 Å²	89	62.7 Å²	62.7	39%	0.387	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	116.4	-174.8	-158.3	178.9	175.7	-168.5	0	108	G368 S489	G368-K529 PolarHBondContact O-NZ 3.44Å; S489-K529 PolarHBondContact N-O 3.19Å; S489-K529 PolarHBondContact O-N 3.47Å
530	L	45.9	Very low	44.4	Very low	19 Å²	19	67.3 Å²	67.3	10%	0.099	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	118.6	159.8	-167.5	73.8	0	0	0	104.8	V488 L527 R532 I551 K592	V488-L530 HydrophobicContact CB-CD1 4.03Å; V488-L530 HydrophobicContact CG1-CD1 3.65Å; V488-L530 HydrophobicContact CG2-CD1 3.55Å; L527-L530 HydrophobicContact CD2-CB 4.06Å; L530-R532 PolarHBondContact O-N 2.78Å; L530-I551 HydrophobicContact CD2-CG2 4.39Å; L530-I551 WeakPolarHBondContact CD2-O 3.25Å; L530-K592 HydrophobicContact CB-CD 3.95Å; L530-K592 HydrophobicContact CB-CG 4.33Å; L530-K592 PolarHBondContact O-NZ 2.64Å
531	S	40.1	Very low	43	Very low	23 Å²	23	74.5 Å²	74.5	16%	0.161	37%	0.374	C	S	.	.			trans	-52.5	121	175.6	-170	0	0	0	0	107.7	V487 V533	V487-S531 WeakPolarHBondContact O-CB 2.86Å; V487-S531 PolarHBondContact O-N 3.12Å; S531-V533 PolarHBondContact O-N 2.74Å
532	R	35.4	Very low	41.8	Very low	185 Å²	185	81.3 Å²	81.3	70%	0.698	41%	0.41	S	S	*	.			trans	-71.3	118.5	-173.4	-91.6	-174.4	176.7	173.9	2.4	107.2	L530 C534	L530-R532 PolarHBondContact O-N 2.78Å; R532-C534 PolarHBondContact O-N 3.08Å
533	V	33.8	Very low	40.2	Very low	69 Å²	69	84.8 Å²	84.8	42%	0.418	43%	0.433	S	S	.	.			trans	-59.6	89.2	147	162.2	0	0	0	0	106.2	K472 S531 R535	K472-V533 HydrophobicContact CD-CB 4.46Å; K472-V533 HydrophobicContact CD-CG1 3.72Å; K472-V533 HydrophobicContact CG-CB 3.96Å; K472-V533 HydrophobicContact CG-CG1 3.38Å; K472-V533 HydrophobicContact CG-CG2 3.89Å; S531-V533 PolarHBondContact O-N 2.74Å; V533-R535 PolarHBondContact O-N 2.81Å; V533-R535 VanDerWaalsContact O-N 3.16Å
534	C	29.3	Very low	39	Very low	40 Å²	40	93.4 Å²	93.4	27%	0.27	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-53.9	117.2	178.5	-85.1	0	0	0	0	111.8	Y434 K472 R532 T536	Y434-C534 HydrophobicContact CE2-CB 4.39Å; Y434-C534 PolarHBondContact OH-SG 2.93Å; K472-C534 WeakPolarHBondContact CE-O 3.42Å; K472-C534 PolarHBondContact NZ-O 2.78Å; R532-C534 PolarHBondContact O-N 3.08Å; C534-T536 PolarHBondContact O-N 2.79Å
535	R	28.2	Very low	37.7	Very low	155 Å²	155	103.3 Å²	103.3	59%	0.585	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-74.1	117.4	177.7	-148.7	-177.1	-158.4	-178	3.2	108.4	V533 N537 N548	V533-R535 PolarHBondContact O-N 2.81Å; V533-R535 VanDerWaalsContact O-N 3.16Å; R535-N537 PolarHBondContact O-N 2.87Å; R535-N548 PolarHBondContact NH2-OD1 2.81Å
536	T	31.6	Very low	36.4	Very low	47 Å²	47	111 Å²	111	29%	0.288	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-66.8	118.6	161.4	79.7	0	0	0	0	106.4	E433 C534 F538	E433-T536 HydrophobicContact CB-CG2 4.11Å; E433-T536 HydrophobicContact CG-CG2 3.47Å; E433-T536 VanDerWaalsContact CG-CG2 3.47Å; E433-T536 WeakPolarHBondContact OE1-CB 3.29Å; E433-T536 WeakPolarHBondContact OE1-CG2 3.39Å; E433-T536 WeakPolarHBondContact OE2-CA 3.49Å; E433-T536 VanDerWaalsContact OE2-CB 3.29Å; E433-T536 WeakPolarHBondContact OE2-CB 3.47Å; E433-T536 WeakPolarHBondContact OE2-CG2 3.45Å; C534-T536 PolarHBondContact O-N 2.79Å; T536-F538 PolarHBondContact O-N 2.94Å; T536-F538 WeakPolarHBondContact OG1-CD2 3.47Å
537	N	27.9	Very low	35.4	Very low	144 Å²	144	119.4 Å²	119.4	77%	0.77	59%	0.587	S	S	*	*			trans	-78.5	73.7	172.2	-89.4	-19.9	0	0	0	108.4	R535 V539	R535-N537 PolarHBondContact O-N 2.87Å; N537-V539 PolarHBondContact O-N 3.38Å
538	F	30.7	Very low	34.5	Very low	139 Å²	139	124.6 Å²	124.6	61%	0.61	62%	0.615	S	S	*	*			trans	-82.4	104.4	158.7	-81.3	-86.6	0	0	0	108.3	I39 T536 S540	I39-F538 HydrophobicContact CD1-CZ 4.21Å; T536-F538 PolarHBondContact O-N 2.94Å; T536-F538 WeakPolarHBondContact OG1-CD2 3.47Å; F538-S540 PolarHBondContact O-N 2.94Å
539	V	28.1	Very low	33.7	Very low	131 Å²	131	123.4 Å²	123.4	79%	0.794	61%	0.612	S	S	*	*			trans	-66.1	85.1	161.7	178.9	0	0	0	0	106.9	N537 I541	N537-V539 PolarHBondContact O-N 3.38Å; V539-I541 HydrophobicContact CG1-CG1 4.27Å; V539-I541 PolarHBondContact O-N 2.8Å
540	S	32.2	Very low	33.3	Very low	97 Å²	97	123.7 Å²	123.7	68%	0.678	62%	0.617	S	S	*	*			trans	-78.8	109.2	160	63	0	0	0	0	107.3	F538 D542	F538-S540 PolarHBondContact O-N 2.94Å; S540-D542 PolarHBondContact O-N 3.1Å
541	I	32.9	Very low	33.4	Very low	167 Å²	167	125.1 Å²	125.1	86%	0.856	62%	0.624	S	S	*	*			trans	-66.5	80.4	161.4	-56.5	168.7	0	0	0	106.1	V539	V539-I541 HydrophobicContact CG1-CG1 4.27Å; V539-I541 PolarHBondContact O-N 2.8Å
542	D	36.6	Very low	34	Very low	144 Å²	144	126.5 Å²	126.5	77%	0.77	63%	0.634	S	S	*	*			trans	-149.1	121.6	148.4	-142.8	-10.4	0	0	0	109.9	S540	S540-D542 PolarHBondContact O-N 3.1Å
543	N	31.7	Very low	35.3	Very low	151 Å²	151	120.1 Å²	120.1	81%	0.807	61%	0.613	S	S	*	*			trans	-75.1	137.5	-178.8	-89.9	-42.7	0	0	0	108.6
544	Q	34.2	Very low	37	Very low	184 Å²	184	116.9 Å²	116.9	86%	0.86	59%	0.594	S	S	*	*	S	Bend	trans	97.6	115.3	165.3	-50.6	-172.4	-8.4	0	0	116.4
545	R	32.9	Very low	39.3	Very low	238 Å²	238	116.9 Å²	116.9	90%	0.898	59%	0.592	S	S	*	*			trans	90.9	31.9	159.1	-68.2	-173.7	175.1	167.1	-0.2	122
546	N	30.8	Very low	41.7	Very low	163 Å²	163	109.7 Å²	109.7	87%	0.872	56%	0.564	S	S	*	*			trans	-112.4	99.5	159.9	-89	-13.7	0	0	0	112.3
547	Q	33.8	Very low	44.3	Very low	192 Å²	192	112.5 Å²	112.5	90%	0.897	57%	0.57	S	S	*	*			trans	-64.3	129.8	171.3	-76.1	177.7	-13.5	0	0	110.1	L549	Q547-L549 PolarHBondContact O-N 2.92Å
548	N	29.4	Very low	47	Very low	115 Å²	115	105.7 Å²	105.7	62%	0.615	53%	0.533	S	S	*	.			trans	-53.5	110.6	177.7	-65.6	-46.1	0	0	0	112.3	R535 I550	R535-N548 PolarHBondContact NH2-OD1 2.81Å; N548-I550 HydrophobicContact CB-CG1 4.44Å; N548-I550 PolarHBondContact O-N 3.26Å
549	L	35.5	Very low	49.8	Very low	100 Å²	100	101 Å²	101	52%	0.524	51%	0.514	S	S	.	.			trans	-88.7	59.9	164	-133.8	100.6	0	0	0	110.1	Q547	Q547-L549 PolarHBondContact O-N 2.92Å
550	I	38.1	Very low	52.6	Low	95 Å²	95	94.8 Å²	94.8	49%	0.487	48%	0.477	S	S	.	.			trans	-80.5	116.2	159.8	-58.7	172.3	0	0	0	103.6	N548 S552	N548-I550 HydrophobicContact CB-CG1 4.44Å; N548-I550 PolarHBondContact O-N 3.26Å; I550-S552 PolarHBondContact O-N 3.19Å
551	I	49.1	Very low	55.3	Low	48 Å²	48	91.3 Å²	91.3	25%	0.246	45%	0.451	C	S	.	.			trans	-68.4	79.3	162.1	-55.1	177.8	0	0	0	105	L530 N553	L530-I551 HydrophobicContact CD2-CG2 4.39Å; L530-I551 WeakPolarHBondContact CD2-O 3.25Å; I551-N553 WeakPolarHBondContact CG2-O 3.17Å
552	S	52.9	Low	57.8	Low	52 Å²	52	83.5 Å²	83.5	36%	0.364	41%	0.411	S	S	.	.			trans	-81.8	-15.5	176.4	52.8	0	0	0	0	110.4	I550 R591 K592	I550-S552 PolarHBondContact O-N 3.19Å; S552-R591 CarbonylContact O-C 3.45Å; S552-R591 WeakPolarHBondContact O-CA 3.36Å; S552-K592 PolarHBondContact O-N 3.21Å
553	N	62.7	Low	60	Low	51 Å²	51	76.9 Å²	76.9	27%	0.273	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	140	-173	-39.6	-4.7	0	0	0	109	I551 S589 I590 R591	I551-N553 WeakPolarHBondContact CG2-O 3.17Å; N553-S589 WeakPolarHBondContact CB-OG 3.41Å; N553-I590 VanDerWaalsContact CA-O 3.3Å; N553-I590 WeakPolarHBondContact CA-O 3.19Å; N553-R591 WeakPolarHBondContact OD1-CG 3.37Å; N553-R591 PolarHBondContact OD1-NE 3.03Å
554	A	67.7	Low	61.8	Low	2 Å²	2	71.6 Å²	71.6	2%	0.017	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	134.8	165.1	0	0	0	0	0	108.2	F556 I590	A554-F556 HydrophobicContact CB-CD2 4.42Å; A554-F556 HydrophobicContact CB-CE2 3.57Å; A554-F556 HydrophobicContact CB-CZ 3.94Å; A554-F556 VanDerWaalsContact O-CD2 3.23Å; A554-F556 WeakPolarHBondContact O-CD2 3.33Å; A554-F556 WeakPolarHBondContact O-CE2 3.25Å; A554-I590 PolarHBondContact N-O 3.36Å; A554-I590 PolarHBondContact O-N 2.8Å
555	D	77.8	Confident	63.4	Low	40 Å²	40	71.6 Å²	71.6	21%	0.214	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	125.3	-179.1	-67.2	-11.5	0	0	0	109.5	V588 S589 S624 A627	D555-V588 CarbonylContact C-O 3.49Å; D555-V588 WeakPolarHBondContact CA-O 3.48Å; D555-S589 WeakPolarHBondContact OD1-CA 3.41Å; D555-S589 WeakPolarHBondContact OD1-CB 3.26Å; D555-S589 PolarHBondContact OD1-OG 2.92Å; D555-S624 WeakPolarHBondContact O-CB 3.17Å; D555-S624 PolarHBondContact O-N 2.87Å; D555-A627 HydrophobicContact CB-CB 3.57Å; D555-A627 VanDerWaalsContact OD2-CB 3.26Å; D555-A627 WeakPolarHBondContact OD2-CB 3.28Å
556	F	78.5	Confident	64.9	Low	3 Å²	3	63.2 Å²	63.2	1%	0.013	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	147.6	-178.3	-67.9	-90.7	0	0	0	111.2	V488 V490 L527 A554 L558 S587 V588 I590 S622 I623	V488-F556 HydrophobicContact CG1-CZ 4.08Å; V490-F556 HydrophobicContact CG2-CE1 3.78Å; V490-F556 HydrophobicContact CG2-CE2 4.13Å; V490-F556 HydrophobicContact CG2-CZ 3.34Å; L527-F556 HydrophobicContact CD1-CE2 3.85Å; L527-F556 HydrophobicContact CD1-CZ 4.15Å; A554-F556 HydrophobicContact CB-CD2 4.42Å; A554-F556 HydrophobicContact CB-CE2 3.57Å; A554-F556 HydrophobicContact CB-CZ 3.94Å; A554-F556 VanDerWaalsContact O-CD2 3.23Å; A554-F556 WeakPolarHBondContact O-CD2 3.33Å; A554-F556 WeakPolarHBondContact O-CE2 3.25Å; F556-L558 HydrophobicContact CB-CD2 4.46Å; F556-S587 PolarHBondContact O-N 2.95Å; F556-V588 HydrophobicContact CB-CB 4.49Å; F556-V588 PolarHBondContact N-O 2.86Å; F556-V588 WeakPolarHBondContact O-CB 3.39Å; F556-V588 PolarHBondContact O-N 3.32Å; F556-I590 HydrophobicContact CD2-CB 4.18Å; F556-I590 HydrophobicContact CD2-CD1 3.57Å; F556-I590 HydrophobicContact CD2-CG1 3.81Å; F556-I590 HydrophobicContact CE2-CB 4.16Å; F556-I590 HydrophobicContact CE2-CD1 3.99Å; F556-I590 HydrophobicContact CE2-CG1 4.26Å; F556-I590 HydrophobicContact CG-CD1 4.23Å; F556-S622 CarbonylContact C-O 3.58Å; F556-S622 VanDerWaalsContact CA-O 3.26Å; F556-S622 WeakPolarHBondContact CA-O 3.07Å; F556-S622 WeakPolarHBondContact CD1-O 3.33Å; F556-I623 HydrophobicContact CD1-CG1 4.28Å; F556-I623 HydrophobicContact CE1-CG1 3.83Å; F556-I623 HydrophobicContact CZ-CG1 4.46Å
557	R	85.9	Confident	66.4	Low	106 Å²	106	57.8 Å²	57.8	40%	0.4	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	123.9	163	-176.7	176	-158.1	-173.6	3.4	108.3	T584 L585 D586 Y621 S622	R557-T584 HydrophobicContact CG-CG2 4.43Å; R557-L585 WeakPolarHBondContact CA-O 3.49Å; R557-D586 WeakPolarHBondContact CD-OD1 3.47Å; R557-D586 WeakPolarHBondContact CG-OD1 3.47Å; R557-D586 IonicContact CZ-OD1 3.8Å; R557-D586 IonicContact NE-OD1 2.91Å; R557-D586 PolarHBondContact NE-OD1 3.01Å; R557-D586 IonicContact NH2-OD1 2.78Å; R557-Y621 WeakPolarHBondContact O-CA 3.48Å; R557-S622 PolarHBondContact N-O 3.1Å; R557-S622 PolarHBondContact O-N 3Å
558	L	86.3	Confident	67.5	Low	1 Å²	1	57.2 Å²	57.2	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	129.8	178.8	-56.8	174.5	0	0	0	109.7	F525 F556 T584 L585 V588 W596 V619 N620	F525-L558 HydrophobicContact CD2-CD1 4.27Å; F525-L558 HydrophobicContact CE1-CD2 4.25Å; F525-L558 HydrophobicContact CE2-CD1 3.74Å; F525-L558 HydrophobicContact CE2-CD2 3.62Å; F525-L558 HydrophobicContact CE2-CG 4.35Å; F525-L558 HydrophobicContact CZ-CD1 4.46Å; F525-L558 HydrophobicContact CZ-CD2 3.48Å; F525-L558 VanDerWaalsContact CZ-CD2 3.48Å; F556-L558 HydrophobicContact CB-CD2 4.46Å; L558-T584 CarbonylContact O-C 3.57Å; L558-T584 WeakPolarHBondContact O-CA 3.49Å; L558-L585 HydrophobicContact CB-CB 4.26Å; L558-L585 HydrophobicContact CD1-CD1 4.46Å; L558-L585 PolarHBondContact N-O 3.34Å; L558-L585 PolarHBondContact O-N 3.29Å; L558-V588 HydrophobicContact CD1-CB 4.26Å; L558-V588 HydrophobicContact CD1-CG1 4.24Å; L558-V588 HydrophobicContact CD1-CG2 3.87Å; L558-V588 HydrophobicContact CG-CG2 4.22Å; L558-W596 HydrophobicContact CD1-CH2 3.62Å; L558-W596 HydrophobicContact CD1-CZ3 3.49Å; L558-W596 VanDerWaalsContact CD1-CZ3 3.49Å; L558-V619 HydrophobicContact CD2-CG1 4.4Å; L558-N620 CarbonylContact C-O 3.52Å; L558-N620 WeakPolarHBondContact CA-O 3.42Å
559	I	88.7	Confident	69.2	Low	40 Å²	40	56 Å²	56	21%	0.205	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	110.6	174.1	-55.6	173.4	0	0	0	107.8	Q582 T584 V619 N620	I559-Q582 HydrophobicContact CG2-CG 3.8Å; I559-T584 HydrophobicContact CG1-CG2 4.36Å; I559-V619 WeakPolarHBondContact O-CA 3.35Å; I559-N620 HydrophobicContact CB-CB 4.3Å; I559-N620 PolarHBondContact N-O 3.48Å; I559-N620 PolarHBondContact O-N 2.88Å
560	I	87.4	Confident	71.2	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	113.8	-179.3	-51.1	175.1	0	0	0	108.7	V523 F574 Q582 L583 L585 I617 Q618 V619	V523-I560 HydrophobicContact CG2-CD1 4.12Å; I560-F574 HydrophobicContact CB-CZ 4.14Å; I560-F574 HydrophobicContact CG2-CE1 4.42Å; I560-F574 HydrophobicContact CG2-CZ 3.83Å; I560-Q582 CarbonylContact O-C 3.33Å; I560-Q582 WeakPolarHBondContact O-CA 3.28Å; I560-L583 HydrophobicContact CB-CB 4.46Å; I560-L583 HydrophobicContact CD1-CD2 4.33Å; I560-L583 PolarHBondContact N-O 3.01Å; I560-L583 PolarHBondContact O-N 2.88Å; I560-L585 HydrophobicContact CD1-CD1 4.16Å; I560-I617 HydrophobicContact CG2-CG2 3.95Å; I560-Q618 CarbonylContact C-O 3.48Å; I560-Q618 WeakPolarHBondContact CA-O 3.22Å; I560-V619 HydrophobicContact CG1-CG1 4.35Å; I560-V619 HydrophobicContact CG1-CG2 4.18Å; I560-V619 HydrophobicContact CG2-CG2 4.24Å
561	N	88.3	Confident	73.3	Confident	24 Å²	24	47.4 Å²	47.4	13%	0.128	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.1	177.8	-62.8	-46.3	0	0	0	110.7	A564 Q582 I617 Q618	N561-A564 HydrophobicContact CB-CB 3.87Å; N561-Q582 WeakPolarHBondContact OD1-CB 3.29Å; N561-Q582 WeakPolarHBondContact OD1-CG 3.37Å; N561-Q582 PolarHBondContact OD1-OE1 2.85Å; N561-I617 WeakPolarHBondContact O-CA 3.34Å; N561-Q618 HydrophobicContact CB-CB 4.38Å; N561-Q618 PolarHBondContact N-O 2.82Å; N561-Q618 PolarHBondContact O-N 3.06Å
562	L	86.1	Confident	75	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.016	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	122.7	174.3	-56.1	178.3	0	0	0	110.5	L521 A564 S570 A572 F574 T581 I602 I617	L521-L562 HydrophobicContact CD1-CD2 3.73Å; L562-A564 VanDerWaalsContact C-N 3.29Å; L562-A564 PolarHBondContact O-N 3.01Å; L562-S570 PolarHBondContact O-OG 3.22Å; L562-A572 HydrophobicContact CB-CB 4.49Å; L562-A572 HydrophobicContact CD1-CB 4.37Å; L562-F574 HydrophobicContact CD1-CD1 4.2Å; L562-F574 HydrophobicContact CD1-CD2 3.76Å; L562-F574 HydrophobicContact CD1-CE1 4.07Å; L562-F574 HydrophobicContact CD1-CE2 3.61Å; L562-F574 HydrophobicContact CD1-CG 4.06Å; L562-F574 HydrophobicContact CD1-CZ 3.77Å; L562-F574 HydrophobicContact CD2-CE1 4.39Å; L562-F574 HydrophobicContact CD2-CZ 4Å; L562-F574 HydrophobicContact CG-CD2 4.36Å; L562-F574 HydrophobicContact CG-CE1 4.34Å; L562-F574 HydrophobicContact CG-CE2 3.7Å; L562-F574 HydrophobicContact CG-CZ 3.68Å; L562-T581 PolarHBondContact N-O 2.89Å; L562-I602 HydrophobicContact CD1-CB 4.22Å; L562-I602 HydrophobicContact CD1-CG2 3.58Å; L562-I602 HydrophobicContact CD2-CD1 4.46Å; L562-I602 HydrophobicContact CD2-CG2 4Å; L562-I602 HydrophobicContact CG-CG2 4.44Å; L562-I617 HydrophobicContact CD2-CG1 4.01Å; L562-I617 HydrophobicContact CD2-CG2 4.29Å
563	D	82.3	Confident	76.4	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.027	24%	0.243	C	C	.	.	S	Bend	trans	55.7	44.3	178.2	-146.8	13	0	0	0	111.7	K565 K566 S570 R571 I615 V616	D563-K565 PolarHBondContact O-N 3.23Å; D563-K566 PolarHBondContact O-N 2.9Å; D563-K566 WeakPolarHBondContact OD2-CD 3.09Å; D563-S570 VanDerWaalsContact CB-OG 3.31Å; D563-S570 WeakPolarHBondContact CB-OG 3.39Å; D563-R571 IonicContact OD1-CZ 2.91Å; D563-R571 IonicContact OD1-NE 3.51Å; D563-R571 IonicContact OD1-NH2 3.1Å; D563-R571 PolarHBondContact OD1-NH2 2.89Å; D563-R571 WeakPolarHBondContact OD2-CG 3.41Å; D563-R571 IonicContact OD2-CZ 2.76Å; D563-R571 PolarHBondContact OD2-N 2.8Å; D563-R571 IonicContact OD2-NE 3.92Å; D563-R571 PolarHBondContact OD2-NE 3.35Å; D563-R571 IonicContact OD2-NH2 3.74Å; D563-R571 PolarHBondContact OD2-NH2 3.07Å; D563-I615 HydrophobicContact CB-CG2 4.43Å; D563-V616 WeakPolarHBondContact CA-O 3.38Å; D563-V616 PolarHBondContact N-O 2.94Å
564	A	69.4	Low	77.4	Confident	40 Å²	40	43.4 Å²	43.4	33%	0.331	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-52.8	-31.9	-170.2	0	0	0	0	0	113.9	N561 L562 K566 Q618	N561-A564 HydrophobicContact CB-CB 3.87Å; L562-A564 VanDerWaalsContact C-N 3.29Å; L562-A564 PolarHBondContact O-N 3.01Å; A564-K566 VanDerWaalsContact C-N 3.25Å; A564-K566 PolarHBondContact O-N 3.12Å; A564-Q618 HydrophobicContact CB-CG 4.3Å
565	K	68.4	Low	77.9	Confident	183 Å²	183	45.7 Å²	45.7	80%	0.796	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-68.7	-18.8	177.8	-69.5	-174.9	177.5	178.8	0	113.8	D563	D563-K565 PolarHBondContact O-N 3.23Å
566	K	64.9	Low	77.5	Confident	63 Å²	63	49.2 Å²	49.2	27%	0.274	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-102	-6.4	-175.3	-67.7	-153.6	178.1	-176.5	0	115.2	D563 A564 L568 S569 D610	D563-K566 PolarHBondContact O-N 2.9Å; D563-K566 WeakPolarHBondContact OD2-CD 3.09Å; A564-K566 VanDerWaalsContact C-N 3.25Å; A564-K566 PolarHBondContact O-N 3.12Å; K566-L568 PolarHBondContact O-N 2.72Å; K566-L568 VanDerWaalsContact O-N 3.12Å; K566-S569 PolarHBondContact O-N 3.4Å; K566-D610 WeakPolarHBondContact CE-OD2 3.43Å; K566-D610 VanDerWaalsContact NZ-CG 3.34Å; K566-D610 IonicContact NZ-OD2 3.73Å; K566-D610 PolarHBondContact NZ-OD2 3.13Å
567	G	61.3	Low	76.9	Confident	48 Å²	48	50.6 Å²	50.6	50%	0.495	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	50	-117.4	177.3	0	0	0	0	0	112.9	S569 S570	G567-S569 PolarHBondContact O-N 2.93Å; G567-S570 WeakPolarHBondContact O-CB 3.19Å; G567-S570 PolarHBondContact O-N 3.25Å
568	L	57.1	Low	75.8	Confident	181 Å²	181	49.2 Å²	49.2	95%	0.948	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-63.6	-19	179.1	-78.3	134.9	0	0	0	114.4	K566	K566-L568 PolarHBondContact O-N 2.72Å; K566-L568 VanDerWaalsContact O-N 3.12Å
569	S	65.3	Low	74.9	Confident	89 Å²	89	53.6 Å²	53.6	62%	0.622	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-98	22	177.6	-57	0	0	0	0	113.2	K566 G567 R571	K566-S569 PolarHBondContact O-N 3.4Å; G567-S569 PolarHBondContact O-N 2.93Å; S569-R571 PolarHBondContact O-N 3.39Å
570	S	77.1	Confident	74.3	Confident	5 Å²	5	54.9 Å²	54.9	4%	0.035	30%	0.302	C	S	.	.			trans	-56.2	129.8	176.2	-179.4	0	0	0	0	111.2	L562 D563 G567 A572 I605	L562-S570 PolarHBondContact O-OG 3.22Å; D563-S570 VanDerWaalsContact CB-OG 3.31Å; D563-S570 WeakPolarHBondContact CB-OG 3.39Å; G567-S570 WeakPolarHBondContact O-CB 3.19Å; G567-S570 PolarHBondContact O-N 3.25Å; S570-A572 PolarHBondContact OG-O 3.42Å; S570-A572 VanDerWaalsContact OG-O 3.1Å; S570-I605 WeakPolarHBondContact O-CD1 3.16Å
571	R	82.8	Confident	73.9	Confident	9 Å²	9	57.1 Å²	57.1	3%	0.034	32%	0.315	C	S	.	.	S	Bend	trans	-82.7	-15.5	-176.4	-67	168.8	-74.1	163.4	9.9	113.6	D563 S569 V604 I605 I608 D610 N613 P614 I615	D563-R571 IonicContact OD1-CZ 2.91Å; D563-R571 IonicContact OD1-NE 3.51Å; D563-R571 IonicContact OD1-NH2 3.1Å; D563-R571 PolarHBondContact OD1-NH2 2.89Å; D563-R571 WeakPolarHBondContact OD2-CG 3.41Å; D563-R571 IonicContact OD2-CZ 2.76Å; D563-R571 PolarHBondContact OD2-N 2.8Å; D563-R571 IonicContact OD2-NE 3.92Å; D563-R571 PolarHBondContact OD2-NE 3.35Å; D563-R571 IonicContact OD2-NH2 3.74Å; D563-R571 PolarHBondContact OD2-NH2 3.07Å; S569-R571 PolarHBondContact O-N 3.39Å; R571-V604 WeakPolarHBondContact O-CA 3.29Å; R571-V604 WeakPolarHBondContact O-CG1 3.38Å; R571-I605 PolarHBondContact O-N 3.12Å; R571-I608 HydrophobicContact CB-CG2 3.91Å; R571-I608 HydrophobicContact CG-CB 4.23Å; R571-I608 HydrophobicContact CG-CG2 3.8Å; R571-D610 WeakPolarHBondContact CD-O 3.46Å; R571-D610 IonicContact CZ-OD2 3.18Å; R571-D610 PolarHBondContact NH1-O 3.22Å; R571-D610 VanDerWaalsContact NH1-O 3.1Å; R571-D610 IonicContact NH1-OD1 3.44Å; R571-D610 IonicContact NH1-OD2 2.91Å; R571-D610 PolarHBondContact NH1-OD2 3.44Å; R571-N613 PolarHBondContact NH1-O 2.91Å; R571-P614 PolarHBondContact NH2-O 2.87Å; R571-I615 HydrophobicContact CB-CD1 4.3Å; R571-I615 HydrophobicContact CB-CG1 4.46Å
572	A	83.3	Confident	73.7	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	150.5	-178.6	0	0	0	0	0	112.2	L562 S570 I602 Y603 I615	L562-A572 HydrophobicContact CB-CB 4.49Å; L562-A572 HydrophobicContact CD1-CB 4.37Å; S570-A572 PolarHBondContact OG-O 3.42Å; S570-A572 VanDerWaalsContact OG-O 3.1Å; A572-I602 HydrophobicContact CB-CD1 4.19Å; A572-Y603 CarbonylContact C-O 3.6Å; A572-Y603 VanDerWaalsContact CA-O 3.25Å; A572-Y603 WeakPolarHBondContact CA-O 3.36Å; A572-I615 HydrophobicContact CB-CD1 4.16Å; A572-I615 HydrophobicContact CB-CG2 3.77Å
573	R	83.3	Confident	73.7	Confident	67 Å²	67	61.9 Å²	61.9	25%	0.253	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	154.5	-179.5	-63.6	-179.3	-178.6	-117.1	-9.4	110.9	H578 I602 Y603 I605	R573-H578 WeakPolarHBondContact CD-O 3.38Å; R573-H578 PolarHBondContact NH1-O 3.26Å; R573-H578 VanDerWaalsContact NH1-O 3.12Å; R573-I602 CarbonylContact O-C 3.58Å; R573-I602 VanDerWaalsContact O-CA 3.23Å; R573-I602 WeakPolarHBondContact O-CA 3.23Å; R573-Y603 HydrophobicContact CB-CD1 4.16Å; R573-Y603 HydrophobicContact CB-CE1 3.53Å; R573-Y603 HydrophobicContact CB-CE2 4.41Å; R573-Y603 WeakPolarHBondContact CD-OH 3.31Å; R573-Y603 PolarHBondContact N-O 2.79Å; R573-Y603 WeakPolarHBondContact O-CD1 3.15Å; R573-Y603 PolarHBondContact O-N 3Å; R573-I605 HydrophobicContact CG-CD1 4.2Å; R573-I605 HydrophobicContact CG-CG1 4.21Å
574	F	83.8	Confident	73.9	Confident	1 Å²	1	64 Å²	64	0%	0.004	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	134.2	173.2	-69.1	-76.5	0	0	0	110.9	I560 L562 E576 S577 I580 L583 R600 I602	I560-F574 HydrophobicContact CB-CZ 4.14Å; I560-F574 HydrophobicContact CG2-CE1 4.42Å; I560-F574 HydrophobicContact CG2-CZ 3.83Å; L562-F574 HydrophobicContact CD1-CD1 4.2Å; L562-F574 HydrophobicContact CD1-CD2 3.76Å; L562-F574 HydrophobicContact CD1-CE1 4.07Å; L562-F574 HydrophobicContact CD1-CE2 3.61Å; L562-F574 HydrophobicContact CD1-CG 4.06Å; L562-F574 HydrophobicContact CD1-CZ 3.77Å; L562-F574 HydrophobicContact CD2-CE1 4.39Å; L562-F574 HydrophobicContact CD2-CZ 4Å; L562-F574 HydrophobicContact CG-CD2 4.36Å; L562-F574 HydrophobicContact CG-CE1 4.34Å; L562-F574 HydrophobicContact CG-CE2 3.7Å; L562-F574 HydrophobicContact CG-CZ 3.68Å; F574-E576 VanDerWaalsContact C-N 3.28Å; F574-E576 PolarHBondContact O-N 2.67Å; F574-S577 CarbonylContact O-C 3.58Å; F574-S577 PolarHBondContact O-N 3.18Å; F574-S577 VanDerWaalsContact O-O 3.14Å; F574-I580 HydrophobicContact CD2-CG2 4.32Å; F574-I580 WeakPolarHBondContact CD2-O 3.27Å; F574-I580 PolarHBondContact N-O 3.05Å; F574-L583 HydrophobicContact CD1-CB 4.46Å; F574-L583 HydrophobicContact CD1-CD2 4.31Å; F574-L583 HydrophobicContact CD2-CB 4.01Å; F574-L583 HydrophobicContact CE1-CB 4.01Å; F574-L583 HydrophobicContact CE1-CD2 3.99Å; F574-L583 HydrophobicContact CE2-CB 3.51Å; F574-L583 HydrophobicContact CG-CB 4.46Å; F574-L583 HydrophobicContact CZ-CB 3.51Å; F574-L583 HydrophobicContact CZ-CD2 4.31Å; F574-R600 HydrophobicContact CD1-CB 4.37Å; F574-R600 HydrophobicContact CE1-CB 4.21Å; F574-I602 HydrophobicContact CD1-CG2 3.88Å; F574-I602 HydrophobicContact CE1-CG2 4.02Å
575	L	77.2	Confident	74.5	Confident	49 Å²	49	63.2 Å²	63.2	26%	0.257	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-34.1	-177.7	-173.3	67	0	0	0	112.6	L510 S577 Y601 Y603	L510-L575 HydrophobicContact CD2-CD1 3.79Å; L575-S577 PolarHBondContact O-N 3.04Å; L575-Y601 HydrophobicContact CD2-CG 4.33Å; L575-Y601 PolarHBondContact N-O 3.28Å; L575-Y603 HydrophobicContact CD1-CD1 4.3Å
576	E	70.9	Confident	75.1	Confident	114 Å²	114	58.8 Å²	58.8	53%	0.533	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-21.3	-176.8	-68.4	149.8	-164.5	0	0	112.7	F574 R600	F574-E576 VanDerWaalsContact C-N 3.28Å; F574-E576 PolarHBondContact O-N 2.67Å; E576-R600 WeakPolarHBondContact OE2-CD 3.41Å; E576-R600 IonicContact OE2-NE 3.68Å
577	S	65.2	Low	75.5	Confident	33 Å²	33	58.9 Å²	58.9	23%	0.231	34%	0.335	C	S	.	.	S	Bend	trans	-153.3	102.6	-178.7	59.1	0	0	0	0	110.8	F574 L575 S579 I580	F574-S577 CarbonylContact O-C 3.58Å; F574-S577 PolarHBondContact O-N 3.18Å; F574-S577 VanDerWaalsContact O-O 3.14Å; L575-S577 PolarHBondContact O-N 3.04Å; S577-S579 PolarHBondContact O-N 2.82Å; S577-I580 PolarHBondContact O-N 3.49Å; S577-I580 WeakPolarHBondContact OG-CB 3.2Å; S577-I580 WeakPolarHBondContact OG-CD1 3.31Å; S577-I580 WeakPolarHBondContact OG-CG1 3.37Å
578	H	63.7	Low	76.3	Confident	77 Å²	77	57.2 Å²	57.2	36%	0.356	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-9.1	-171.7	-63	77.5	0	0	0	116.4	R573 Y603	R573-H578 WeakPolarHBondContact CD-O 3.38Å; R573-H578 PolarHBondContact NH1-O 3.26Å; R573-H578 VanDerWaalsContact NH1-O 3.12Å; H578-Y603 PolarHBondContact O-OH 3.47Å
579	S	65.8	Low	77.2	Confident	92 Å²	92	51.1 Å²	51.1	64%	0.643	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	-5.6	-178.8	51.1	0	0	0	0	114.9	S577	S577-S579 PolarHBondContact O-N 2.82Å
580	I	75.9	Confident	77.6	Confident	68 Å²	68	47 Å²	47	35%	0.349	26%	0.258	S	S	.	.			trans	-101.6	127	-166.6	-54.7	-169.4	0	0	0	111.3	F574 S577 Q582	F574-I580 HydrophobicContact CD2-CG2 4.32Å; F574-I580 WeakPolarHBondContact CD2-O 3.27Å; F574-I580 PolarHBondContact N-O 3.05Å; S577-I580 PolarHBondContact O-N 3.49Å; S577-I580 WeakPolarHBondContact OG-CB 3.2Å; S577-I580 WeakPolarHBondContact OG-CD1 3.31Å; S577-I580 WeakPolarHBondContact OG-CG1 3.37Å; I580-Q582 WeakPolarHBondContact CG2-O 3.37Å
581	T	80.2	Confident	77.2	Confident	48 Å²	48	52.8 Å²	52.8	29%	0.294	28%	0.28	S	S	.	.	S	Bend	trans	-105.1	-11.2	173.1	54.1	0	0	0	0	112.6	L562	L562-T581 PolarHBondContact N-O 2.89Å
582	Q	84.9	Confident	76.4	Confident	96 Å²	96	56.2 Å²	56.2	45%	0.449	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	122	179.4	171.5	178.8	-25.2	0	0	110.2	I559 I560 N561 I580	I559-Q582 HydrophobicContact CG2-CG 3.8Å; I560-Q582 CarbonylContact O-C 3.33Å; I560-Q582 WeakPolarHBondContact O-CA 3.28Å; N561-Q582 WeakPolarHBondContact OD1-CB 3.29Å; N561-Q582 WeakPolarHBondContact OD1-CG 3.37Å; N561-Q582 PolarHBondContact OD1-OE1 2.85Å; I580-Q582 WeakPolarHBondContact CG2-O 3.37Å
583	L	85	Confident	75.5	Confident	32 Å²	32	59.6 Å²	59.6	17%	0.168	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127.5	175.7	175.4	70	0	0	0	109.9	I560 F574 L585 R600	I560-L583 HydrophobicContact CB-CB 4.46Å; I560-L583 HydrophobicContact CD1-CD2 4.33Å; I560-L583 PolarHBondContact N-O 3.01Å; I560-L583 PolarHBondContact O-N 2.88Å; F574-L583 HydrophobicContact CD1-CB 4.46Å; F574-L583 HydrophobicContact CD1-CD2 4.31Å; F574-L583 HydrophobicContact CD2-CB 4.01Å; F574-L583 HydrophobicContact CE1-CB 4.01Å; F574-L583 HydrophobicContact CE1-CD2 3.99Å; F574-L583 HydrophobicContact CE2-CB 3.51Å; F574-L583 HydrophobicContact CG-CB 4.46Å; F574-L583 HydrophobicContact CZ-CB 3.51Å; F574-L583 HydrophobicContact CZ-CD2 4.31Å; L583-L585 HydrophobicContact CD2-CD2 4.2Å; L583-L585 HydrophobicContact CG-CD2 4.27Å; L583-R600 HydrophobicContact CD2-CG 3.72Å
584	T	85.9	Confident	74.7	Confident	49 Å²	49	61.5 Å²	61.5	30%	0.301	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.7	173.8	-54.1	0	0	0	0	109.6	R557 L558 I559 D586	R557-T584 HydrophobicContact CG-CG2 4.43Å; L558-T584 CarbonylContact O-C 3.57Å; L558-T584 WeakPolarHBondContact O-CA 3.49Å; I559-T584 HydrophobicContact CG1-CG2 4.36Å; T584-D586 VanDerWaalsContact CG2-OD1 3.3Å; T584-D586 WeakPolarHBondContact CG2-OD1 3.49Å
585	L	83.5	Confident	73.9	Confident	24 Å²	24	70.8 Å²	70.8	13%	0.126	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	104.6	169.8	-55.2	172.9	0	0	0	107.8	R557 L558 I560 L583 V588 W596 E598	R557-L585 WeakPolarHBondContact CA-O 3.49Å; L558-L585 HydrophobicContact CB-CB 4.26Å; L558-L585 HydrophobicContact CD1-CD1 4.46Å; L558-L585 PolarHBondContact N-O 3.34Å; L558-L585 PolarHBondContact O-N 3.29Å; I560-L585 HydrophobicContact CD1-CD1 4.16Å; L583-L585 HydrophobicContact CD2-CD2 4.2Å; L583-L585 HydrophobicContact CG-CD2 4.27Å; L585-V588 HydrophobicContact CB-CG2 3.87Å; L585-W596 HydrophobicContact CD1-CH2 4.26Å; L585-E598 HydrophobicContact CD1-CG 4Å
586	D	80.3	Confident	73.7	Confident	89 Å²	89	71.1 Å²	71.1	48%	0.476	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	147	175.4	-61.5	-46	0	0	0	109.9	R557 T584	R557-D586 WeakPolarHBondContact CD-OD1 3.47Å; R557-D586 WeakPolarHBondContact CG-OD1 3.47Å; R557-D586 IonicContact CZ-OD1 3.8Å; R557-D586 IonicContact NE-OD1 2.91Å; R557-D586 PolarHBondContact NE-OD1 3.01Å; R557-D586 IonicContact NH2-OD1 2.78Å; T584-D586 VanDerWaalsContact CG2-OD1 3.3Å; T584-D586 WeakPolarHBondContact CG2-OD1 3.49Å
587	S	74.2	Confident	73.8	Confident	66 Å²	66	68.3 Å²	68.3	46%	0.462	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	60	47.5	174	-51.9	0	0	0	0	116.4	F556 S589	F556-S587 PolarHBondContact O-N 2.95Å; S587-S589 PolarHBondContact O-N 3.35Å
588	V	77.1	Confident	74.4	Confident	13 Å²	13	69 Å²	69	8%	0.079	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	103.3	172.9	-179.6	0	0	0	0	110.9	D555 F556 L558 L585 I590 W596	D555-V588 CarbonylContact C-O 3.49Å; D555-V588 WeakPolarHBondContact CA-O 3.48Å; F556-V588 HydrophobicContact CB-CB 4.49Å; F556-V588 PolarHBondContact N-O 2.86Å; F556-V588 WeakPolarHBondContact O-CB 3.39Å; F556-V588 PolarHBondContact O-N 3.32Å; L558-V588 HydrophobicContact CD1-CB 4.26Å; L558-V588 HydrophobicContact CD1-CG1 4.24Å; L558-V588 HydrophobicContact CD1-CG2 3.87Å; L558-V588 HydrophobicContact CG-CG2 4.22Å; L585-V588 HydrophobicContact CB-CG2 3.87Å; V588-I590 HydrophobicContact CG1-CD1 4.49Å; V588-I590 HydrophobicContact CG1-CG1 4.02Å; V588-I590 PolarHBondContact O-N 3.1Å; V588-W596 HydrophobicContact CB-CH2 4.45Å; V588-W596 HydrophobicContact CB-CZ2 4.33Å; V588-W596 HydrophobicContact CG1-CD2 3.69Å; V588-W596 HydrophobicContact CG1-CE3 4Å; V588-W596 HydrophobicContact CG1-CG 4.35Å; V588-W596 HydrophobicContact CG1-CH2 3.55Å; V588-W596 HydrophobicContact CG1-CZ2 3.28Å; V588-W596 HydrophobicContact CG1-CZ3 3.94Å; V588-W596 HydrophobicContact CG2-CH2 4.04Å; V588-W596 HydrophobicContact CG2-CZ2 4.07Å
589	S	76.6	Confident	75	Confident	52 Å²	52	72.7 Å²	72.7	36%	0.364	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	109.3	179.9	-149.4	0	0	0	0	111.8	N553 D555 S587	N553-S589 WeakPolarHBondContact CB-OG 3.41Å; D555-S589 WeakPolarHBondContact OD1-CA 3.41Å; D555-S589 WeakPolarHBondContact OD1-CB 3.26Å; D555-S589 PolarHBondContact OD1-OG 2.92Å; S587-S589 PolarHBondContact O-N 3.35Å
590	I	72.3	Confident	75.7	Confident	2 Å²	2	70.2 Å²	70.2	1%	0.01	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	124.6	179.6	-53.1	-179.8	0	0	0	110	F525 L527 N553 A554 F556 V588 W596	F525-I590 HydrophobicContact CB-CD1 3.82Å; F525-I590 HydrophobicContact CG-CD1 4.25Å; L527-I590 HydrophobicContact CB-CG2 3.78Å; L527-I590 HydrophobicContact CD1-CB 3.97Å; L527-I590 HydrophobicContact CD1-CG2 3.73Å; L527-I590 HydrophobicContact CG-CG2 4.41Å; N553-I590 VanDerWaalsContact CA-O 3.3Å; N553-I590 WeakPolarHBondContact CA-O 3.19Å; A554-I590 PolarHBondContact N-O 3.36Å; A554-I590 PolarHBondContact O-N 2.8Å; F556-I590 HydrophobicContact CD2-CB 4.18Å; F556-I590 HydrophobicContact CD2-CD1 3.57Å; F556-I590 HydrophobicContact CD2-CG1 3.81Å; F556-I590 HydrophobicContact CE2-CB 4.16Å; F556-I590 HydrophobicContact CE2-CD1 3.99Å; F556-I590 HydrophobicContact CE2-CG1 4.26Å; F556-I590 HydrophobicContact CG-CD1 4.23Å; V588-I590 HydrophobicContact CG1-CD1 4.49Å; V588-I590 HydrophobicContact CG1-CG1 4.02Å; V588-I590 PolarHBondContact O-N 3.1Å; I590-W596 HydrophobicContact CG1-CB 4.18Å; I590-W596 HydrophobicContact CG1-CG 4.39Å; I590-W596 HydrophobicContact CG2-CB 4.22Å
591	R	69.9	Low	75.9	Confident	128 Å²	128	71.5 Å²	71.5	48%	0.483	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	142.6	178.9	-61.4	-165.6	171	164.8	-0.2	113.1	S552 N553 G593 E594	S552-R591 CarbonylContact O-C 3.45Å; S552-R591 WeakPolarHBondContact O-CA 3.36Å; N553-R591 WeakPolarHBondContact OD1-CG 3.37Å; N553-R591 PolarHBondContact OD1-NE 3.03Å; R591-G593 PolarHBondContact O-N 2.93Å; R591-E594 HydrophobicContact CB-CB 4.1Å; R591-E594 HydrophobicContact CB-CG 4.17Å; R591-E594 WeakPolarHBondContact CD-OE2 3.37Å; R591-E594 PolarHBondContact O-N 3.27Å
592	K	65.1	Low	76	Confident	81 Å²	81	69.3 Å²	69.3	35%	0.352	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	124.7	174.5	-174.7	-178.2	-173.9	158.1	0	110.9	L527 L530 S552 E594	L527-K592 HydrophobicContact CD2-CB 4.04Å; L527-K592 HydrophobicContact CD2-CG 4.31Å; L530-K592 HydrophobicContact CB-CD 3.95Å; L530-K592 HydrophobicContact CB-CG 4.33Å; L530-K592 PolarHBondContact O-NZ 2.64Å; S552-K592 PolarHBondContact O-N 3.21Å; K592-E594 VanDerWaalsContact C-N 3.27Å; K592-E594 PolarHBondContact O-N 3Å
593	G	65.5	Low	75.8	Confident	70 Å²	70	65.5 Å²	65.5	72%	0.722	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.2	-9.5	178.5	0	0	0	0	0	115.3	L527 R591	L527-G593 PolarHBondContact O-N 3.36Å; R591-G593 PolarHBondContact O-N 2.93Å
594	E	66.6	Low	75.6	Confident	107 Å²	107	64 Å²	64	50%	0.5	31%	0.314	S	S	.	.			trans	-92.2	146.1	171.9	-69.6	-177.2	177.5	0	0	110.7	R591 K592	R591-E594 HydrophobicContact CB-CB 4.1Å; R591-E594 HydrophobicContact CB-CG 4.17Å; R591-E594 WeakPolarHBondContact CD-OE2 3.37Å; R591-E594 PolarHBondContact O-N 3.27Å; K592-E594 VanDerWaalsContact C-N 3.27Å; K592-E594 PolarHBondContact O-N 3Å
595	R	66.1	Low	75.2	Confident	197 Å²	197	64.1 Å²	64.1	74%	0.743	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	108.7	171.8	-73.3	-177.6	174.7	171.2	-1.4	108.7	P526	P526-R595 HydrophobicContact CB-CG 4.18Å
596	W	73.4	Confident	74.3	Confident	56 Å²	56	66.9 Å²	66.9	21%	0.212	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	135.7	170.7	-175.4	88.1	0	0	0	109.8	F525 L558 L585 V588 I590 E598	F525-W596 HydrophobicContact CB-CE3 4.5Å; F525-W596 AromaticContact CD2-CE3 3.94Å; F525-W596 HydrophobicContact CD2-CE3 3.94Å; F525-W596 AromaticContact CD2-CZ3 3.96Å; F525-W596 HydrophobicContact CD2-CZ3 3.96Å; F525-W596 HydrophobicContact CE2-CZ3 4.43Å; F525-W596 PolarHBondContact N-O 3.48Å; F525-W596 PolarHBondContact O-N 3.48Å; F525-W596 VanDerWaalsContact O-N 3.08Å; L558-W596 HydrophobicContact CD1-CH2 3.62Å; L558-W596 HydrophobicContact CD1-CZ3 3.49Å; L558-W596 VanDerWaalsContact CD1-CZ3 3.49Å; L585-W596 HydrophobicContact CD1-CH2 4.26Å; V588-W596 HydrophobicContact CB-CH2 4.45Å; V588-W596 HydrophobicContact CB-CZ2 4.33Å; V588-W596 HydrophobicContact CG1-CD2 3.69Å; V588-W596 HydrophobicContact CG1-CE3 4Å; V588-W596 HydrophobicContact CG1-CG 4.35Å; V588-W596 HydrophobicContact CG1-CH2 3.55Å; V588-W596 HydrophobicContact CG1-CZ2 3.28Å; V588-W596 HydrophobicContact CG1-CZ3 3.94Å; V588-W596 HydrophobicContact CG2-CH2 4.04Å; V588-W596 HydrophobicContact CG2-CZ2 4.07Å; I590-W596 HydrophobicContact CG1-CB 4.18Å; I590-W596 HydrophobicContact CG1-CG 4.39Å; I590-W596 HydrophobicContact CG2-CB 4.22Å; W596-E598 HydrophobicContact CE3-CB 4.46Å; W596-E598 HydrophobicContact CH2-CB 3.29Å; W596-E598 HydrophobicContact CH2-CG 3.91Å; W596-E598 HydrophobicContact CZ2-CB 3.74Å; W596-E598 HydrophobicContact CZ2-CG 4.2Å; W596-E598 HydrophobicContact CZ3-CB 3.67Å
597	C	73.8	Confident	73.6	Confident	54 Å²	54	70 Å²	70	37%	0.365	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	124.2	-178	-178.5	0	0	0	0	110.3	V523 L524	V523-C597 CarbonylContact O-C 3.46Å; V523-C597 VanDerWaalsContact O-CA 3.31Å; V523-C597 WeakPolarHBondContact O-CA 3.39Å; L524-C597 HydrophobicContact CD2-CB 3.87Å; L524-C597 HydrophobicContact CG-CB 4.15Å
598	E	76.3	Confident	73.3	Confident	47 Å²	47	67.7 Å²	67.7	22%	0.22	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	138.9	175	-168.4	67.3	-179.4	0	0	111.2	K522 V523 L585 W596 R600	K522-E598 WeakPolarHBondContact CA-O 3.27Å; V523-E598 PolarHBondContact N-O 2.95Å; V523-E598 PolarHBondContact O-N 3.19Å; L585-E598 HydrophobicContact CD1-CG 4Å; W596-E598 HydrophobicContact CE3-CB 4.46Å; W596-E598 HydrophobicContact CH2-CB 3.29Å; W596-E598 HydrophobicContact CH2-CG 3.91Å; W596-E598 HydrophobicContact CZ2-CB 3.74Å; W596-E598 HydrophobicContact CZ2-CG 4.2Å; W596-E598 HydrophobicContact CZ3-CB 3.67Å; E598-R600 IonicContact OE1-CZ 3.14Å; E598-R600 IonicContact OE1-NH1 2.71Å; E598-R600 PolarHBondContact OE1-NH1 3.03Å; E598-R600 IonicContact OE1-NH2 2.76Å; E598-R600 PolarHBondContact OE1-NH2 3.37Å
599	R	77.6	Confident	72.4	Confident	156 Å²	156	79.2 Å²	79.2	59%	0.589	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.5	127.6	178.4	-69.7	-174.6	-81.3	-173	-5.5	110.1	V520 L521 K522	V520-R599 HydrophobicContact CG1-CB 4.39Å; V520-R599 HydrophobicContact CG1-CG 4.5Å; L521-R599 CarbonylContact O-C 3.45Å; L521-R599 VanDerWaalsContact O-CA 3.3Å; L521-R599 WeakPolarHBondContact O-CA 3.34Å; K522-R599 HydrophobicContact CG-CG 4.16Å
600	R	80.4	Confident	71.8	Confident	39 Å²	39	78.1 Å²	78.1	15%	0.147	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	139.8	174.3	-75.3	-68.6	178.9	-78.8	-8.8	110.7	L521 F574 E576 L583 E598	L521-R600 WeakPolarHBondContact CB-O 3.35Å; L521-R600 PolarHBondContact N-O 2.92Å; L521-R600 PolarHBondContact O-N 3.27Å; F574-R600 HydrophobicContact CD1-CB 4.37Å; F574-R600 HydrophobicContact CE1-CB 4.21Å; E576-R600 WeakPolarHBondContact OE2-CD 3.41Å; E576-R600 IonicContact OE2-NE 3.68Å; L583-R600 HydrophobicContact CD2-CG 3.72Å; E598-R600 IonicContact OE1-CZ 3.14Å; E598-R600 IonicContact OE1-NH1 2.71Å; E598-R600 PolarHBondContact OE1-NH1 3.03Å; E598-R600 IonicContact OE1-NH2 2.76Å; E598-R600 PolarHBondContact OE1-NH2 3.37Å
601	Y	79.7	Confident	71.5	Confident	96 Å²	96	83.2 Å²	83.2	38%	0.376	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	128.4	178.2	-62.2	-88.9	0	0	0	109.4	W518 V520 L575	W518-Y601 AromaticContact CE3-CD1 3.86Å; W518-Y601 HydrophobicContact CE3-CD1 3.86Å; W518-Y601 HydrophobicContact CE3-CE1 4.38Å; W518-Y601 AromaticContact CZ3-CD1 3.66Å; W518-Y601 HydrophobicContact CZ3-CD1 3.66Å; W518-Y601 AromaticContact CZ3-CE1 3.71Å; W518-Y601 HydrophobicContact CZ3-CE1 3.71Å; V520-Y601 HydrophobicContact CG2-CD1 3.85Å; V520-Y601 HydrophobicContact CG2-CE1 3.6Å; L575-Y601 HydrophobicContact CD2-CG 4.33Å; L575-Y601 PolarHBondContact N-O 3.28Å
602	I	81.7	Confident	71.1	Confident	1 Å²	1	81.5 Å²	81.5	1%	0.005	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	151	172.8	67.1	163	0	0	0	109.7	W518 C519 L521 L562 A572 R573 F574	W518-I602 CarbonylContact C-O 3.51Å; W518-I602 VanDerWaalsContact CA-O 3.31Å; W518-I602 WeakPolarHBondContact CA-O 3.2Å; C519-I602 PolarHBondContact N-O 3.27Å; C519-I602 PolarHBondContact O-N 2.84Å; C519-I602 VanDerWaalsContact SG-CD1 3.55Å; C519-I602 WeakPolarHBondContact SG-CG1 3.12Å; L521-I602 HydrophobicContact CD1-CB 4.5Å; L521-I602 HydrophobicContact CD1-CD1 3.95Å; L521-I602 HydrophobicContact CD1-CG1 4.21Å; L521-I602 HydrophobicContact CD1-CG2 3.52Å; L521-I602 HydrophobicContact CD2-CD1 3.76Å; L521-I602 HydrophobicContact CD2-CG1 4.09Å; L521-I602 HydrophobicContact CG-CD1 3.93Å; L521-I602 HydrophobicContact CG-CG1 3.9Å; L521-I602 HydrophobicContact CG-CG2 3.88Å; L562-I602 HydrophobicContact CD1-CB 4.22Å; L562-I602 HydrophobicContact CD1-CG2 3.58Å; L562-I602 HydrophobicContact CD2-CD1 4.46Å; L562-I602 HydrophobicContact CD2-CG2 4Å; L562-I602 HydrophobicContact CG-CG2 4.44Å; A572-I602 HydrophobicContact CB-CD1 4.19Å; R573-I602 CarbonylContact O-C 3.58Å; R573-I602 VanDerWaalsContact O-CA 3.23Å; R573-I602 WeakPolarHBondContact O-CA 3.23Å; F574-I602 HydrophobicContact CD1-CG2 3.88Å; F574-I602 HydrophobicContact CE1-CG2 4.02Å
603	Y	81.5	Confident	71.3	Confident	16 Å²	16	82 Å²	82	6%	0.063	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	150.9	171.1	74.4	-85.2	0	0	0	110.3	L510 V516 P517 A572 R573 L575 H578	L510-Y603 HydrophobicContact CD1-CD2 4.37Å; L510-Y603 HydrophobicContact CD1-CE2 3.96Å; L510-Y603 HydrophobicContact CD2-CD1 4.26Å; L510-Y603 HydrophobicContact CD2-CE1 4.13Å; L510-Y603 HydrophobicContact CD2-CG 4.5Å; V516-Y603 HydrophobicContact CB-CD2 4.08Å; V516-Y603 HydrophobicContact CG1-CD2 4.15Å; V516-Y603 HydrophobicContact CG2-CD2 3.94Å; V516-Y603 HydrophobicContact CG2-CG 4.01Å; P517-Y603 WeakPolarHBondContact O-CA 3.49Å; P517-Y603 WeakPolarHBondContact O-CB 3.13Å; A572-Y603 CarbonylContact C-O 3.6Å; A572-Y603 VanDerWaalsContact CA-O 3.25Å; A572-Y603 WeakPolarHBondContact CA-O 3.36Å; R573-Y603 HydrophobicContact CB-CD1 4.16Å; R573-Y603 HydrophobicContact CB-CE1 3.53Å; R573-Y603 HydrophobicContact CB-CE2 4.41Å; R573-Y603 WeakPolarHBondContact CD-OH 3.31Å; R573-Y603 PolarHBondContact N-O 2.79Å; R573-Y603 WeakPolarHBondContact O-CD1 3.15Å; R573-Y603 PolarHBondContact O-N 3Å; L575-Y603 HydrophobicContact CD1-CD1 4.3Å; H578-Y603 PolarHBondContact O-OH 3.47Å
604	V	80.8	Confident	71.9	Confident	0 Å²	0	80 Å²	80	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	133.9	175.1	-175.9	0	0	0	0	108.2	I501 L503 P517 R571 I608 I615	I501-V604 HydrophobicContact CD1-CG2 3.52Å; I501-V604 HydrophobicContact CG2-CG2 4.21Å; L503-V604 HydrophobicContact CD2-CB 4.38Å; L503-V604 HydrophobicContact CD2-CG1 3.95Å; P517-V604 HydrophobicContact CG-CB 4.16Å; P517-V604 PolarHBondContact O-N 2.62Å; R571-V604 WeakPolarHBondContact O-CA 3.29Å; R571-V604 WeakPolarHBondContact O-CG1 3.38Å; V604-I608 HydrophobicContact CG1-CD1 3.71Å; V604-I608 HydrophobicContact CG1-CG1 4.38Å; V604-I608 HydrophobicContact CG1-CG2 4.37Å; V604-I615 HydrophobicContact CG1-CD1 4.21Å; V604-I615 HydrophobicContact CG2-CD1 3.61Å
605	I	76.2	Confident	72.6	Confident	52 Å²	52	74.9 Å²	74.9	27%	0.267	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-66.1	145.5	179.6	-49	169.5	0	0	0	108.7	S570 R571 R573 I608	S570-I605 WeakPolarHBondContact O-CD1 3.16Å; R571-I605 PolarHBondContact O-N 3.12Å; R573-I605 HydrophobicContact CG-CD1 4.2Å; R573-I605 HydrophobicContact CG-CG1 4.21Å; I605-I608 HydrophobicContact CB-CG2 4.35Å; I605-I608 WeakPolarHBondContact O-CG2 3.37Å
606	D	66.1	Low	73.6	Confident	83 Å²	83	66.8 Å²	66.8	44%	0.444	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	158.6	170.4	-134.1	-9	0	0	0	110.9	K506 I608	K506-D606 IonicContact NZ-OD1 2.64Å; K506-D606 PolarHBondContact NZ-OD1 3.03Å; K506-D606 IonicContact NZ-OD2 3.59Å; K506-D606 PolarHBondContact NZ-OD2 2.82Å; D606-I608 VanDerWaalsContact C-N 3.33Å; D606-I608 PolarHBondContact O-N 3.19Å
607	D	64.7	Low	74.2	Confident	153 Å²	153	64.1 Å²	64.1	82%	0.818	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	30.4	175.8	-59.9	-35.4	0	0	0	116.7	R609	D607-R609 PolarHBondContact O-N 3.07Å
608	I	68.3	Low	74.8	Confident	18 Å²	18	63.9 Å²	63.9	9%	0.092	29%	0.293	C	S	.	.			trans	-65	126.2	172.7	53.3	161	0	0	0	111.8	L503 R571 V604 I605 D606 K611 I651	L503-I608 HydrophobicContact CD1-CD1 4.21Å; L503-I608 HydrophobicContact CD1-CG1 4.36Å; L503-I608 HydrophobicContact CD2-CD1 4.26Å; R571-I608 HydrophobicContact CB-CG2 3.91Å; R571-I608 HydrophobicContact CG-CB 4.23Å; R571-I608 HydrophobicContact CG-CG2 3.8Å; V604-I608 HydrophobicContact CG1-CD1 3.71Å; V604-I608 HydrophobicContact CG1-CG1 4.38Å; V604-I608 HydrophobicContact CG1-CG2 4.37Å; I605-I608 HydrophobicContact CB-CG2 4.35Å; I605-I608 WeakPolarHBondContact O-CG2 3.37Å; D606-I608 VanDerWaalsContact C-N 3.33Å; D606-I608 PolarHBondContact O-N 3.19Å; I608-K611 HydrophobicContact CD1-CG 4.23Å; I608-K611 HydrophobicContact CG1-CG 4.22Å; I608-K611 WeakPolarHBondContact O-CE 3.25Å; I608-I651 HydrophobicContact CD1-CD1 3.57Å
609	R	57.7	Low	75.3	Confident	255 Å²	255	61.6 Å²	61.6	96%	0.962	28%	0.283	S	S	*	.	S	Bend	trans	-69.8	-34.4	176.5	-69	-173.2	179.7	-175	-0.2	113.1	D607	D607-R609 PolarHBondContact O-N 3.07Å
610	D	63.5	Low	75.8	Confident	29 Å²	29	56.8 Å²	56.8	16%	0.155	27%	0.268	C	S	.	.			trans	-103.7	99.9	-178.5	178.1	8.1	0	0	0	110.8	K566 R571 L612 N613	K566-D610 WeakPolarHBondContact CE-OD2 3.43Å; K566-D610 VanDerWaalsContact NZ-CG 3.34Å; K566-D610 IonicContact NZ-OD2 3.73Å; K566-D610 PolarHBondContact NZ-OD2 3.13Å; R571-D610 WeakPolarHBondContact CD-O 3.46Å; R571-D610 IonicContact CZ-OD2 3.18Å; R571-D610 PolarHBondContact NH1-O 3.22Å; R571-D610 VanDerWaalsContact NH1-O 3.1Å; R571-D610 IonicContact NH1-OD1 3.44Å; R571-D610 IonicContact NH1-OD2 2.91Å; R571-D610 PolarHBondContact NH1-OD2 3.44Å; D610-L612 PolarHBondContact OD1-N 2.96Å; D610-N613 PolarHBondContact OD1-N 2.82Å; D610-N613 PolarHBondContact OD1-ND2 2.89Å; D610-N613 WeakPolarHBondContact OD2-CB 3.4Å; D610-N613 PolarHBondContact OD2-ND2 2.82Å
611	K	66.3	Low	76	Confident	110 Å²	110	55.5 Å²	55.5	48%	0.478	26%	0.264	S	S	.	.			trans	-101.7	0.6	175.9	-56.7	177.9	-178.8	-179.9	0	112.7	L503 I608 I651	L503-K611 HydrophobicContact CD1-CD 3.88Å; L503-K611 HydrophobicContact CD1-CG 4.02Å; I608-K611 HydrophobicContact CD1-CG 4.23Å; I608-K611 HydrophobicContact CG1-CG 4.22Å; I608-K611 WeakPolarHBondContact O-CE 3.25Å; K611-I651 HydrophobicContact CB-CG2 4.39Å
612	L	61	Low	76.2	Confident	92 Å²	92	53.7 Å²	53.7	48%	0.482	27%	0.265	S	S	.	.	S	Bend	trans	-96.6	-44.7	-171.8	-64.5	178.8	0	0	0	111.9	D610	D610-L612 PolarHBondContact OD1-N 2.96Å
613	N	71.3	Confident	76.1	Confident	92 Å²	92	55 Å²	55	49%	0.492	27%	0.272	S	S	.	.	S	Bend	trans	-77.6	141.4	-178.7	-65	-52.2	0	0	0	110.9	R571 D610	R571-N613 PolarHBondContact NH1-O 2.91Å; D610-N613 PolarHBondContact OD1-N 2.82Å; D610-N613 PolarHBondContact OD1-ND2 2.89Å; D610-N613 WeakPolarHBondContact OD2-CB 3.4Å; D610-N613 PolarHBondContact OD2-ND2 2.82Å
614	P	77.5	Confident	75.7	Confident	27 Å²	27	54.5 Å²	54.5	18%	0.175	27%	0.271	C	S	.	.			trans	-58.9	151.8	171.2	21.9	-30.4	0	0	0	111.1	R571 V616 E648 V649 N650	R571-P614 PolarHBondContact NH2-O 2.87Å; P614-V616 PolarHBondContact O-N 2.8Å; P614-E648 HydrophobicContact CB-CB 3.98Å; P614-E648 HydrophobicContact CB-CG 4.37Å; P614-V649 CarbonylContact C-O 3.48Å; P614-V649 WeakPolarHBondContact CA-O 3.49Å; P614-N650 WeakPolarHBondContact CB-OD1 3.3Å
615	I	81.8	Confident	75	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	105.1	168.3	-59.2	177.2	0	0	0	106.8	D563 R571 A572 V604 V649 I651	D563-I615 HydrophobicContact CB-CG2 4.43Å; R571-I615 HydrophobicContact CB-CD1 4.3Å; R571-I615 HydrophobicContact CB-CG1 4.46Å; A572-I615 HydrophobicContact CB-CD1 4.16Å; A572-I615 HydrophobicContact CB-CG2 3.77Å; V604-I615 HydrophobicContact CG1-CD1 4.21Å; V604-I615 HydrophobicContact CG2-CD1 3.61Å; I615-V649 HydrophobicContact CB-CB 4.38Å; I615-V649 PolarHBondContact N-O 2.73Å; I615-V649 PolarHBondContact O-N 3.13Å; I615-V649 VanDerWaalsContact O-N 3.08Å; I615-I651 HydrophobicContact CD1-CD1 4.37Å; I615-I651 HydrophobicContact CG1-CD1 4.47Å
616	V	85.6	Confident	74.1	Confident	26 Å²	26	64 Å²	64	16%	0.158	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	128.1	-177.8	-177.4	0	0	0	0	110.1	D563 P614 Q618 E648	D563-V616 WeakPolarHBondContact CA-O 3.38Å; D563-V616 PolarHBondContact N-O 2.94Å; P614-V616 PolarHBondContact O-N 2.8Å; V616-Q618 HydrophobicContact CG1-CG 4.13Å; V616-E648 HydrophobicContact CG2-CG 4.44Å
617	I	85.6	Confident	73.5	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.005	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	119.3	175.7	-57.3	150.8	0	0	0	107.6	V494 L521 I560 N561 L562 V619 T646 G647 V649	V494-I617 HydrophobicContact CG1-CB 4.27Å; V494-I617 HydrophobicContact CG1-CD1 4.13Å; V494-I617 HydrophobicContact CG1-CG2 4.01Å; L521-I617 HydrophobicContact CD1-CD1 3.74Å; L521-I617 HydrophobicContact CD1-CG1 4.08Å; L521-I617 HydrophobicContact CD1-CG2 4.23Å; L521-I617 HydrophobicContact CD2-CD1 3.33Å; L521-I617 HydrophobicContact CD2-CG1 4.45Å; L521-I617 HydrophobicContact CG-CD1 4.15Å; I560-I617 HydrophobicContact CG2-CG2 3.95Å; N561-I617 WeakPolarHBondContact O-CA 3.34Å; L562-I617 HydrophobicContact CD2-CG1 4.01Å; L562-I617 HydrophobicContact CD2-CG2 4.29Å; I617-V619 HydrophobicContact CG2-CG2 4.39Å; I617-T646 CarbonylContact O-C 3.56Å; I617-T646 WeakPolarHBondContact O-CA 3.09Å; I617-G647 PolarHBondContact N-O 3.17Å; I617-G647 PolarHBondContact O-N 2.94Å; I617-V649 HydrophobicContact CD1-CG2 3.6Å
618	Q	87.3	Confident	73	Confident	48 Å²	48	55.4 Å²	55.4	22%	0.224	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.6	176.5	-64.2	-174.5	-23.1	0	0	109.7	I560 N561 A564 V616 T646	I560-Q618 CarbonylContact C-O 3.48Å; I560-Q618 WeakPolarHBondContact CA-O 3.22Å; N561-Q618 HydrophobicContact CB-CB 4.38Å; N561-Q618 PolarHBondContact N-O 2.82Å; N561-Q618 PolarHBondContact O-N 3.06Å; A564-Q618 HydrophobicContact CB-CG 4.3Å; V616-Q618 HydrophobicContact CG1-CG 4.13Å; Q618-T646 HydrophobicContact CG-CG2 4.26Å
619	V	86.7	Confident	72.2	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	104.9	175.1	-175.7	0	0	0	0	108.5	V494 V523 F525 L558 I559 I560 I617 V644 I645	V494-V619 HydrophobicContact CG2-CB 4.37Å; V494-V619 HydrophobicContact CG2-CG2 3.52Å; V523-V619 HydrophobicContact CG1-CG1 4.33Å; V523-V619 HydrophobicContact CG1-CG2 4.27Å; V523-V619 HydrophobicContact CG2-CG2 4.34Å; F525-V619 HydrophobicContact CE2-CG1 4.12Å; F525-V619 HydrophobicContact CZ-CG1 3.77Å; L558-V619 HydrophobicContact CD2-CG1 4.4Å; I559-V619 WeakPolarHBondContact O-CA 3.35Å; I560-V619 HydrophobicContact CG1-CG1 4.35Å; I560-V619 HydrophobicContact CG1-CG2 4.18Å; I560-V619 HydrophobicContact CG2-CG2 4.24Å; I617-V619 HydrophobicContact CG2-CG2 4.39Å; V619-V644 WeakPolarHBondContact O-CA 3.02Å; V619-I645 PolarHBondContact N-O 2.87Å; V619-I645 PolarHBondContact O-N 2.72Å
620	N	88.2	Confident	71.7	Confident	55 Å²	55	58 Å²	58	29%	0.294	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	130	172	-61.3	-14.9	0	0	0	108.3	L558 I559 V644	L558-N620 CarbonylContact C-O 3.52Å; L558-N620 WeakPolarHBondContact CA-O 3.42Å; I559-N620 HydrophobicContact CB-CB 4.3Å; I559-N620 PolarHBondContact N-O 3.48Å; I559-N620 PolarHBondContact O-N 2.88Å; N620-V644 WeakPolarHBondContact OD1-CG1 3.46Å; N620-V644 WeakPolarHBondContact OD1-CG2 3.47Å
621	Y	85.1	Confident	70.8	Confident	11 Å²	11	64.7 Å²	64.7	4%	0.043	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	134.4	179.9	65.2	-82	0	0	0	111.4	V490 F525 R557 K637 P642 G643 I645	V490-Y621 HydrophobicContact CB-CE2 4.17Å; V490-Y621 HydrophobicContact CG1-CE2 4.45Å; V490-Y621 PolarHBondContact O-OH 2.99Å; V490-Y621 VanDerWaalsContact O-OH 3.08Å; F525-Y621 HydrophobicContact CE1-CD1 4.02Å; F525-Y621 HydrophobicContact CE1-CD2 4.46Å; F525-Y621 HydrophobicContact CE1-CE1 4.46Å; F525-Y621 AromaticContact CE1-CG 3.99Å; F525-Y621 HydrophobicContact CE1-CG 3.99Å; F525-Y621 HydrophobicContact CZ-CD1 4.41Å; F525-Y621 HydrophobicContact CZ-CG 4.42Å; R557-Y621 WeakPolarHBondContact O-CA 3.48Å; Y621-K637 HydrophobicContact CE2-CD 3.93Å; Y621-P642 PolarHBondContact OH-O 2.72Å; Y621-G643 WeakPolarHBondContact CD1-O 3.29Å; Y621-G643 PolarHBondContact N-O 3.26Å; Y621-I645 HydrophobicContact CD1-CD1 3.83Å; Y621-I645 HydrophobicContact CD1-CG1 4.35Å; Y621-I645 HydrophobicContact CE1-CD1 3.56Å; Y621-I645 HydrophobicContact CE1-CG1 3.82Å
622	S	84.3	Confident	70	Confident	58 Å²	58	62.5 Å²	62.5	41%	0.406	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	159	175	65.7	0	0	0	0	110.1	F556 R557	F556-S622 CarbonylContact C-O 3.58Å; F556-S622 VanDerWaalsContact CA-O 3.26Å; F556-S622 WeakPolarHBondContact CA-O 3.07Å; F556-S622 WeakPolarHBondContact CD1-O 3.33Å; R557-S622 PolarHBondContact N-O 3.1Å; R557-S622 PolarHBondContact O-N 3Å
623	I	77.8	Confident	69.4	Low	30 Å²	30	60 Å²	60	15%	0.154	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	137.1	170.4	-64.1	170.4	0	0	0	107.7	V488 F556 F628 P635 K637	V488-I623 HydrophobicContact CG2-CD1 4.29Å; F556-I623 HydrophobicContact CD1-CG1 4.28Å; F556-I623 HydrophobicContact CE1-CG1 3.83Å; F556-I623 HydrophobicContact CZ-CG1 4.46Å; I623-F628 HydrophobicContact CG2-CE2 4.03Å; I623-P635 HydrophobicContact CD1-CB 4.2Å; I623-P635 WeakPolarHBondContact CD1-O 2.99Å; I623-K637 HydrophobicContact CD1-CB 4.34Å
624	S	73.6	Confident	69	Low	5 Å²	5	61.5 Å²	61.5	4%	0.035	31%	0.307	C	S	.	.			trans	-72	125.9	179.5	-169.1	0	0	0	0	110.4	D555 D626	D555-S624 WeakPolarHBondContact O-CB 3.17Å; D555-S624 PolarHBondContact O-N 2.87Å; S624-D626 VanDerWaalsContact C-N 3.31Å
625	D	65.4	Low	68.3	Low	107 Å²	107	60.3 Å²	60.3	57%	0.572	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-68.2	-31.4	176.2	-78.7	-51.5	0	0	0	112.1	A627 R634	D625-A627 VanDerWaalsContact C-N 3.28Å; D625-A627 PolarHBondContact O-N 3.21Å; D625-R634 IonicContact OD1-NH1 3.81Å; D625-R634 PolarHBondContact OD1-NH1 2.83Å; D625-R634 VanDerWaalsContact OD1-NH1 3.14Å
626	D	59.1	Low	67.7	Low	144 Å²	144	62.8 Å²	62.8	77%	0.77	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-76.2	-10.9	-172.5	-63.8	-32.7	0	0	0	114.4	S624 F628	S624-D626 VanDerWaalsContact C-N 3.31Å; D626-F628 VanDerWaalsContact C-N 3.34Å; D626-F628 PolarHBondContact O-N 3.23Å
627	A	53.7	Low	67.1	Low	28 Å²	28	64.2 Å²	64.2	23%	0.231	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-83.2	-8.2	-174.8	0	0	0	0	0	114.2	D555 D625	D555-A627 HydrophobicContact CB-CB 3.57Å; D555-A627 VanDerWaalsContact OD2-CB 3.26Å; D555-A627 WeakPolarHBondContact OD2-CB 3.28Å; D625-A627 VanDerWaalsContact C-N 3.28Å; D625-A627 PolarHBondContact O-N 3.21Å
628	F	53.7	Low	66.3	Low	27 Å²	27	65.5 Å²	65.5	12%	0.118	33%	0.325	C	S	.	.	S	Bend	trans	-117.8	109.1	-176.3	-62.2	-78.8	0	0	0	109.9	I623 D626 Q632 R634 P635	I623-F628 HydrophobicContact CG2-CE2 4.03Å; D626-F628 VanDerWaalsContact C-N 3.34Å; D626-F628 PolarHBondContact O-N 3.23Å; F628-Q632 HydrophobicContact CD1-CB 4.26Å; F628-R634 HydrophobicContact CB-CG 3.88Å; F628-R634 HydrophobicContact CD2-CG 4.07Å; F628-R634 HydrophobicContact CG-CG 4.06Å; F628-P635 HydrophobicContact CE1-CG 4.03Å; F628-P635 VanDerWaalsContact CE2-CD 3.49Å; F628-P635 HydrophobicContact CE2-CG 4.28Å; F628-P635 HydrophobicContact CZ-CG 3.59Å
629	P	52	Low	65.5	Low	79 Å²	79	67.6 Å²	67.6	51%	0.513	35%	0.35	S	S	.	.			trans	-52	147.9	164.9	-18.9	29.2	0	0	0	108.8	Q631 Q632	P629-Q631 PolarHBondContact O-N 2.99Å; P629-Q632 PolarHBondContact O-N 3.28Å
630	Y	45.6	Very low	64.9	Low	250 Å²	250	73.2 Å²	73.2	98%	0.98	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.9	-6.8	179.2	-84.1	-88.3	0	0	0	116
631	Q	45.4	Very low	64.2	Low	169 Å²	169	73.9 Å²	73.9	79%	0.79	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-1	-176.1	-63.6	170.3	-17.7	0	0	114.3	P629	P629-Q631 PolarHBondContact O-N 2.99Å
632	Q	48.3	Very low	63.7	Low	64 Å²	64	77.2 Å²	77.2	30%	0.299	40%	0.397	S	S	.	.	S	Bend	trans	-119.7	136.3	176.3	-74.1	-176.8	1.5	0	0	111.7	F628 P629 R634	F628-Q632 HydrophobicContact CD1-CB 4.26Å; P629-Q632 PolarHBondContact O-N 3.28Å; Q632-R634 PolarHBondContact O-N 2.97Å
633	L	49.1	Very low	63.4	Low	40 Å²	40	75.8 Å²	75.8	21%	0.209	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-62.5	119.9	175	-75.4	175.4	0	0	0	110.8	F471 E483 S484 P635	F471-L633 HydrophobicContact CB-CD1 3.66Å; F471-L633 HydrophobicContact CD1-CD1 4.34Å; F471-L633 HydrophobicContact CG-CD1 4.49Å; F471-L633 VanDerWaalsContact O-CD1 3.3Å; F471-L633 WeakPolarHBondContact O-CD1 3.33Å; E483-L633 HydrophobicContact CB-CD1 4.33Å; E483-L633 HydrophobicContact CB-CD2 3.85Å; S484-L633 WeakPolarHBondContact O-CD1 3.35Å; L633-P635 WeakPolarHBondContact O-CD 2.87Å
634	R	62.5	Low	63.8	Low	123 Å²	123	77.4 Å²	77.4	46%	0.464	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-65.5	125	177	-70.8	-175.3	-79	174.2	-8	109.4	R485 D625 F628 Q632	R485-R634 WeakPolarHBondContact CB-O 3.47Å; R485-R634 WeakPolarHBondContact CG-O 3.35Å; R485-R634 PolarHBondContact NE-O 3.41Å; R485-R634 PolarHBondContact NH2-O 2.77Å; D625-R634 IonicContact OD1-NH1 3.81Å; D625-R634 PolarHBondContact OD1-NH1 2.83Å; D625-R634 VanDerWaalsContact OD1-NH1 3.14Å; F628-R634 HydrophobicContact CB-CG 3.88Å; F628-R634 HydrophobicContact CD2-CG 4.07Å; F628-R634 HydrophobicContact CG-CG 4.06Å; Q632-R634 PolarHBondContact O-N 2.97Å
635	P	64.4	Low	64.3	Low	2 Å²	2	78 Å²	78	1%	0.013	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-61.2	157	170.9	-17.1	29.3	0	0	0	111.8	R485 P486 V488 I623 F628 L633	R485-P635 PolarHBondContact NH2-O 2.8Å; P486-P635 HydrophobicContact CG-CB 4.13Å; P486-P635 HydrophobicContact CG-CG 4.24Å; P486-P635 CarbonylContact O-C 3.49Å; P486-P635 WeakPolarHBondContact O-CA 3.23Å; P486-P635 WeakPolarHBondContact O-CB 3.16Å; V488-P635 HydrophobicContact CG2-CB 3.46Å; V488-P635 VanDerWaalsContact CG2-CB 3.46Å; V488-P635 HydrophobicContact CG2-CG 4.47Å; I623-P635 HydrophobicContact CD1-CB 4.2Å; I623-P635 WeakPolarHBondContact CD1-O 2.99Å; F628-P635 HydrophobicContact CE1-CG 4.03Å; F628-P635 VanDerWaalsContact CE2-CD 3.49Å; F628-P635 HydrophobicContact CE2-CG 4.28Å; F628-P635 HydrophobicContact CZ-CG 3.59Å; L633-P635 WeakPolarHBondContact O-CD 2.87Å
636	V	67.6	Low	65.2	Low	51 Å²	51	77 Å²	77	31%	0.309	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	141	174.7	171.5	0	0	0	0	108.7	R485 P486 V487 V488	R485-V636 HydrophobicContact CB-CB 4.35Å; R485-V636 HydrophobicContact CB-CG2 3.54Å; R485-V636 HydrophobicContact CG-CG2 4.15Å; P486-V636 PolarHBondContact O-N 3.06Å; V487-V636 CarbonylContact C-O 3.55Å; V487-V636 WeakPolarHBondContact CA-O 3.44Å; V488-V636 PolarHBondContact N-O 2.92Å
637	K	73.1	Confident	66.2	Low	56 Å²	56	70.5 Å²	70.5	24%	0.243	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	135.3	170.9	-170.8	-165.4	67.6	160	0	108.8	V488 Y621 I623 A639 M641 P642	V488-K637 WeakPolarHBondContact O-CA 3.26Å; Y621-K637 HydrophobicContact CE2-CD 3.93Å; I623-K637 HydrophobicContact CD1-CB 4.34Å; K637-A639 PolarHBondContact O-N 2.9Å; K637-M641 PolarHBondContact NZ-O 3.4Å; K637-P642 VanDerWaalsContact NZ-C 3.27Å; K637-P642 PolarHBondContact NZ-O 3.23Å
638	D	68.5	Low	67.6	Low	28 Å²	28	74.7 Å²	74.7	15%	0.15	39%	0.385	C	S	.	.			trans	-44.7	123.4	170.6	-172.4	-22.8	0	0	0	111.4	V487 V488 S489 Y640 M641	V487-D638 HydrophobicContact CG1-CB 3.85Å; V488-D638 PolarHBondContact O-N 3.08Å; S489-D638 PolarHBondContact OG-OD2 3.15Å; D638-Y640 PolarHBondContact O-N 3.34Å; D638-Y640 WeakPolarHBondContact OD1-CD2 3.38Å; D638-Y640 PolarHBondContact OD1-N 3.44Å; D638-M641 HydrophobicContact CB-CB 4.22Å; D638-M641 HydrophobicContact CB-CG 3.85Å; D638-M641 PolarHBondContact O-N 3.21Å
639	A	71.1	Confident	68.9	Low	92 Å²	92	73.4 Å²	73.4	76%	0.76	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-23.2	-175.3	0	0	0	0	0	112.5	K637	K637-A639 PolarHBondContact O-N 2.9Å
640	Y	74.7	Confident	70	Confident	119 Å²	119	72 Å²	72	47%	0.467	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-5.4	179.9	-55	-66.9	0	0	0	113.1	H393 N400 D638	H393-Y640 AromaticContact ND1-CE2 3.76Å; H393-Y640 AromaticContact ND1-CZ 3.75Å; H393-Y640 PolarHBondContact ND1-OH 3.36Å; N400-Y640 WeakPolarHBondContact ND2-CE1 3.23Å; N400-Y640 PolarHBondContact ND2-OH 2.88Å; D638-Y640 PolarHBondContact O-N 3.34Å; D638-Y640 WeakPolarHBondContact OD1-CD2 3.38Å; D638-Y640 PolarHBondContact OD1-N 3.44Å
641	M	72.7	Confident	71.2	Confident	69 Å²	69	60.5 Å²	60.5	34%	0.34	32%	0.323	S	S	.	.	S	Bend	trans	-95.2	136.8	177.5	-69.3	-75.3	167.2	0	0	111.5	K637 D638	K637-M641 PolarHBondContact NZ-O 3.4Å; D638-M641 HydrophobicContact CB-CB 4.22Å; D638-M641 HydrophobicContact CB-CG 3.85Å; D638-M641 PolarHBondContact O-N 3.21Å
642	P	75.2	Confident	72.2	Confident	80 Å²	80	56.8 Å²	56.8	52%	0.519	31%	0.306	S	S	.	.			trans	-59.3	156.5	179.4	24.7	-32.8	0	0	0	111.5	Y621 K637	Y621-P642 PolarHBondContact OH-O 2.72Å; K637-P642 VanDerWaalsContact NZ-C 3.27Å; K637-P642 PolarHBondContact NZ-O 3.23Å
643	G	78.2	Confident	72.8	Confident	28 Å²	28	55.9 Å²	55.9	29%	0.289	30%	0.301	S	S	.	.	S	Bend	trans	-94.8	-1	173.7	0	0	0	0	0	113.8	Y621	Y621-G643 WeakPolarHBondContact CD1-O 3.29Å; Y621-G643 PolarHBondContact N-O 3.26Å
644	V	85.3	Confident	73.3	Confident	65 Å²	65	60.8 Å²	60.8	39%	0.394	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	134.5	-168.2	-175.2	0	0	0	0	108.9	V619 N620 T646	V619-V644 WeakPolarHBondContact O-CA 3.02Å; N620-V644 WeakPolarHBondContact OD1-CG1 3.46Å; N620-V644 WeakPolarHBondContact OD1-CG2 3.47Å; V644-T646 HydrophobicContact CG1-CG2 4.43Å
645	I	84.8	Confident	73.4	Confident	17 Å²	17	55.5 Å²	55.5	9%	0.087	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	138.4	171	-64.5	148.1	0	0	0	107.9	G492 V494 F525 V619 Y621	G492-I645 VanDerWaalsContact CA-CD1 3.44Å; G492-I645 WeakPolarHBondContact O-CG2 3.26Å; V494-I645 HydrophobicContact CG2-CG2 4.01Å; F525-I645 HydrophobicContact CD1-CD1 3.99Å; F525-I645 HydrophobicContact CE1-CD1 3.2Å; F525-I645 HydrophobicContact CZ-CD1 3.69Å; V619-I645 PolarHBondContact N-O 2.87Å; V619-I645 PolarHBondContact O-N 2.72Å; Y621-I645 HydrophobicContact CD1-CD1 3.83Å; Y621-I645 HydrophobicContact CD1-CG1 4.35Å; Y621-I645 HydrophobicContact CE1-CD1 3.56Å; Y621-I645 HydrophobicContact CE1-CG1 3.82Å
646	T	84.2	Confident	73.4	Confident	86 Å²	86	57.5 Å²	57.5	53%	0.528	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	142	-179.8	53.1	0	0	0	0	111.2	I617 Q618 V644	I617-T646 CarbonylContact O-C 3.56Å; I617-T646 WeakPolarHBondContact O-CA 3.09Å; Q618-T646 HydrophobicContact CG-CG2 4.26Å; V644-T646 HydrophobicContact CG1-CG2 4.43Å
647	G	80.3	Confident	73	Confident	8 Å²	8	67.3 Å²	67.3	8%	0.082	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	164.4	166.5	0	0	0	0	0	110.5	I617	I617-G647 PolarHBondContact N-O 3.17Å; I617-G647 PolarHBondContact O-N 2.94Å
648	E	83.3	Confident	72.8	Confident	115 Å²	115	69.1 Å²	69.1	54%	0.537	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	147.6	-173	-65	-175.4	173.6	0	0	110.6	P614 V616	P614-E648 HydrophobicContact CB-CB 3.98Å; P614-E648 HydrophobicContact CB-CG 4.37Å; V616-E648 HydrophobicContact CG2-CG 4.44Å
649	V	79.9	Confident	72.4	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	123.5	174.4	-167.1	0	0	0	0	109.3	A496 I501 L521 P614 I615 I617	A496-V649 HydrophobicContact CB-CB 4.4Å; A496-V649 HydrophobicContact CB-CG1 4.23Å; A496-V649 HydrophobicContact CB-CG2 3.48Å; A496-V649 VanDerWaalsContact CB-CG2 3.48Å; I501-V649 HydrophobicContact CD1-CG1 3.6Å; I501-V649 HydrophobicContact CG1-CG1 3.68Å; L521-V649 HydrophobicContact CD2-CG2 4.2Å; P614-V649 CarbonylContact C-O 3.48Å; P614-V649 WeakPolarHBondContact CA-O 3.49Å; I615-V649 HydrophobicContact CB-CB 4.38Å; I615-V649 PolarHBondContact N-O 2.73Å; I615-V649 PolarHBondContact O-N 3.13Å; I615-V649 VanDerWaalsContact O-N 3.08Å; I617-V649 HydrophobicContact CD1-CG2 3.6Å
650	N	75.4	Confident	72.3	Confident	51 Å²	51	73.2 Å²	73.2	27%	0.273	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	157	-177.2	-73.8	-31.1	0	0	0	111.6	D499 V500 I501 P614	D499-N650 PolarHBondContact O-N 3.45Å; V500-N650 CarbonylContact C-O 3.57Å; V500-N650 WeakPolarHBondContact CA-O 3.47Å; V500-N650 HydrophobicContact CG2-CB 4.29Å; I501-N650 PolarHBondContact N-O 3.36Å; P614-N650 WeakPolarHBondContact CB-OD1 3.3Å
651	I	72.4	Confident	72.3	Confident	7 Å²	7	67.8 Å²	67.8	4%	0.036	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	134.9	176.6	-62	165.8	0	0	0	108.3	I501 L503 I608 K611 I615 K653	I501-I651 CarbonylContact O-C 3.59Å; I501-I651 WeakPolarHBondContact O-CA 3.49Å; L503-I651 HydrophobicContact CD1-CG2 3.7Å; L503-I651 HydrophobicContact CD2-CG2 4.23Å; L503-I651 HydrophobicContact CG-CG2 3.71Å; I608-I651 HydrophobicContact CD1-CD1 3.57Å; K611-I651 HydrophobicContact CB-CG2 4.39Å; I615-I651 HydrophobicContact CD1-CD1 4.37Å; I615-I651 HydrophobicContact CG1-CD1 4.47Å; I651-K653 WeakPolarHBondContact O-CG 3.43Å
652	Q	65.8	Low	72.9	Confident	91 Å²	91	68 Å²	68	43%	0.425	36%	0.363	S	S	.	.			trans	-65.1	146.5	-178.7	-173.1	173.1	-7.6	0	0	113.1	V500 I501 N502	V500-Q652 HydrophobicContact CG1-CB 4.11Å; I501-Q652 PolarHBondContact O-N 2.59Å; N502-Q652 HydrophobicContact CB-CB 4.3Å; N502-Q652 PolarHBondContact ND2-OE1 2.79Å
653	K	61.2	Low	73.5	Confident	46 Å²	46	64.2 Å²	64.2	20%	0.2	34%	0.338	C	S	.	.			trans	-129.6	164	-166.9	-54	178.8	-176.1	-173.4	0	113.4	I651 F698 N745	I651-K653 WeakPolarHBondContact O-CG 3.43Å; K653-F698 HydrophobicContact CB-CD1 4.19Å; K653-F698 HydrophobicContact CB-CE1 3.26Å; K653-F698 HydrophobicContact CB-CE2 3.98Å; K653-F698 HydrophobicContact CB-CZ 3.15Å; K653-F698 HydrophobicContact CD-CD1 3.16Å; K653-F698 HydrophobicContact CD-CE1 3.01Å; K653-F698 HydrophobicContact CD-CG 4.13Å; K653-F698 HydrophobicContact CD-CZ 3.86Å; K653-F698 HydrophobicContact CG-CD1 4.24Å; K653-F698 HydrophobicContact CG-CE1 3.69Å; K653-F698 HydrophobicContact CG-CZ 4.08Å; K653-N745 PolarHBondContact NZ-ND2 3.11Å; K653-N745 PolarHBondContact NZ-O 2.86Å; K653-N745 PolarHBondContact NZ-OD1 3Å
654	D	58.1	Low	74.2	Confident	143 Å²	143	64.3 Å²	64.3	77%	0.765	33%	0.333	S	S	*	.			trans	-86.7	100.9	-161	-159.7	5	0	0	0	114.5
655	C	65.3	Low	74.6	Confident	11 Å²	11	61.3 Å²	61.3	7%	0.074	31%	0.314	C	S	.	.			trans	-121.4	42.5	-167.2	-71.7	0	0	0	0	116	N659 I660 C661 F698	C655-N659 CarbonylContact O-C 3.48Å; C655-N659 WeakPolarHBondContact O-CA 3.5Å; C655-N659 PolarHBondContact O-N 2.86Å; C655-I660 PolarHBondContact O-N 3.13Å; C655-C661 WeakPolarHBondContact CA-SG 3.36Å; C655-C661 HydrophobicContact CB-CB 3.95Å; C655-C661 WeakPolarHBondContact CB-SG 3.28Å; C655-C661 WeakPolarHBondContact SG-CB 3.35Å; C655-C661 PolarHBondContact SG-N 3.04Å; C655-C661 CovalentContact SG-SG 2.04Å; C655-C661 PolarHBondContact SG-SG 3.04Å; C655-F698 WeakPolarHBondContact SG-CE2 3.21Å
656	G	64.3	Low	75	Confident	44 Å²	44	66.2 Å²	66.2	45%	0.454	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	-167.8	179.7	0	0	0	0	0	114.1	N659	G656-N659 PolarHBondContact O-N 2.84Å
657	R	59.5	Low	75.4	Confident	258 Å²	258	62.6 Å²	62.6	97%	0.974	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-26.4	-170.7	-74	-175.3	-178.5	164.1	1.7	114.1
658	D	69.6	Low	76.1	Confident	94 Å²	94	66.1 Å²	66.1	50%	0.503	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-6.4	177.1	54.8	-1.7	0	0	0	112.5	I660	D658-I660 PolarHBondContact O-N 2.84Å; D658-I660 PolarHBondContact OD1-N 3.45Å
659	N	60.5	Low	76.5	Confident	105 Å²	105	61.6 Å²	61.6	56%	0.561	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	25.4	-174.8	-68.9	-42.2	0	0	0	113.2	C655 G656	C655-N659 CarbonylContact O-C 3.48Å; C655-N659 WeakPolarHBondContact O-CA 3.5Å; C655-N659 PolarHBondContact O-N 2.86Å; G656-N659 PolarHBondContact O-N 2.84Å
660	I	67.6	Low	77.1	Confident	101 Å²	101	68.2 Å²	68.2	52%	0.518	34%	0.342	S	S	.	.			trans	-116.5	102.8	178.3	-59.2	173	0	0	0	108.1	C655 D658 I662 E695	C655-I660 PolarHBondContact O-N 3.13Å; D658-I660 PolarHBondContact O-N 2.84Å; D658-I660 PolarHBondContact OD1-N 3.45Å; I660-I662 HydrophobicContact CG2-CG1 4.09Å; I660-I662 PolarHBondContact O-N 2.81Å; I660-E695 VanDerWaalsContact O-OE2 3.07Å
661	C	74.8	Confident	77.7	Confident	4 Å²	4	67.9 Å²	67.9	3%	0.027	34%	0.34	C	S	.	.			trans	-74.2	120.5	175.5	-76.2	0	0	0	0	110.6	C655 E695 D696 F698 N781	C655-C661 WeakPolarHBondContact CA-SG 3.36Å; C655-C661 HydrophobicContact CB-CB 3.95Å; C655-C661 WeakPolarHBondContact CB-SG 3.28Å; C655-C661 WeakPolarHBondContact SG-CB 3.35Å; C655-C661 PolarHBondContact SG-N 3.04Å; C655-C661 CovalentContact SG-SG 2.04Å; C655-C661 PolarHBondContact SG-SG 3.04Å; C661-E695 VanDerWaalsContact CA-OE2 3.26Å; C661-E695 WeakPolarHBondContact CA-OE2 3.05Å; C661-D696 WeakPolarHBondContact CB-O 3.48Å; C661-F698 HydrophobicContact CB-CD2 4.47Å; C661-F698 HydrophobicContact CB-CE2 4.07Å; C661-F698 WeakPolarHBondContact SG-CE2 3.42Å; C661-N781 WeakPolarHBondContact CB-ND2 3.01Å; C661-N781 WeakPolarHBondContact O-CB 3.37Å; C661-N781 PolarHBondContact O-ND2 3.16Å
662	I	85.6	Confident	78.5	Confident	73 Å²	73	71.8 Å²	71.8	37%	0.374	36%	0.361	S	S	.	.			trans	-114.4	100.3	173.5	-55.9	177.6	0	0	0	109.2	I660 L694 E695	I660-I662 HydrophobicContact CG2-CG1 4.09Å; I660-I662 PolarHBondContact O-N 2.81Å; I662-L694 WeakPolarHBondContact O-CB 3.09Å; I662-E695 PolarHBondContact N-OE2 3.49Å; I662-E695 WeakPolarHBondContact O-CB 3.11Å; I662-E695 PolarHBondContact O-N 2.95Å
663	P	88.6	Confident	79.2	Confident	1 Å²	1	70.9 Å²	70.9	1%	0.006	36%	0.356	C	S	.	.			trans	-81.3	171.6	176.9	35.7	-37.4	0	0	0	112.2	A697 N781	P663-A697 HydrophobicContact CB-CB 3.57Å; P663-A697 HydrophobicContact CG-CB 4.01Å; P663-N781 HydrophobicContact CG-CB 3.74Å
664	D	92.5	Very high	80.2	Confident	31 Å²	31	77.6 Å²	77.6	17%	0.166	39%	0.388	C	S	.	.			trans	-136.3	85.4	172.6	172.6	44.5	0	0	0	107	N692 G693 L694	D664-N692 PolarHBondContact N-OD1 2.78Å; D664-N692 CarbonylContact O-C 3.57Å; D664-N692 VanDerWaalsContact O-CA 3.28Å; D664-N692 WeakPolarHBondContact O-CA 3.2Å; D664-G693 PolarHBondContact O-N 2.75Å; D664-L694 HydrophobicContact CB-CB 3.89Å; D664-L694 HydrophobicContact CB-CD1 3.74Å; D664-L694 HydrophobicContact CB-CG 3.52Å
665	L	92.7	Very high	81.2	Confident	1 Å²	1	71.9 Å²	71.9	1%	0.005	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	139	-179.2	-66.4	-178.9	0	0	0	108	H691 N692 A697 L747 T777 E783 N791	L665-H691 CarbonylContact C-O 3.46Å; L665-H691 WeakPolarHBondContact CA-O 3.29Å; L665-N692 HydrophobicContact CD2-CB 3.95Å; L665-A697 HydrophobicContact CD2-CB 4.05Å; L665-L747 HydrophobicContact CD2-CD2 3.78Å; L665-T777 HydrophobicContact CB-CG2 4.1Å; L665-T777 HydrophobicContact CD1-CG2 4.45Å; L665-E783 PolarHBondContact N-OE1 3.14Å; L665-N791 WeakPolarHBondContact CB-OD1 3.41Å; L665-N791 PolarHBondContact O-OD1 2.79Å
666	R	93.2	Very high	81.8	Confident	121 Å²	121	71.5 Å²	71.5	46%	0.457	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	140.1	173.1	65	-178.7	-178.3	-173.9	-8.5	110.2	I690 H691 D790	R666-I690 CarbonylContact O-C 3.49Å; R666-I690 WeakPolarHBondContact O-CA 3.42Å; R666-H691 HydrophobicContact CG-CB 3.74Å; R666-H691 PolarHBondContact N-O 2.81Å; R666-H691 PolarHBondContact NE-CD2 2.78Å; R666-H691 PolarHBondContact NH2-CD2 3.02Å; R666-H691 PolarHBondContact NH2-NE2 3.21Å; R666-H691 VanDerWaalsContact NH2-NE2 3.13Å; R666-H691 PolarHBondContact O-N 2.88Å; R666-D790 HydrophobicContact CB-CB 4.43Å; R666-D790 WeakPolarHBondContact CB-OD2 3.34Å
667	M	93.6	Very high	82.4	Confident	9 Å²	9	71.8 Å²	71.8	4%	0.044	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	139.2	-175	179.5	172.8	64.8	0	0	112.5	I688 T689 I690 F702 L775 T777 D790 N791 V793	M667-I688 HydrophobicContact CG-CG2 4.29Å; M667-I688 HydrophobicContact SD-CG2 4.3Å; M667-T689 WeakPolarHBondContact CA-O 3.4Å; M667-I690 HydrophobicContact CB-CG1 4.19Å; M667-I690 HydrophobicContact CG-CG1 3.98Å; M667-I690 HydrophobicContact SD-CD1 4.45Å; M667-I690 HydrophobicContact SD-CG1 4.3Å; M667-F702 HydrophobicContact SD-CD2 3.7Å; M667-F702 HydrophobicContact SD-CE2 3.46Å; M667-F702 WeakPolarHBondContact SD-CE2 3.27Å; M667-L775 VanDerWaalsContact CE-C 3.42Å; M667-L775 HydrophobicContact CE-CB 3.59Å; M667-L775 WeakPolarHBondContact CE-O 3.5Å; M667-L775 HydrophobicContact SD-CB 4.15Å; M667-T777 HydrophobicContact CB-CG2 4.15Å; M667-D790 PolarHBondContact N-O 3.2Å; M667-N791 VanDerWaalsContact CE-O 3.3Å; M667-N791 WeakPolarHBondContact CE-O 3.16Å; M667-V793 HydrophobicContact CE-CB 3.95Å; M667-V793 HydrophobicContact CE-CG2 3.86Å; M667-V793 HydrophobicContact CG-CG2 4.43Å
668	T	93.9	Very high	83	Confident	82 Å²	82	60 Å²	60	50%	0.503	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	143.4	165.4	61.7	0	0	0	0	110.1	T689	T668-T689 PolarHBondContact N-O 3.25Å; T668-T689 PolarHBondContact O-N 3.06Å
669	A	92.6	Very high	83	Confident	20 Å²	20	56.9 Å²	56.9	17%	0.165	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	137.8	179.5	0	0	0	0	0	110.9	V686 S687 L775 V793 I795	A669-V686 HydrophobicContact CB-CG1 4.21Å; A669-S687 CarbonylContact C-O 3.58Å; A669-S687 VanDerWaalsContact CA-O 3.24Å; A669-S687 WeakPolarHBondContact CA-O 3.43Å; A669-L775 HydrophobicContact CB-CD1 3.47Å; A669-L775 VanDerWaalsContact CB-CD1 3.47Å; A669-V793 HydrophobicContact CB-CG1 4.33Å; A669-I795 HydrophobicContact CB-CD1 3.64Å; A669-I795 HydrophobicContact CB-CG1 4.48Å
670	Q	91.4	Very high	83.7	Confident	140 Å²	140	52.7 Å²	52.7	65%	0.654	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.6	132.6	-177.7	-67	-179.5	-5.8	0	0	110.5	S687	Q670-S687 PolarHBondContact N-O 2.84Å; Q670-S687 PolarHBondContact O-N 2.78Å
671	L	89.5	Confident	84.2	Confident	43 Å²	43	52.2 Å²	52.2	23%	0.225	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	134.8	173.9	-173.2	65.4	0	0	0	109.7	K673 F684 V686 I797	L671-K673 VanDerWaalsContact C-N 3.27Å; L671-K673 WeakPolarHBondContact CD2-O 3.43Å; L671-K673 WeakPolarHBondContact CG-O 3.48Å; L671-K673 PolarHBondContact O-N 2.91Å; L671-F684 HydrophobicContact CD1-CB 4.29Å; L671-F684 HydrophobicContact CD1-CD2 3.39Å; L671-F684 HydrophobicContact CD1-CE2 4.01Å; L671-F684 HydrophobicContact CD1-CG 4.13Å; L671-V686 HydrophobicContact CD1-CG2 4.22Å; L671-I797 HydrophobicContact CD2-CG2 3.93Å
672	N	87.5	Confident	84.4	Confident	90 Å²	90	53 Å²	53	48%	0.481	28%	0.277	S	S	.	.	S	Bend	trans	-81.7	-0.9	179.9	75.1	-30.5	0	0	0	114.5	N685	N672-N685 HydrophobicContact CB-CB 4.35Å; N672-N685 VanDerWaalsContact CG-N 3.34Å; N672-N685 PolarHBondContact N-O 3.1Å; N672-N685 PolarHBondContact ND2-N 2.84Å; N672-N685 PolarHBondContact OD1-N 3.19Å; N672-N685 PolarHBondContact OD1-O 3.31Å
673	K	82	Confident	84.5	Confident	72 Å²	72	57 Å²	57	31%	0.313	29%	0.287	S	S	.	.			trans	-133.4	141.5	-172.8	-162.2	169.3	-174	164.3	0	110.8	L671 A675 D682 F684	L671-K673 VanDerWaalsContact C-N 3.27Å; L671-K673 WeakPolarHBondContact CD2-O 3.43Å; L671-K673 WeakPolarHBondContact CG-O 3.48Å; L671-K673 PolarHBondContact O-N 2.91Å; K673-A675 WeakPolarHBondContact CD-O 3.37Å; K673-A675 WeakPolarHBondContact CE-O 3.39Å; K673-A675 WeakPolarHBondContact CG-O 3.48Å; K673-D682 WeakPolarHBondContact CE-OD2 3.23Å; K673-D682 IonicContact NZ-OD1 2.64Å; K673-D682 PolarHBondContact NZ-OD1 2.83Å; K673-D682 IonicContact NZ-OD2 2.64Å; K673-D682 PolarHBondContact NZ-OD2 2.84Å; K673-F684 HydrophobicContact CB-CB 4.46Å
674	E	81.3	Confident	84.5	Confident	187 Å²	187	56.9 Å²	56.9	87%	0.874	29%	0.287	S	S	*	.	S	Bend	trans	-76.8	-31.7	-177.7	-68.6	-175.9	175.6	0	0	113.7	P798	E674-P798 WeakPolarHBondContact O-CG 3.28Å
675	A	79.2	Confident	84.4	Confident	23 Å²	23	57.4 Å²	57.4	19%	0.19	29%	0.289	C	S	.	.			trans	-160.2	154.2	174.8	0	0	0	0	0	111.3	K673 P798 E800	K673-A675 WeakPolarHBondContact CD-O 3.37Å; K673-A675 WeakPolarHBondContact CE-O 3.39Å; K673-A675 WeakPolarHBondContact CG-O 3.48Å; A675-P798 CarbonylContact C-O 3.56Å; A675-P798 VanDerWaalsContact CA-O 3.26Å; A675-P798 WeakPolarHBondContact CA-O 3.06Å; A675-P798 HydrophobicContact CB-CB 4.37Å; A675-E800 HydrophobicContact CB-CB 4.07Å
676	I	78.8	Confident	84.4	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.01	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	132.2	175.3	-66.6	-174.3	0	0	0	110	D682 F684 T761 I797 P798 M799 E800	I676-D682 HydrophobicContact CG2-CB 4.34Å; I676-F684 HydrophobicContact CD1-CD1 3.3Å; I676-F684 HydrophobicContact CD1-CE1 3.24Å; I676-F684 HydrophobicContact CD1-CG 4.05Å; I676-F684 HydrophobicContact CD1-CZ 3.97Å; I676-F684 HydrophobicContact CG1-CD1 4.21Å; I676-T761 HydrophobicContact CD1-CG2 4Å; I676-T761 HydrophobicContact CG2-CG2 3.75Å; I676-I797 HydrophobicContact CD1-CD1 4.42Å; I676-I797 HydrophobicContact CD1-CG2 3.36Å; I676-I797 HydrophobicContact CG1-CG2 3.7Å; I676-P798 PolarHBondContact N-O 2.9Å; I676-M799 CarbonylContact O-C 3.54Å; I676-M799 WeakPolarHBondContact O-CA 3.49Å; I676-E800 PolarHBondContact O-N 2.83Å
677	L	76.9	Confident	84.4	Confident	50 Å²	50	53.2 Å²	53.2	26%	0.262	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	120.8	176	-73.6	163.1	0	0	0	111.1	G679 A680 E800 K802	L677-G679 PolarHBondContact O-N 2.77Å; L677-A680 HydrophobicContact CB-CB 3.78Å; L677-A680 WeakPolarHBondContact O-CB 3.41Å; L677-A680 PolarHBondContact O-N 3Å; L677-E800 WeakPolarHBondContact CA-O 3Å; L677-E800 HydrophobicContact CD2-CB 4.22Å; L677-E800 HydrophobicContact CD2-CG 4.27Å; L677-K802 HydrophobicContact CD2-CB 3.96Å
678	I	72	Confident	84.4	Confident	12 Å²	12	52.8 Å²	52.8	6%	0.062	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	129.4	-177	-52	-176.9	0	0	0	111.4	M799 E800 V801 P848 T849 Y1026	I678-M799 HydrophobicContact CD1-CB 3.94Å; I678-M799 HydrophobicContact CD1-CE 3.69Å; I678-M799 HydrophobicContact CG1-CB 3.98Å; I678-M799 HydrophobicContact CG1-CE 3.64Å; I678-E800 PolarHBondContact N-O 2.9Å; I678-V801 HydrophobicContact CD1-CG2 3.75Å; I678-V801 HydrophobicContact CG1-CG2 4.41Å; I678-P848 CarbonylContact O-C 3.5Å; I678-T849 HydrophobicContact CB-CG2 4.24Å; I678-T849 HydrophobicContact CG2-CG2 4.39Å; I678-T849 VanDerWaalsContact O-CA 3.24Å; I678-T849 WeakPolarHBondContact O-CA 3.47Å; I678-T849 WeakPolarHBondContact O-CB 3.39Å; I678-T849 PolarHBondContact O-N 3.34Å; I678-T849 PolarHBondContact O-OG1 3.43Å; I678-Y1026 HydrophobicContact CB-CE2 4.33Å; I678-Y1026 HydrophobicContact CD1-CD1 4.43Å; I678-Y1026 HydrophobicContact CD1-CD2 3.55Å; I678-Y1026 HydrophobicContact CD1-CE1 4.33Å; I678-Y1026 HydrophobicContact CD1-CE2 3.43Å; I678-Y1026 VanDerWaalsContact CD1-CE2 3.43Å; I678-Y1026 HydrophobicContact CD1-CG 4.07Å; I678-Y1026 HydrophobicContact CG1-CE2 4.44Å; I678-Y1026 HydrophobicContact CG2-CE2 3.61Å; I678-Y1026 WeakPolarHBondContact CG2-OH 3.46Å
679	G	69.8	Low	84.3	Confident	28 Å²	28	50.6 Å²	50.6	29%	0.289	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.1	5.1	-177.7	0	0	0	0	0	114.1	L677 P848	L677-G679 PolarHBondContact O-N 2.77Å; G679-P848 CarbonylContact C-O 3.55Å; G679-P848 WeakPolarHBondContact CA-O 3.39Å; G679-P848 WeakPolarHBondContact O-CB 3.38Å
680	A	74.7	Confident	84.3	Confident	16 Å²	16	49.7 Å²	49.7	13%	0.132	26%	0.255	C	S	.	.	S	Bend	trans	-91.8	146.2	169.2	0	0	0	0	0	109.2	L677 D682 T761 P848	L677-A680 HydrophobicContact CB-CB 3.78Å; L677-A680 WeakPolarHBondContact O-CB 3.41Å; L677-A680 PolarHBondContact O-N 3Å; A680-D682 PolarHBondContact O-N 3.15Å; A680-T761 PolarHBondContact O-OG1 3.38Å; A680-P848 HydrophobicContact CB-CB 3.68Å; A680-P848 HydrophobicContact CB-CG 4.15Å
681	D	78.4	Confident	84.3	Confident	92 Å²	92	44.5 Å²	44.5	49%	0.492	23%	0.231	S	C	.	.			trans	-77.7	76.6	172.1	-46.2	-46.5	0	0	0	107.9	R986	D681-R986 IonicContact OD2-NH1 3.87Å; D681-R986 PolarHBondContact OD2-NH1 3.22Å
682	D	79.2	Confident	84.4	Confident	20 Å²	20	42.5 Å²	42.5	11%	0.107	22%	0.221	C	C	.	.			trans	-100.4	139.4	-171.6	-154.6	-1.2	0	0	0	110.5	K673 I676 A680 S760 T761	K673-D682 WeakPolarHBondContact CE-OD2 3.23Å; K673-D682 IonicContact NZ-OD1 2.64Å; K673-D682 PolarHBondContact NZ-OD1 2.83Å; K673-D682 IonicContact NZ-OD2 2.64Å; K673-D682 PolarHBondContact NZ-OD2 2.84Å; I676-D682 HydrophobicContact CG2-CB 4.34Å; A680-D682 PolarHBondContact O-N 3.15Å; D682-S760 WeakPolarHBondContact O-CA 3.44Å; D682-T761 WeakPolarHBondContact CB-OG1 3.33Å; D682-T761 PolarHBondContact N-OG1 2.88Å; D682-T761 VanDerWaalsContact N-OG1 3.14Å; D682-T761 PolarHBondContact O-N 2.81Å; D682-T761 PolarHBondContact O-OG1 2.91Å
683	R	87.2	Confident	84.5	Confident	156 Å²	156	39.5 Å²	39.5	59%	0.589	21%	0.211	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	128.3	-179.6	-69.5	176.6	171	163.6	-0.2	109.6	E713 F759	R683-E713 WeakPolarHBondContact CD-OE2 3.24Å; R683-E713 IonicContact CZ-OE1 2.62Å; R683-E713 IonicContact CZ-OE2 2.75Å; R683-E713 VanDerWaalsContact NE-CD 3.33Å; R683-E713 IonicContact NE-OE1 3.07Å; R683-E713 PolarHBondContact NE-OE1 2.77Å; R683-E713 IonicContact NE-OE2 3.36Å; R683-E713 PolarHBondContact NE-OE2 2.88Å; R683-E713 VanDerWaalsContact NE-OE2 3.1Å; R683-E713 IonicContact NH2-OE1 3.53Å; R683-E713 PolarHBondContact NH2-OE1 2.76Å; R683-F759 WeakPolarHBondContact CA-O 3.4Å
684	F	89.3	Confident	84.7	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	155.1	177.5	66.2	-87.8	0	0	0	111.3	L671 K673 I676 V686 L710 F759 T761 L773 I797	L671-F684 HydrophobicContact CD1-CB 4.29Å; L671-F684 HydrophobicContact CD1-CD2 3.39Å; L671-F684 HydrophobicContact CD1-CE2 4.01Å; L671-F684 HydrophobicContact CD1-CG 4.13Å; K673-F684 HydrophobicContact CB-CB 4.46Å; I676-F684 HydrophobicContact CD1-CD1 3.3Å; I676-F684 HydrophobicContact CD1-CE1 3.24Å; I676-F684 HydrophobicContact CD1-CG 4.05Å; I676-F684 HydrophobicContact CD1-CZ 3.97Å; I676-F684 HydrophobicContact CG1-CD1 4.21Å; F684-V686 HydrophobicContact CD2-CG2 4.17Å; F684-V686 HydrophobicContact CE2-CG2 4Å; F684-L710 HydrophobicContact CE1-CD1 3.64Å; F684-L710 HydrophobicContact CZ-CD1 3.74Å; F684-L710 HydrophobicContact CZ-CD2 3.99Å; F684-L710 HydrophobicContact CZ-CG 4.45Å; F684-F759 HydrophobicContact CD1-CB 4.24Å; F684-F759 HydrophobicContact CD2-CB 4.35Å; F684-F759 HydrophobicContact CD2-CD2 4.43Å; F684-F759 HydrophobicContact CE1-CB 3.66Å; F684-F759 HydrophobicContact CE2-CB 3.78Å; F684-F759 AromaticContact CE2-CD2 3.77Å; F684-F759 HydrophobicContact CE2-CD2 3.77Å; F684-F759 HydrophobicContact CE2-CG 4.06Å; F684-F759 HydrophobicContact CZ-CB 3.42Å; F684-F759 VanDerWaalsContact CZ-CB 3.42Å; F684-F759 HydrophobicContact CZ-CD2 4.16Å; F684-F759 AromaticContact CZ-CG 3.97Å; F684-F759 HydrophobicContact CZ-CG 3.97Å; F684-F759 PolarHBondContact N-O 3.06Å; F684-F759 VanDerWaalsContact N-O 3.08Å; F684-F759 PolarHBondContact O-N 3.18Å; F684-T761 HydrophobicContact CD1-CG2 4.45Å; F684-T761 HydrophobicContact CE1-CG2 3.99Å; F684-L773 HydrophobicContact CE2-CD1 4.28Å; F684-I797 HydrophobicContact CE1-CD1 4.31Å; F684-I797 HydrophobicContact CE2-CD1 3.58Å; F684-I797 HydrophobicContact CZ-CD1 3.4Å
685	N	90.6	Very high	85	Confident	42 Å²	42	34.8 Å²	34.8	23%	0.225	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131.9	178.9	-66.3	-28.6	0	0	0	109.7	N672 N756 L757 Q758	N672-N685 HydrophobicContact CB-CB 4.35Å; N672-N685 VanDerWaalsContact CG-N 3.34Å; N672-N685 PolarHBondContact N-O 3.1Å; N672-N685 PolarHBondContact ND2-N 2.84Å; N672-N685 PolarHBondContact OD1-N 3.19Å; N672-N685 PolarHBondContact OD1-O 3.31Å; N685-N756 HydrophobicContact CB-CB 4.31Å; N685-L757 CarbonylContact C-O 3.6Å; N685-L757 WeakPolarHBondContact CA-O 3.44Å; N685-Q758 WeakPolarHBondContact OD1-CB 3.11Å; N685-Q758 WeakPolarHBondContact OD1-CG 3.33Å
686	V	92.3	Very high	85.3	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	119.4	166.4	-173.3	0	0	0	0	106.8	A669 L671 F684 I688 N756 L757 F759 L773 I795	A669-V686 HydrophobicContact CB-CG1 4.21Å; L671-V686 HydrophobicContact CD1-CG2 4.22Å; F684-V686 HydrophobicContact CD2-CG2 4.17Å; F684-V686 HydrophobicContact CE2-CG2 4Å; V686-I688 HydrophobicContact CB-CD1 4.01Å; V686-I688 HydrophobicContact CG1-CD1 3.79Å; V686-I688 HydrophobicContact CG1-CG1 4.49Å; V686-I688 WeakPolarHBondContact O-CD1 3.3Å; V686-N756 CarbonylContact O-C 3.54Å; V686-N756 WeakPolarHBondContact O-CA 3.28Å; V686-L757 PolarHBondContact N-O 3.28Å; V686-L757 PolarHBondContact O-N 3.35Å; V686-F759 HydrophobicContact CG2-CD2 4.2Å; V686-F759 HydrophobicContact CG2-CE2 4.07Å; V686-L773 HydrophobicContact CG2-CD1 3.74Å; V686-I795 HydrophobicContact CG1-CD1 3.68Å
687	S	92	Very high	85.6	Confident	33 Å²	33	35.5 Å²	35.5	23%	0.231	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	115.2	175.6	-71.1	0	0	0	0	110.3	A669 Q670 N756	A669-S687 CarbonylContact C-O 3.58Å; A669-S687 VanDerWaalsContact CA-O 3.24Å; A669-S687 WeakPolarHBondContact CA-O 3.43Å; Q670-S687 PolarHBondContact N-O 2.84Å; Q670-S687 PolarHBondContact O-N 2.78Å; S687-N756 VanDerWaalsContact CA-OD1 3.3Å; S687-N756 WeakPolarHBondContact CA-OD1 3.4Å; S687-N756 VanDerWaalsContact CB-OD1 3.31Å; S687-N756 WeakPolarHBondContact CB-OD1 3.41Å; S687-N756 PolarHBondContact OG-OD1 2.71Å
688	I	93.1	Very high	85.8	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	132	-178.2	-63.3	74.4	0	0	0	109.1	M667 V686 I690 F702 R754 F755 L757	M667-I688 HydrophobicContact CG-CG2 4.29Å; M667-I688 HydrophobicContact SD-CG2 4.3Å; V686-I688 HydrophobicContact CB-CD1 4.01Å; V686-I688 HydrophobicContact CG1-CD1 3.79Å; V686-I688 HydrophobicContact CG1-CG1 4.49Å; V686-I688 WeakPolarHBondContact O-CD1 3.3Å; I688-I690 HydrophobicContact CG2-CD1 3.91Å; I688-I690 HydrophobicContact CG2-CG1 3.75Å; I688-F702 HydrophobicContact CD1-CZ 4.44Å; I688-F702 HydrophobicContact CG1-CE1 4.48Å; I688-F702 HydrophobicContact CG1-CE2 4.16Å; I688-F702 HydrophobicContact CG1-CZ 3.75Å; I688-F702 HydrophobicContact CG2-CD2 4.48Å; I688-F702 HydrophobicContact CG2-CE2 4.08Å; I688-F702 HydrophobicContact CG2-CZ 4.37Å; I688-R754 WeakPolarHBondContact O-CA 3.47Å; I688-F755 HydrophobicContact CB-CD1 4.33Å; I688-F755 HydrophobicContact CB-CD2 4.38Å; I688-F755 HydrophobicContact CB-CE1 3.95Å; I688-F755 HydrophobicContact CB-CE2 3.98Å; I688-F755 HydrophobicContact CB-CZ 3.76Å; I688-F755 HydrophobicContact CD1-CD2 4.4Å; I688-F755 HydrophobicContact CD1-CE2 4.1Å; I688-F755 HydrophobicContact CG1-CE2 4.06Å; I688-F755 HydrophobicContact CG1-CZ 4.14Å; I688-F755 HydrophobicContact CG2-CD1 4.47Å; I688-F755 HydrophobicContact CG2-CE1 3.7Å; I688-F755 HydrophobicContact CG2-CE2 4.33Å; I688-F755 HydrophobicContact CG2-CZ 3.62Å; I688-F755 PolarHBondContact N-O 3.35Å; I688-F755 PolarHBondContact O-N 3.39Å; I688-F755 VanDerWaalsContact O-N 3.13Å; I688-L757 HydrophobicContact CD1-CB 4.32Å; I688-L757 HydrophobicContact CD1-CD1 3.8Å; I688-L757 HydrophobicContact CD1-CG 3.71Å
689	T	92.7	Very high	86.2	Confident	37 Å²	37	36.9 Å²	36.9	23%	0.227	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	117	169.4	-61.1	0	0	0	0	109.4	M667 T668 T752 V753 R754	M667-T689 WeakPolarHBondContact CA-O 3.4Å; T668-T689 PolarHBondContact N-O 3.25Å; T668-T689 PolarHBondContact O-N 3.06Å; T689-T752 HydrophobicContact CG2-CG2 3.48Å; T689-T752 VanDerWaalsContact CG2-CG2 3.48Å; T689-V753 WeakPolarHBondContact CA-O 3.38Å; T689-R754 HydrophobicContact CG2-CG 4Å
690	I	92.2	Very high	87	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	132.2	176.6	-60	166.4	0	0	0	108.5	R666 M667 I688 F702 I743 L747 T752 V753 F755 T777	R666-I690 CarbonylContact O-C 3.49Å; R666-I690 WeakPolarHBondContact O-CA 3.42Å; M667-I690 HydrophobicContact CB-CG1 4.19Å; M667-I690 HydrophobicContact CG-CG1 3.98Å; M667-I690 HydrophobicContact SD-CD1 4.45Å; M667-I690 HydrophobicContact SD-CG1 4.3Å; I688-I690 HydrophobicContact CG2-CD1 3.91Å; I688-I690 HydrophobicContact CG2-CG1 3.75Å; I690-F702 HydrophobicContact CD1-CB 3.89Å; I690-F702 HydrophobicContact CD1-CD2 3.73Å; I690-F702 HydrophobicContact CD1-CG 4Å; I690-I743 HydrophobicContact CD1-CD1 3.72Å; I690-I743 HydrophobicContact CD1-CG2 4.37Å; I690-I743 HydrophobicContact CG2-CD1 3.98Å; I690-L747 HydrophobicContact CG2-CD2 4.44Å; I690-T752 CarbonylContact O-C 3.58Å; I690-T752 VanDerWaalsContact O-CA 3.31Å; I690-T752 WeakPolarHBondContact O-CA 3.32Å; I690-T752 WeakPolarHBondContact O-CG2 3.35Å; I690-V753 PolarHBondContact N-O 3.38Å; I690-V753 PolarHBondContact O-N 2.82Å; I690-F755 HydrophobicContact CD1-CE1 4.12Å; I690-F755 HydrophobicContact CD1-CZ 4.37Å; I690-T777 HydrophobicContact CG2-CG2 4.32Å
691	H	92.4	Very high	87.7	Confident	32 Å²	32	37.7 Å²	37.7	15%	0.148	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	139.1	179.6	179.1	88.6	0	0	0	110.4	L665 R666 T751 T752	L665-H691 CarbonylContact C-O 3.46Å; L665-H691 WeakPolarHBondContact CA-O 3.29Å; R666-H691 HydrophobicContact CG-CB 3.74Å; R666-H691 PolarHBondContact N-O 2.81Å; R666-H691 PolarHBondContact NE-CD2 2.78Å; R666-H691 PolarHBondContact NH2-CD2 3.02Å; R666-H691 PolarHBondContact NH2-NE2 3.21Å; R666-H691 VanDerWaalsContact NH2-NE2 3.13Å; R666-H691 PolarHBondContact O-N 2.88Å; H691-T751 WeakPolarHBondContact CA-O 3.33Å; H691-T752 HydrophobicContact CB-CG2 4.41Å; H691-T752 PolarHBondContact ND1-OG1 3.44Å
692	N	91.4	Very high	88.3	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	111.9	171.1	-176.7	9	0	0	0	110	D664 L665 E695 A697 L747 A750 T751	D664-N692 PolarHBondContact N-OD1 2.78Å; D664-N692 CarbonylContact O-C 3.57Å; D664-N692 VanDerWaalsContact O-CA 3.28Å; D664-N692 WeakPolarHBondContact O-CA 3.2Å; L665-N692 HydrophobicContact CD2-CB 3.95Å; N692-E695 PolarHBondContact ND2-O 2.73Å; N692-E695 PolarHBondContact OD1-O 3.07Å; N692-A697 PolarHBondContact ND2-N 3.19Å; N692-L747 HydrophobicContact CB-CD2 3.89Å; N692-L747 HydrophobicContact CB-CG 3.94Å; N692-L747 PolarHBondContact ND2-O 3.24Å; N692-A750 WeakPolarHBondContact O-CA 3.49Å; N692-A750 PolarHBondContact O-N 3.42Å; N692-T751 PolarHBondContact N-O 3.45Å; N692-T751 PolarHBondContact O-N 2.64Å
693	G	88.6	Confident	89	Confident	28 Å²	28	34.6 Å²	34.6	29%	0.289	17%	0.173	S	C	.	.			trans	-85.3	-25.3	-172.1	0	0	0	0	0	115.9	D664	D664-G693 PolarHBondContact O-N 2.75Å
694	L	86.7	Confident	89.3	Confident	92 Å²	92	27.2 Å²	27.2	48%	0.482	15%	0.145	S	C	.	.	S	Bend	trans	-114.2	-113.1	-170.8	-68.7	179.9	0	0	0	112.7	I662 D664 R749	I662-L694 WeakPolarHBondContact O-CB 3.09Å; D664-L694 HydrophobicContact CB-CB 3.89Å; D664-L694 HydrophobicContact CB-CD1 3.74Å; D664-L694 HydrophobicContact CB-CG 3.52Å; L694-R749 WeakPolarHBondContact O-CA 3.34Å; L694-R749 WeakPolarHBondContact O-CB 3.19Å; L694-R749 WeakPolarHBondContact O-CD 3.14Å; L694-R749 WeakPolarHBondContact O-CG 3.24Å
695	E	87.8	Confident	89.5	Confident	67 Å²	67	28.7 Å²	28.7	31%	0.313	15%	0.153	S	C	.	.	S	Bend	trans	-94	173	-177.4	-59.3	-175.1	150.6	0	0	112	I660 C661 I662 N692 A697	I660-E695 VanDerWaalsContact O-OE2 3.07Å; C661-E695 VanDerWaalsContact CA-OE2 3.26Å; C661-E695 WeakPolarHBondContact CA-OE2 3.05Å; I662-E695 PolarHBondContact N-OE2 3.49Å; I662-E695 WeakPolarHBondContact O-CB 3.11Å; I662-E695 PolarHBondContact O-N 2.95Å; N692-E695 PolarHBondContact ND2-O 2.73Å; N692-E695 PolarHBondContact OD1-O 3.07Å; E695-A697 PolarHBondContact O-N 3.35Å
696	D	84.9	Confident	89.4	Confident	41 Å²	41	26.8 Å²	26.8	22%	0.219	14%	0.142	C	C	.	.			trans	-59.9	128.6	-178.3	-79.4	17	0	0	0	111.8	C661 F698 P746 P748 R749	C661-D696 WeakPolarHBondContact CB-O 3.48Å; D696-F698 HydrophobicContact CB-CZ 4.31Å; D696-P746 HydrophobicContact CB-CB 3.71Å; D696-P746 HydrophobicContact CB-CG 4.15Å; D696-P746 WeakPolarHBondContact OD2-CG 3.48Å; D696-P748 WeakPolarHBondContact OD1-CA 3.26Å; D696-R749 PolarHBondContact OD1-N 3.01Å
697	A	85.3	Confident	89.3	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-98.1	110.8	177.5	0	0	0	0	0	110.1	P663 L665 N692 E695 A700 P746 L747	P663-A697 HydrophobicContact CB-CB 3.57Å; P663-A697 HydrophobicContact CG-CB 4.01Å; L665-A697 HydrophobicContact CD2-CB 4.05Å; N692-A697 PolarHBondContact ND2-N 3.19Å; E695-A697 PolarHBondContact O-N 3.35Å; A697-A700 HydrophobicContact CB-CB 4.16Å; A697-P746 CarbonylContact O-C 3.55Å; A697-P746 WeakPolarHBondContact O-CA 3.23Å; A697-L747 HydrophobicContact CB-CB 4.28Å; A697-L747 PolarHBondContact N-O 2.99Å; A697-L747 PolarHBondContact O-N 3.42Å
698	F	81.1	Confident	88.8	Confident	20 Å²	20	30.3 Å²	30.3	9%	0.088	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	142.2	177.5	-61.9	-63.8	0	0	0	112.6	K653 C655 C661 D696 A700 P746 S779 T780 N781	K653-F698 HydrophobicContact CB-CD1 4.19Å; K653-F698 HydrophobicContact CB-CE1 3.26Å; K653-F698 HydrophobicContact CB-CE2 3.98Å; K653-F698 HydrophobicContact CB-CZ 3.15Å; K653-F698 HydrophobicContact CD-CD1 3.16Å; K653-F698 HydrophobicContact CD-CE1 3.01Å; K653-F698 HydrophobicContact CD-CG 4.13Å; K653-F698 HydrophobicContact CD-CZ 3.86Å; K653-F698 HydrophobicContact CG-CD1 4.24Å; K653-F698 HydrophobicContact CG-CE1 3.69Å; K653-F698 HydrophobicContact CG-CZ 4.08Å; C655-F698 WeakPolarHBondContact SG-CE2 3.21Å; C661-F698 HydrophobicContact CB-CD2 4.47Å; C661-F698 HydrophobicContact CB-CE2 4.07Å; C661-F698 WeakPolarHBondContact SG-CE2 3.42Å; D696-F698 HydrophobicContact CB-CZ 4.31Å; F698-A700 PolarHBondContact O-N 3.21Å; F698-P746 HydrophobicContact CD1-CB 3.51Å; F698-P746 HydrophobicContact CD1-CG 4.01Å; F698-P746 HydrophobicContact CE1-CB 3.43Å; F698-P746 VanDerWaalsContact CE1-CB 3.43Å; F698-P746 HydrophobicContact CE1-CG 3.53Å; F698-P746 HydrophobicContact CG-CB 4.41Å; F698-P746 HydrophobicContact CZ-CB 4.3Å; F698-P746 HydrophobicContact CZ-CG 4.45Å; F698-S779 WeakPolarHBondContact O-CB 3.23Å; F698-T780 PolarHBondContact O-N 3.25Å; F698-T780 PolarHBondContact O-OG1 2.76Å; F698-N781 WeakPolarHBondContact CD2-OD1 3.33Å; F698-N781 PolarHBondContact N-OD1 2.76Å
699	E	79.9	Confident	88.1	Confident	70 Å²	70	31 Å²	31	33%	0.327	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.1	45.1	-174.2	-62.2	-176.2	-165.8	0	0	110.8	Q701 N745 T780	E699-Q701 PolarHBondContact O-N 2.72Å; E699-Q701 VanDerWaalsContact O-N 3.16Å; E699-N745 WeakPolarHBondContact CG-ND2 3.42Å; E699-N745 PolarHBondContact N-OD1 2.86Å; E699-T780 HydrophobicContact CB-CG2 3.75Å; E699-T780 HydrophobicContact CG-CG2 4.25Å; E699-T780 WeakPolarHBondContact OE2-CG2 3.37Å
700	A	86.5	Confident	87.9	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	120	174.2	0	0	0	0	0	107.7	A697 F698 I743 G744 L747 N778	A697-A700 HydrophobicContact CB-CB 4.16Å; F698-A700 PolarHBondContact O-N 3.21Å; A700-I743 HydrophobicContact CB-CD1 3.99Å; A700-I743 HydrophobicContact CB-CG1 3.72Å; A700-I743 WeakPolarHBondContact O-CG1 2.81Å; A700-I743 PolarHBondContact O-N 3.1Å; A700-I743 VanDerWaalsContact O-N 3.08Å; A700-G744 WeakPolarHBondContact CB-O 3.33Å; A700-G744 PolarHBondContact N-O 2.65Å; A700-G744 PolarHBondContact O-N 3.35Å; A700-L747 HydrophobicContact CB-CB 3.7Å; A700-L747 HydrophobicContact CB-CD2 4.28Å; A700-N778 CarbonylContact C-O 3.5Å; A700-N778 WeakPolarHBondContact CA-O 3.2Å
701	Q	89.2	Confident	87.6	Confident	62 Å²	62	31.8 Å²	31.8	29%	0.29	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	155.1	-177.7	-72.4	-179.1	-2.7	0	0	110.3	E699 F703 C741 T777 N778	E699-Q701 PolarHBondContact O-N 2.72Å; E699-Q701 VanDerWaalsContact O-N 3.16Å; Q701-F703 HydrophobicContact CB-CD2 4.48Å; Q701-F703 HydrophobicContact CB-CE2 3.69Å; Q701-F703 HydrophobicContact CB-CZ 4.02Å; Q701-C741 CarbonylContact C-O 3.58Å; Q701-C741 WeakPolarHBondContact CA-O 3.31Å; Q701-T777 WeakPolarHBondContact O-CA 3.3Å; Q701-T777 PolarHBondContact O-OG1 3.27Å; Q701-N778 PolarHBondContact N-O 3.49Å; Q701-N778 PolarHBondContact O-N 3.21Å
702	F	92	Very high	87.5	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	132.3	175.4	164.3	-95.2	0	0	0	108.9	M667 I688 I690 V704 C741 I743 F755 L757 L775 I776	M667-F702 HydrophobicContact SD-CD2 3.7Å; M667-F702 HydrophobicContact SD-CE2 3.46Å; M667-F702 WeakPolarHBondContact SD-CE2 3.27Å; I688-F702 HydrophobicContact CD1-CZ 4.44Å; I688-F702 HydrophobicContact CG1-CE1 4.48Å; I688-F702 HydrophobicContact CG1-CE2 4.16Å; I688-F702 HydrophobicContact CG1-CZ 3.75Å; I688-F702 HydrophobicContact CG2-CD2 4.48Å; I688-F702 HydrophobicContact CG2-CE2 4.08Å; I688-F702 HydrophobicContact CG2-CZ 4.37Å; I690-F702 HydrophobicContact CD1-CB 3.89Å; I690-F702 HydrophobicContact CD1-CD2 3.73Å; I690-F702 HydrophobicContact CD1-CG 4Å; F702-V704 HydrophobicContact CD1-CG2 4.24Å; F702-V704 HydrophobicContact CE1-CG2 3.22Å; F702-V704 HydrophobicContact CE2-CG2 4.34Å; F702-V704 HydrophobicContact CZ-CG2 3.29Å; F702-C741 HydrophobicContact CB-CB 4.35Å; F702-C741 HydrophobicContact CD1-CB 3.93Å; F702-C741 PolarHBondContact N-O 3.3Å; F702-C741 PolarHBondContact O-N 2.8Å; F702-I743 HydrophobicContact CB-CD1 4.38Å; F702-I743 HydrophobicContact CB-CG2 3.87Å; F702-F755 AromaticContact CD1-CE2 3.9Å; F702-F755 HydrophobicContact CD1-CE2 3.9Å; F702-F755 AromaticContact CD1-CZ 3.53Å; F702-F755 HydrophobicContact CD1-CZ 3.53Å; F702-F755 HydrophobicContact CD2-CZ 4.4Å; F702-F755 AromaticContact CE1-CE2 3.69Å; F702-F755 HydrophobicContact CE1-CE2 3.69Å; F702-F755 AromaticContact CE1-CZ 3.67Å; F702-F755 HydrophobicContact CE1-CZ 3.67Å; F702-F755 AromaticContact CG-CZ 3.89Å; F702-F755 HydrophobicContact CG-CZ 3.89Å; F702-F755 HydrophobicContact CZ-CE2 4.32Å; F702-F755 HydrophobicContact CZ-CZ 4.16Å; F702-L757 HydrophobicContact CE1-CD1 3.78Å; F702-L757 HydrophobicContact CZ-CD1 4.01Å; F702-L775 HydrophobicContact CE2-CB 4.08Å; F702-L775 HydrophobicContact CE2-CD2 4.04Å; F702-L775 HydrophobicContact CZ-CB 4.5Å; F702-L775 HydrophobicContact CZ-CD2 3.61Å; F702-I776 CarbonylContact C-O 3.54Å; F702-I776 WeakPolarHBondContact CA-O 3.33Å
703	F	93.1	Very high	87.3	Confident	47 Å²	47	35.7 Å²	35.7	21%	0.206	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	139.9	-176.5	-61.6	-88.1	0	0	0	110.5	Q701 V738 I739 S740 L775 I776 N778	Q701-F703 HydrophobicContact CB-CD2 4.48Å; Q701-F703 HydrophobicContact CB-CE2 3.69Å; Q701-F703 HydrophobicContact CB-CZ 4.02Å; F703-V738 HydrophobicContact CB-CG2 4.4Å; F703-V738 HydrophobicContact CD1-CG2 4.04Å; F703-I739 VanDerWaalsContact CA-O 3.28Å; F703-I739 WeakPolarHBondContact CA-O 3.45Å; F703-S740 WeakPolarHBondContact CE1-OG 3.41Å; F703-L775 WeakPolarHBondContact O-CA 3.36Å; F703-I776 HydrophobicContact CB-CB 4.44Å; F703-I776 PolarHBondContact N-O 3.31Å; F703-I776 PolarHBondContact O-N 3.4Å; F703-N778 WeakPolarHBondContact CE2-OD1 3.47Å
704	V	93.5	Very high	87.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	123.8	168.9	-171.5	0	0	0	0	108.8	F702 V738 I739 L757 F759 L773 H774 L775	F702-V704 HydrophobicContact CD1-CG2 4.24Å; F702-V704 HydrophobicContact CE1-CG2 3.22Å; F702-V704 HydrophobicContact CE2-CG2 4.34Å; F702-V704 HydrophobicContact CZ-CG2 3.29Å; V704-V738 CarbonylContact O-C 3.59Å; V704-V738 VanDerWaalsContact O-CA 3.27Å; V704-V738 WeakPolarHBondContact O-CA 3.42Å; V704-I739 HydrophobicContact CB-CB 4.45Å; V704-I739 PolarHBondContact N-O 3.16Å; V704-I739 PolarHBondContact O-N 3.13Å; V704-L757 HydrophobicContact CG2-CD1 3.45Å; V704-L757 VanDerWaalsContact CG2-CD1 3.45Å; V704-F759 HydrophobicContact CG1-CZ 4.21Å; V704-L773 HydrophobicContact CG1-CD2 4.32Å; V704-H774 WeakPolarHBondContact CA-O 3.49Å; V704-L775 HydrophobicContact CB-CD2 4.37Å; V704-L775 HydrophobicContact CG1-CD2 3.96Å; V704-L775 HydrophobicContact CG2-CD2 3.7Å
705	I	93.1	Very high	87.3	Confident	32 Å²	32	33.1 Å²	33.1	16%	0.164	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	119.5	169	-53.7	171.1	0	0	0	106.8	F732 Y737 V738 H774 I776	I705-F732 HydrophobicContact CD1-CE1 4.22Å; I705-F732 HydrophobicContact CD1-CZ 4.39Å; I705-F732 HydrophobicContact CG2-CD1 4.32Å; I705-Y737 WeakPolarHBondContact CA-O 3.09Å; I705-V738 HydrophobicContact CG1-CG2 4.43Å; I705-H774 HydrophobicContact CB-CB 4.23Å; I705-H774 PolarHBondContact N-O 3.16Å; I705-H774 PolarHBondContact O-N 2.95Å; I705-I776 HydrophobicContact CD1-CD1 4.3Å
706	A	90.4	Very high	87.1	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.008	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	148.4	-177.5	0	0	0	0	0	110.3	L710 S736 Y737 L773	A706-L710 HydrophobicContact CB-CD2 4.38Å; A706-S736 CarbonylContact O-C 3.58Å; A706-S736 WeakPolarHBondContact O-CA 3.21Å; A706-S736 VanDerWaalsContact O-CB 3.23Å; A706-S736 WeakPolarHBondContact O-CB 3.41Å; A706-Y737 HydrophobicContact CB-CD1 4.48Å; A706-Y737 HydrophobicContact CB-CE1 3.8Å; A706-Y737 HydrophobicContact CB-CE2 3.98Å; A706-Y737 PolarHBondContact N-O 2.97Å; A706-Y737 WeakPolarHBondContact O-CD1 3.3Å; A706-Y737 PolarHBondContact O-N 2.8Å; A706-L773 HydrophobicContact CB-CD2 3.56Å
707	P	88.9	Confident	86.8	Confident	24 Å²	24	37.1 Å²	37.1	16%	0.156	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	146.7	-179.9	29	-34.5	0	0	0	111.7	G709 L710 T735 Y737 I767 I771	P707-G709 PolarHBondContact O-N 2.65Å; P707-L710 PolarHBondContact O-N 2.8Å; P707-T735 WeakPolarHBondContact CA-O 3.42Å; P707-Y737 WeakPolarHBondContact O-CE1 2.94Å; P707-I767 HydrophobicContact CB-CD1 4.16Å; P707-I767 HydrophobicContact CG-CD1 4.13Å; P707-I771 HydrophobicContact CG-CG2 3.98Å
708	I	82.6	Confident	86.3	Confident	84 Å²	84	40.5 Å²	40.5	43%	0.431	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	132.2	172.4	-65.6	168.5	0	0	0	108.7	E734 T735	I708-E734 WeakPolarHBondContact CD1-O 3.24Å; I708-T735 PolarHBondContact N-O 2.99Å
709	G	78.6	Confident	85.6	Confident	15 Å²	15	46 Å²	46	16%	0.155	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	112.9	-27.9	-174	0	0	0	0	0	112.9	P707 N763 V764	P707-G709 PolarHBondContact O-N 2.65Å; G709-N763 WeakPolarHBondContact CA-O 3.42Å; G709-N763 CarbonylContact O-C 3.54Å; G709-V764 WeakPolarHBondContact O-CG2 3.49Å; G709-V764 PolarHBondContact O-N 3.39Å
710	L	86.9	Confident	84.6	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	24%	0.241	C	C	.	.	S	Bend	trans	-84.1	121.3	169.1	-176.8	71.9	0	0	0	109.3	F684 A706 P707 Y737 F759 S760 T761 V764 I771 L773	F684-L710 HydrophobicContact CE1-CD1 3.64Å; F684-L710 HydrophobicContact CZ-CD1 3.74Å; F684-L710 HydrophobicContact CZ-CD2 3.99Å; F684-L710 HydrophobicContact CZ-CG 4.45Å; A706-L710 HydrophobicContact CB-CD2 4.38Å; P707-L710 PolarHBondContact O-N 2.8Å; L710-Y737 WeakPolarHBondContact O-CE1 3.22Å; L710-Y737 PolarHBondContact O-OH 3.03Å; L710-F759 HydrophobicContact CD1-CB 4.12Å; L710-F759 HydrophobicContact CD2-CB 4.31Å; L710-F759 HydrophobicContact CD2-CD1 3.71Å; L710-F759 HydrophobicContact CD2-CE1 4.24Å; L710-F759 HydrophobicContact CD2-CG 4.1Å; L710-F759 HydrophobicContact CG-CB 4.21Å; L710-F759 HydrophobicContact CG-CD1 3.95Å; L710-F759 HydrophobicContact CG-CG 4.39Å; L710-S760 WeakPolarHBondContact CD1-O 3.37Å; L710-T761 HydrophobicContact CD1-CG2 3.88Å; L710-V764 HydrophobicContact CB-CG2 4.45Å; L710-V764 HydrophobicContact CD1-CG2 4.38Å; L710-I771 HydrophobicContact CD2-CG2 4.02Å; L710-L773 HydrophobicContact CD2-CD2 3.77Å
711	D	87.1	Confident	83.4	Confident	52 Å²	52	52.8 Å²	52.8	28%	0.278	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	139.6	-176.2	-71.3	-36.8	0	0	0	112.2	F759 S760 N763	D711-F759 CarbonylContact O-C 3.57Å; D711-F759 WeakPolarHBondContact O-CA 3.48Å; D711-S760 PolarHBondContact N-O 2.86Å; D711-S760 PolarHBondContact O-N 2.71Å; D711-N763 PolarHBondContact OD2-ND2 2.84Å
712	Y	89.9	Confident	82.2	Confident	41 Å²	41	54.1 Å²	54.1	16%	0.161	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	111.1	174.9	171.4	-113.7	0	0	0	110.7	G714 C726 P729 I739 L757 F759	Y712-G714 VanDerWaalsContact CE2-C 3.46Å; Y712-G714 WeakPolarHBondContact CE2-O 3.32Å; Y712-G714 VanDerWaalsContact CZ-CA 3.49Å; Y712-C726 WeakPolarHBondContact OH-CB 3.49Å; Y712-P729 HydrophobicContact CD1-CG 3.98Å; Y712-P729 HydrophobicContact CG-CG 4.43Å; Y712-I739 HydrophobicContact CD1-CD1 3.87Å; Y712-I739 HydrophobicContact CD1-CG1 4.25Å; Y712-I739 HydrophobicContact CD2-CD1 3.44Å; Y712-I739 VanDerWaalsContact CD2-CD1 3.44Å; Y712-I739 HydrophobicContact CE1-CD1 4.26Å; Y712-I739 HydrophobicContact CE1-CG2 4.35Å; Y712-I739 HydrophobicContact CE2-CD1 3.88Å; Y712-I739 HydrophobicContact CG-CD1 3.41Å; Y712-I739 VanDerWaalsContact CG-CD1 3.41Å; Y712-I739 HydrophobicContact CG-CG1 4.26Å; Y712-L757 HydrophobicContact CE2-CD2 4.02Å; Y712-F759 HydrophobicContact CD2-CD1 4.49Å; Y712-F759 HydrophobicContact CD2-CE1 4.13Å; Y712-F759 HydrophobicContact CD2-CZ 4.4Å
713	E	87.9	Confident	81	Confident	72 Å²	72	60.1 Å²	60.1	34%	0.336	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-17.8	-178.6	-66.5	-168.8	149	0	0	113	R683 Q758	R683-E713 WeakPolarHBondContact CD-OE2 3.24Å; R683-E713 IonicContact CZ-OE1 2.62Å; R683-E713 IonicContact CZ-OE2 2.75Å; R683-E713 VanDerWaalsContact NE-CD 3.33Å; R683-E713 IonicContact NE-OE1 3.07Å; R683-E713 PolarHBondContact NE-OE1 2.77Å; R683-E713 IonicContact NE-OE2 3.36Å; R683-E713 PolarHBondContact NE-OE2 2.88Å; R683-E713 VanDerWaalsContact NE-OE2 3.1Å; R683-E713 IonicContact NH2-OE1 3.53Å; R683-E713 PolarHBondContact NH2-OE1 2.76Å; E713-Q758 HydrophobicContact CB-CB 4.42Å; E713-Q758 HydrophobicContact CB-CG 4.11Å; E713-Q758 PolarHBondContact N-O 2.93Å; E713-Q758 PolarHBondContact OE2-NE2 3.48Å
714	G	87.6	Confident	80.3	Confident	16 Å²	16	58 Å²	58	17%	0.165	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	138.2	-159.6	178.8	0	0	0	0	0	113.7	Y712 Q758	Y712-G714 VanDerWaalsContact CE2-C 3.46Å; Y712-G714 WeakPolarHBondContact CE2-O 3.32Å; Y712-G714 VanDerWaalsContact CZ-CA 3.49Å; G714-Q758 PolarHBondContact O-N 3.13Å
715	F	86.5	Confident	79.7	Confident	50 Å²	50	62.1 Å²	62.1	22%	0.219	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	150.2	-179.7	73	-78.9	0	0	0	112	R717 I724 C726 N756 L757	F715-R717 HydrophobicContact CD2-CG 4.33Å; F715-R717 HydrophobicContact CE2-CG 3.94Å; F715-I724 HydrophobicContact CD2-CG2 4.47Å; F715-I724 HydrophobicContact CE2-CB 4.03Å; F715-I724 HydrophobicContact CE2-CG2 4.13Å; F715-I724 WeakPolarHBondContact CE2-O 3.13Å; F715-I724 WeakPolarHBondContact CZ-O 3.31Å; F715-C726 HydrophobicContact CD1-CB 3.98Å; F715-C726 HydrophobicContact CE1-CB 4.11Å; F715-N756 CarbonylContact C-O 3.59Å; F715-N756 WeakPolarHBondContact CA-O 3.36Å; F715-N756 WeakPolarHBondContact CB-O 3.42Å; F715-L757 HydrophobicContact CB-CD2 3.91Å
716	T	84.9	Confident	79.3	Confident	63 Å²	63	61.8 Å²	61.8	39%	0.387	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	136.9	175	57.1	0	0	0	0	110.6	F755 N756	T716-F755 CarbonylContact O-C 3.57Å; T716-F755 WeakPolarHBondContact O-CA 3.34Å; T716-F755 WeakPolarHBondContact O-CB 3.29Å; T716-N756 PolarHBondContact N-O 2.92Å; T716-N756 PolarHBondContact O-N 2.82Å; T716-N756 WeakPolarHBondContact OG1-CB 3.41Å
717	R	78.3	Confident	79.1	Confident	129 Å²	129	63.4 Å²	63.4	49%	0.487	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	136.4	-177	-61.3	-179.7	-177.6	99.9	-0.4	110.2	F715 I724	F715-R717 HydrophobicContact CD2-CG 4.33Å; F715-R717 HydrophobicContact CE2-CG 3.94Å; R717-I724 PolarHBondContact NH2-O 3.41Å
718	Q	74.9	Confident	78.9	Confident	71 Å²	71	70.2 Å²	70.2	33%	0.332	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-103.2	151.7	170.3	-69	-174.4	-23.9	0	0	110.8	P720 R754 N756	Q718-P720 CarbonylContact O-C 3.55Å; Q718-R754 HydrophobicContact CB-CB 3.83Å; Q718-R754 PolarHBondContact N-O 2.92Å; Q718-R754 VanDerWaalsContact N-O 3.12Å; Q718-N756 PolarHBondContact NE2-ND2 2.83Å; Q718-N756 PolarHBondContact NE2-OD1 3.4Å
719	L	66.3	Low	79.1	Confident	136 Å²	136	69.1 Å²	69.1	71%	0.712	37%	0.366	S	S	*	.	S	Bend	trans	-68.3	142.1	176.3	-80.4	149.5	0	0	0	110.7	I721	L719-I721 HydrophobicContact CD2-CD1 3.92Å; L719-I721 HydrophobicContact CD2-CG1 3.77Å; L719-I721 HydrophobicContact CG-CD1 4.43Å; L719-I721 HydrophobicContact CG-CG1 4.08Å
720	P	59	Low	79.4	Confident	88 Å²	88	75.1 Å²	75.1	57%	0.571	39%	0.388	S	S	*	.	S	Bend	cis	-73	132.2	-0.7	29.5	-32.9	0	0	0	112.4	Q718 R722	Q718-P720 CarbonylContact O-C 3.55Å; P720-R722 PolarHBondContact O-N 3.2Å
721	I	60.3	Low	79.4	Confident	124 Å²	124	82.3 Å²	82.3	64%	0.636	42%	0.422	S	S	*	.			trans	-68.5	104.9	-172.2	-59	162.4	0	0	0	109.4	L719	L719-I721 HydrophobicContact CD2-CD1 3.92Å; L719-I721 HydrophobicContact CD2-CG1 3.77Å; L719-I721 HydrophobicContact CG-CD1 4.43Å; L719-I721 HydrophobicContact CG-CG1 4.08Å
722	R	65.2	Low	79.2	Confident	90 Å²	90	85.7 Å²	85.7	34%	0.34	43%	0.434	S	S	.	.			trans	-102.5	150.3	163.9	-76.4	-175.3	170.3	-121.5	6.2	110.3	P720 I724 T751	P720-R722 PolarHBondContact O-N 3.2Å; R722-I724 PolarHBondContact O-N 2.88Å; R722-T751 VanDerWaalsContact NE-CG2 3.26Å; R722-T751 PolarHBondContact NH2-OG1 3.24Å
723	T	65.8	Low	78.9	Confident	126 Å²	126	86.9 Å²	86.9	77%	0.773	44%	0.443	S	S	*	.			trans	-72.8	96.2	178.5	49.5	0	0	0	0	109.4
724	I	77.9	Confident	78.5	Confident	2 Å²	2	92 Å²	92	1%	0.01	47%	0.467	C	S	.	.			trans	-98.9	141.3	169.2	-55.7	164.2	0	0	0	108	F715 R717 R722 C741 D742 I743 V753 F755	F715-I724 HydrophobicContact CD2-CG2 4.47Å; F715-I724 HydrophobicContact CE2-CB 4.03Å; F715-I724 HydrophobicContact CE2-CG2 4.13Å; F715-I724 WeakPolarHBondContact CE2-O 3.13Å; F715-I724 WeakPolarHBondContact CZ-O 3.31Å; R717-I724 PolarHBondContact NH2-O 3.41Å; R722-I724 PolarHBondContact O-N 2.88Å; I724-C741 HydrophobicContact CG2-CB 4.37Å; I724-D742 WeakPolarHBondContact CA-O 3.49Å; I724-I743 HydrophobicContact CG2-CG2 4.44Å; I724-V753 HydrophobicContact CD1-CG1 3.34Å; I724-V753 HydrophobicContact CG1-CG1 3.82Å; I724-F755 HydrophobicContact CD1-CB 3.67Å; I724-F755 HydrophobicContact CD1-CD1 3.49Å; I724-F755 VanDerWaalsContact CD1-CD1 3.49Å; I724-F755 HydrophobicContact CD1-CE1 4.32Å; I724-F755 HydrophobicContact CD1-CG 3.77Å
725	T	81.9	Confident	78.3	Confident	87 Å²	87	95.9 Å²	95.9	53%	0.534	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	120.8	176.7	-12.1	0	0	0	0	109.3	C741 D742	T725-C741 CarbonylContact O-C 3.55Å; T725-C741 VanDerWaalsContact O-CA 3.3Å; T725-C741 WeakPolarHBondContact O-CA 3.42Å; T725-D742 PolarHBondContact N-O 3.39Å; T725-D742 PolarHBondContact O-N 3.19Å
726	C	85.3	Confident	78.3	Confident	25 Å²	25	94 Å²	94	17%	0.169	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	143.2	177.3	-61.1	0	0	0	0	110.9	Y712 F715 I739 S740 C741	Y712-C726 WeakPolarHBondContact OH-CB 3.49Å; F715-C726 HydrophobicContact CD1-CB 3.98Å; F715-C726 HydrophobicContact CE1-CB 4.11Å; C726-I739 HydrophobicContact CB-CG2 4.07Å; C726-S740 CarbonylContact C-O 3.49Å; C726-S740 WeakPolarHBondContact CA-O 3.34Å; C726-C741 HydrophobicContact CB-CB 4.08Å; C726-C741 WeakPolarHBondContact CB-SG 3.1Å; C726-C741 WeakPolarHBondContact SG-CB 3.19Å; C726-C741 CovalentContact SG-SG 2.04Å; C726-C741 PolarHBondContact SG-SG 3.01Å
727	S	85.6	Confident	78.6	Confident	36 Å²	36	91.9 Å²	91.9	25%	0.252	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-71.7	163.1	173.7	72.5	0	0	0	0	111.4	S740	S727-S740 PolarHBondContact N-O 3.09Å; S727-S740 PolarHBondContact OG-N 3.24Å; S727-S740 VanDerWaalsContact OG-N 3.12Å; S727-S740 PolarHBondContact OG-O 2.85Å
728	Q	85.1	Confident	79.3	Confident	167 Å²	167	87 Å²	87	78%	0.78	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-64.6	153	159.7	-72.3	-178.2	-19.3	0	0	110	K730	Q728-K730 PolarHBondContact O-N 2.76Å
729	P	86.9	Confident	80	Confident	60 Å²	60	83.6 Å²	83.6	39%	0.39	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-49.7	133.4	172.1	-31.1	39.3	0	0	0	112.2	Y712 Y737 I739	Y712-P729 HydrophobicContact CD1-CG 3.98Å; Y712-P729 HydrophobicContact CG-CG 4.43Å; P729-Y737 HydrophobicContact CB-CD2 3.51Å; P729-Y737 HydrophobicContact CB-CE2 3.95Å; P729-Y737 HydrophobicContact CB-CG 4.05Å; P729-Y737 HydrophobicContact CG-CD2 4.13Å; P729-Y737 HydrophobicContact CG-CE2 4.04Å; P729-I739 HydrophobicContact CG-CG1 4.42Å
730	K	84.3	Confident	81.2	Confident	142 Å²	142	78.8 Å²	78.8	62%	0.617	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.8	135.7	171.3	-67.7	-179.4	-178.8	175.9	0	109.3	Q728 F732 Y737 V738	Q728-K730 PolarHBondContact O-N 2.76Å; K730-F732 PolarHBondContact O-N 3.18Å; K730-Y737 CarbonylContact O-C 3.52Å; K730-Y737 VanDerWaalsContact O-CA 3.24Å; K730-Y737 WeakPolarHBondContact O-CA 3.22Å; K730-Y737 WeakPolarHBondContact O-CB 3.44Å; K730-V738 HydrophobicContact CB-CG1 4.32Å; K730-V738 PolarHBondContact N-O 2.82Å; K730-V738 PolarHBondContact O-N 2.86Å
731	E	86	Confident	82.6	Confident	151 Å²	151	74.6 Å²	74.6	71%	0.706	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.6	122.3	175.8	-165.9	178.4	169.7	0	0	110.3
732	F	83.1	Confident	83.7	Confident	123 Å²	123	71.9 Å²	71.9	54%	0.539	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-42.4	179.7	-177.9	-108	0	0	0	110.6	I705 K730 S736 V738	I705-F732 HydrophobicContact CD1-CE1 4.22Å; I705-F732 HydrophobicContact CD1-CZ 4.39Å; I705-F732 HydrophobicContact CG2-CD1 4.32Å; K730-F732 PolarHBondContact O-N 3.18Å; F732-S736 PolarHBondContact N-O 3.02Å; F732-V738 HydrophobicContact CB-CB 4.15Å; F732-V738 HydrophobicContact CB-CG1 4.19Å; F732-V738 HydrophobicContact CD2-CB 4.3Å; F732-V738 HydrophobicContact CD2-CG1 4.2Å; F732-V738 HydrophobicContact CG-CB 4.47Å
733	N	84.7	Confident	84.7	Confident	67 Å²	67	67.8 Å²	67.8	36%	0.358	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	-179.8	169	63.3	31.3	0	0	0	109.4	T735 S736	N733-T735 PolarHBondContact O-N 3.11Å; N733-T735 WeakPolarHBondContact OD1-CA 3.49Å; N733-T735 PolarHBondContact OD1-N 3.06Å; N733-T735 PolarHBondContact OD1-OG1 2.82Å; N733-S736 PolarHBondContact N-O 2.94Å; N733-S736 VanDerWaalsContact N-O 3.15Å; N733-S736 PolarHBondContact ND2-OG 2.95Å; N733-S736 VanDerWaalsContact ND2-OG 3.15Å; N733-S736 PolarHBondContact O-N 2.85Å; N733-S736 WeakPolarHBondContact OD1-CB 3.5Å; N733-S736 PolarHBondContact OD1-N 3.22Å; N733-S736 PolarHBondContact OD1-OG 2.87Å
734	E	79.3	Confident	85.2	Confident	179 Å²	179	62.3 Å²	62.3	84%	0.836	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-13	-178.2	-62.9	-177.7	173.1	0	0	114.8	I708	I708-E734 WeakPolarHBondContact CD1-O 3.24Å
735	T	83	Confident	84.8	Confident	97 Å²	97	63.9 Å²	63.9	60%	0.595	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.2	-8.8	-174.6	56.8	0	0	0	0	114.4	P707 I708 N733	P707-T735 WeakPolarHBondContact CA-O 3.42Å; I708-T735 PolarHBondContact N-O 2.99Å; N733-T735 PolarHBondContact O-N 3.11Å; N733-T735 WeakPolarHBondContact OD1-CA 3.49Å; N733-T735 PolarHBondContact OD1-N 3.06Å; N733-T735 PolarHBondContact OD1-OG1 2.82Å
736	S	87.7	Confident	84.4	Confident	11 Å²	11	60.8 Å²	60.8	8%	0.077	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	151.8	-172.5	63.6	0	0	0	0	112.8	A706 F732 N733	A706-S736 CarbonylContact O-C 3.58Å; A706-S736 WeakPolarHBondContact O-CA 3.21Å; A706-S736 VanDerWaalsContact O-CB 3.23Å; A706-S736 WeakPolarHBondContact O-CB 3.41Å; F732-S736 PolarHBondContact N-O 3.02Å; N733-S736 PolarHBondContact N-O 2.94Å; N733-S736 VanDerWaalsContact N-O 3.15Å; N733-S736 PolarHBondContact ND2-OG 2.95Å; N733-S736 VanDerWaalsContact ND2-OG 3.15Å; N733-S736 PolarHBondContact O-N 2.85Å; N733-S736 WeakPolarHBondContact OD1-CB 3.5Å; N733-S736 PolarHBondContact OD1-N 3.22Å; N733-S736 PolarHBondContact OD1-OG 2.87Å
737	Y	89.7	Confident	84.4	Confident	18 Å²	18	59.6 Å²	59.6	7%	0.071	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	158.4	172.6	69	-92.9	0	0	0	110.5	I705 A706 P707 L710 P729 K730 I739	I705-Y737 WeakPolarHBondContact CA-O 3.09Å; A706-Y737 HydrophobicContact CB-CD1 4.48Å; A706-Y737 HydrophobicContact CB-CE1 3.8Å; A706-Y737 HydrophobicContact CB-CE2 3.98Å; A706-Y737 PolarHBondContact N-O 2.97Å; A706-Y737 WeakPolarHBondContact O-CD1 3.3Å; A706-Y737 PolarHBondContact O-N 2.8Å; P707-Y737 WeakPolarHBondContact O-CE1 2.94Å; L710-Y737 WeakPolarHBondContact O-CE1 3.22Å; L710-Y737 PolarHBondContact O-OH 3.03Å; P729-Y737 HydrophobicContact CB-CD2 3.51Å; P729-Y737 HydrophobicContact CB-CE2 3.95Å; P729-Y737 HydrophobicContact CB-CG 4.05Å; P729-Y737 HydrophobicContact CG-CD2 4.13Å; P729-Y737 HydrophobicContact CG-CE2 4.04Å; K730-Y737 CarbonylContact O-C 3.52Å; K730-Y737 VanDerWaalsContact O-CA 3.24Å; K730-Y737 WeakPolarHBondContact O-CA 3.22Å; K730-Y737 WeakPolarHBondContact O-CB 3.44Å; Y737-I739 HydrophobicContact CD2-CG1 4.15Å; Y737-I739 HydrophobicContact CE2-CD1 3.79Å; Y737-I739 HydrophobicContact CE2-CG1 3.81Å
738	V	92.6	Very high	84.2	Confident	27 Å²	27	59.5 Å²	59.5	16%	0.164	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	135.6	177.4	64.9	0	0	0	0	111.2	F703 V704 I705 K730 F732	F703-V738 HydrophobicContact CB-CG2 4.4Å; F703-V738 HydrophobicContact CD1-CG2 4.04Å; V704-V738 CarbonylContact O-C 3.59Å; V704-V738 VanDerWaalsContact O-CA 3.27Å; V704-V738 WeakPolarHBondContact O-CA 3.42Å; I705-V738 HydrophobicContact CG1-CG2 4.43Å; K730-V738 HydrophobicContact CB-CG1 4.32Å; K730-V738 PolarHBondContact N-O 2.82Å; K730-V738 PolarHBondContact O-N 2.86Å; F732-V738 HydrophobicContact CB-CB 4.15Å; F732-V738 HydrophobicContact CB-CG1 4.19Å; F732-V738 HydrophobicContact CD2-CB 4.3Å; F732-V738 HydrophobicContact CD2-CG1 4.2Å; F732-V738 HydrophobicContact CG-CB 4.47Å
739	I	91.2	Very high	84.3	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	130.6	166.9	-58.6	158.7	0	0	0	107.5	F703 V704 Y712 C726 P729 Y737 F759	F703-I739 VanDerWaalsContact CA-O 3.28Å; F703-I739 WeakPolarHBondContact CA-O 3.45Å; V704-I739 HydrophobicContact CB-CB 4.45Å; V704-I739 PolarHBondContact N-O 3.16Å; V704-I739 PolarHBondContact O-N 3.13Å; Y712-I739 HydrophobicContact CD1-CD1 3.87Å; Y712-I739 HydrophobicContact CD1-CG1 4.25Å; Y712-I739 HydrophobicContact CD2-CD1 3.44Å; Y712-I739 VanDerWaalsContact CD2-CD1 3.44Å; Y712-I739 HydrophobicContact CE1-CD1 4.26Å; Y712-I739 HydrophobicContact CE1-CG2 4.35Å; Y712-I739 HydrophobicContact CE2-CD1 3.88Å; Y712-I739 HydrophobicContact CG-CD1 3.41Å; Y712-I739 VanDerWaalsContact CG-CD1 3.41Å; Y712-I739 HydrophobicContact CG-CG1 4.26Å; C726-I739 HydrophobicContact CB-CG2 4.07Å; P729-I739 HydrophobicContact CG-CG1 4.42Å; Y737-I739 HydrophobicContact CD2-CG1 4.15Å; Y737-I739 HydrophobicContact CE2-CD1 3.79Å; Y737-I739 HydrophobicContact CE2-CG1 3.81Å; I739-F759 HydrophobicContact CD1-CE1 4.12Å; I739-F759 HydrophobicContact CD1-CZ 4.31Å
740	S	89.7	Confident	84.2	Confident	34 Å²	34	60.5 Å²	60.5	24%	0.238	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	122.8	175.1	178.4	0	0	0	0	109.8	F703 C726 S727	F703-S740 WeakPolarHBondContact CE1-OG 3.41Å; C726-S740 CarbonylContact C-O 3.49Å; C726-S740 WeakPolarHBondContact CA-O 3.34Å; S727-S740 PolarHBondContact N-O 3.09Å; S727-S740 PolarHBondContact OG-N 3.24Å; S727-S740 VanDerWaalsContact OG-N 3.12Å; S727-S740 PolarHBondContact OG-O 2.85Å
741	C	89.1	Confident	84.4	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	129.9	177.4	-56.5	0	0	0	0	111.1	Q701 F702 I724 T725 C726	Q701-C741 CarbonylContact C-O 3.58Å; Q701-C741 WeakPolarHBondContact CA-O 3.31Å; F702-C741 HydrophobicContact CB-CB 4.35Å; F702-C741 HydrophobicContact CD1-CB 3.93Å; F702-C741 PolarHBondContact N-O 3.3Å; F702-C741 PolarHBondContact O-N 2.8Å; I724-C741 HydrophobicContact CG2-CB 4.37Å; T725-C741 CarbonylContact O-C 3.55Å; T725-C741 VanDerWaalsContact O-CA 3.3Å; T725-C741 WeakPolarHBondContact O-CA 3.42Å; C726-C741 HydrophobicContact CB-CB 4.08Å; C726-C741 WeakPolarHBondContact CB-SG 3.1Å; C726-C741 WeakPolarHBondContact SG-CB 3.19Å; C726-C741 CovalentContact SG-SG 2.04Å; C726-C741 PolarHBondContact SG-SG 3.01Å
742	D	84.5	Confident	84.5	Confident	68 Å²	68	49.4 Å²	49.4	36%	0.364	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	117.4	167.8	-175.2	-10.7	0	0	0	109	I724 T725 G744	I724-D742 WeakPolarHBondContact CA-O 3.49Å; T725-D742 PolarHBondContact N-O 3.39Å; T725-D742 PolarHBondContact O-N 3.19Å; D742-G744 PolarHBondContact OD1-N 2.8Å
743	I	85.7	Confident	84.8	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.015	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	-5	-178.7	57.8	168.4	0	0	0	112.7	I690 A700 F702 I724 L747 F755 T777	I690-I743 HydrophobicContact CD1-CD1 3.72Å; I690-I743 HydrophobicContact CD1-CG2 4.37Å; I690-I743 HydrophobicContact CG2-CD1 3.98Å; A700-I743 HydrophobicContact CB-CD1 3.99Å; A700-I743 HydrophobicContact CB-CG1 3.72Å; A700-I743 WeakPolarHBondContact O-CG1 2.81Å; A700-I743 PolarHBondContact O-N 3.1Å; A700-I743 VanDerWaalsContact O-N 3.08Å; F702-I743 HydrophobicContact CB-CD1 4.38Å; F702-I743 HydrophobicContact CB-CG2 3.87Å; I724-I743 HydrophobicContact CG2-CG2 4.44Å; I743-L747 HydrophobicContact CD1-CD2 4.33Å; I743-F755 HydrophobicContact CG2-CE1 4.18Å; I743-F755 HydrophobicContact CG2-CZ 4.5Å; I743-T777 WeakPolarHBondContact CD1-OG1 3.2Å
744	G	75.4	Confident	85.1	Confident	12 Å²	12	46 Å²	46	12%	0.124	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	153.4	142.1	172	0	0	0	0	0	114.4	A700 D742 P746 L747	A700-G744 WeakPolarHBondContact CB-O 3.33Å; A700-G744 PolarHBondContact N-O 2.65Å; A700-G744 PolarHBondContact O-N 3.35Å; D742-G744 PolarHBondContact OD1-N 2.8Å; G744-P746 VanDerWaalsContact C-C 3.41Å; G744-L747 PolarHBondContact O-N 3.06Å
745	N	70.7	Confident	85.7	Confident	35 Å²	35	37.5 Å²	37.5	19%	0.187	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-139.2	78.2	175	-170.3	8.9	0	0	0	113.2	K653 E699	K653-N745 PolarHBondContact NZ-ND2 3.11Å; K653-N745 PolarHBondContact NZ-O 2.86Å; K653-N745 PolarHBondContact NZ-OD1 3Å; E699-N745 WeakPolarHBondContact CG-ND2 3.42Å; E699-N745 PolarHBondContact N-OD1 2.86Å
746	P	72.4	Confident	86.1	Confident	21 Å²	21	33.8 Å²	33.8	14%	0.136	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	cis	-83.3	157.1	4.4	29.3	-29.6	0	0	0	113.7	D696 A697 F698 G744 P748	D696-P746 HydrophobicContact CB-CB 3.71Å; D696-P746 HydrophobicContact CB-CG 4.15Å; D696-P746 WeakPolarHBondContact OD2-CG 3.48Å; A697-P746 CarbonylContact O-C 3.55Å; A697-P746 WeakPolarHBondContact O-CA 3.23Å; F698-P746 HydrophobicContact CD1-CB 3.51Å; F698-P746 HydrophobicContact CD1-CG 4.01Å; F698-P746 HydrophobicContact CE1-CB 3.43Å; F698-P746 VanDerWaalsContact CE1-CB 3.43Å; F698-P746 HydrophobicContact CE1-CG 3.53Å; F698-P746 HydrophobicContact CG-CB 4.41Å; F698-P746 HydrophobicContact CZ-CB 4.3Å; F698-P746 HydrophobicContact CZ-CG 4.45Å; G744-P746 VanDerWaalsContact C-C 3.41Å; P746-P748 VanDerWaalsContact O-CD 3.29Å; P746-P748 WeakPolarHBondContact O-CD 3.34Å
747	L	85	Confident	86.3	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-77.8	107.2	150.8	176.4	60.4	0	0	0	107.8	L665 I690 N692 A697 A700 I743 G744 T751 V753	L665-L747 HydrophobicContact CD2-CD2 3.78Å; I690-L747 HydrophobicContact CG2-CD2 4.44Å; N692-L747 HydrophobicContact CB-CD2 3.89Å; N692-L747 HydrophobicContact CB-CG 3.94Å; N692-L747 PolarHBondContact ND2-O 3.24Å; A697-L747 HydrophobicContact CB-CB 4.28Å; A697-L747 PolarHBondContact N-O 2.99Å; A697-L747 PolarHBondContact O-N 3.42Å; A700-L747 HydrophobicContact CB-CB 3.7Å; A700-L747 HydrophobicContact CB-CD2 4.28Å; I743-L747 HydrophobicContact CD1-CD2 4.33Å; G744-L747 PolarHBondContact O-N 3.06Å; L747-T751 HydrophobicContact CD1-CG2 3.69Å; L747-V753 HydrophobicContact CD1-CG2 3.47Å; L747-V753 VanDerWaalsContact CD1-CG2 3.47Å
748	P	82.9	Confident	86.4	Confident	35 Å²	35	35 Å²	35	23%	0.227	18%	0.184	C	C	.	.			trans	-67.4	157.8	-170	-20.1	33.6	0	0	0	113	D696 P746 T751	D696-P748 WeakPolarHBondContact OD1-CA 3.26Å; P746-P748 VanDerWaalsContact O-CD 3.29Å; P746-P748 WeakPolarHBondContact O-CD 3.34Å; P748-T751 WeakPolarHBondContact O-CB 3.47Å; P748-T751 PolarHBondContact O-N 2.66Å; P748-T751 PolarHBondContact O-OG1 2.79Å
749	R	85.8	Confident	86.3	Confident	181 Å²	181	33.7 Å²	33.7	68%	0.683	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-39.5	139.5	165.8	159	167.5	168.7	-178.8	-2	113	L694 D696 T751	L694-R749 WeakPolarHBondContact O-CA 3.34Å; L694-R749 WeakPolarHBondContact O-CB 3.19Å; L694-R749 WeakPolarHBondContact O-CD 3.14Å; L694-R749 WeakPolarHBondContact O-CG 3.24Å; D696-R749 PolarHBondContact OD1-N 3.01Å; R749-T751 PolarHBondContact O-N 3.28Å; R749-T751 VanDerWaalsContact O-N 3.12Å; R749-T751 PolarHBondContact O-OG1 3.38Å
750	A	86	Confident	86.1	Confident	66 Å²	66	33.8 Å²	33.8	55%	0.545	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	26.3	174.9	0	0	0	0	0	114.6	N692	N692-A750 WeakPolarHBondContact O-CA 3.49Å; N692-A750 PolarHBondContact O-N 3.42Å
751	T	87	Confident	85.7	Confident	17 Å²	17	32.5 Å²	32.5	10%	0.104	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	142.8	-177.9	-62.5	0	0	0	0	111.2	H691 N692 R722 L747 P748 R749	H691-T751 WeakPolarHBondContact CA-O 3.33Å; N692-T751 PolarHBondContact N-O 3.45Å; N692-T751 PolarHBondContact O-N 2.64Å; R722-T751 VanDerWaalsContact NE-CG2 3.26Å; R722-T751 PolarHBondContact NH2-OG1 3.24Å; L747-T751 HydrophobicContact CD1-CG2 3.69Å; P748-T751 WeakPolarHBondContact O-CB 3.47Å; P748-T751 PolarHBondContact O-N 2.66Å; P748-T751 PolarHBondContact O-OG1 2.79Å; R749-T751 PolarHBondContact O-N 3.28Å; R749-T751 VanDerWaalsContact O-N 3.12Å; R749-T751 PolarHBondContact O-OG1 3.38Å
752	T	89.7	Confident	85.1	Confident	43 Å²	43	37.2 Å²	37.2	26%	0.264	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	137.3	170.2	-46.1	0	0	0	0	110.8	T689 I690 H691 R754	T689-T752 HydrophobicContact CG2-CG2 3.48Å; T689-T752 VanDerWaalsContact CG2-CG2 3.48Å; I690-T752 CarbonylContact O-C 3.58Å; I690-T752 VanDerWaalsContact O-CA 3.31Å; I690-T752 WeakPolarHBondContact O-CA 3.32Å; I690-T752 WeakPolarHBondContact O-CG2 3.35Å; H691-T752 HydrophobicContact CB-CG2 4.41Å; H691-T752 PolarHBondContact ND1-OG1 3.44Å; T752-R754 HydrophobicContact CG2-CG 4.23Å
753	V	89	Confident	84.3	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.012	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	130.8	174.2	-179	0	0	0	0	108.4	T689 I690 I724 L747 F755	T689-V753 WeakPolarHBondContact CA-O 3.38Å; I690-V753 PolarHBondContact N-O 3.38Å; I690-V753 PolarHBondContact O-N 2.82Å; I724-V753 HydrophobicContact CD1-CG1 3.34Å; I724-V753 HydrophobicContact CG1-CG1 3.82Å; L747-V753 HydrophobicContact CD1-CG2 3.47Å; L747-V753 VanDerWaalsContact CD1-CG2 3.47Å; V753-F755 HydrophobicContact CG1-CD1 4.06Å; V753-F755 HydrophobicContact CG1-CE1 4.35Å
754	R	91	Very high	83.5	Confident	118 Å²	118	39 Å²	39	45%	0.445	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129.4	-179.8	-64.1	-176.5	-178.9	170.2	0.1	111	I688 T689 Q718 T752	I688-R754 WeakPolarHBondContact O-CA 3.47Å; T689-R754 HydrophobicContact CG2-CG 4Å; Q718-R754 HydrophobicContact CB-CB 3.83Å; Q718-R754 PolarHBondContact N-O 2.92Å; Q718-R754 VanDerWaalsContact N-O 3.12Å; T752-R754 HydrophobicContact CG2-CG 4.23Å
755	F	90.9	Very high	82.8	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	157.7	177.7	58.9	-78.4	0	0	0	110.3	I688 I690 F702 T716 I724 I743 V753 L757	I688-F755 HydrophobicContact CB-CD1 4.33Å; I688-F755 HydrophobicContact CB-CD2 4.38Å; I688-F755 HydrophobicContact CB-CE1 3.95Å; I688-F755 HydrophobicContact CB-CE2 3.98Å; I688-F755 HydrophobicContact CB-CZ 3.76Å; I688-F755 HydrophobicContact CD1-CD2 4.4Å; I688-F755 HydrophobicContact CD1-CE2 4.1Å; I688-F755 HydrophobicContact CG1-CE2 4.06Å; I688-F755 HydrophobicContact CG1-CZ 4.14Å; I688-F755 HydrophobicContact CG2-CD1 4.47Å; I688-F755 HydrophobicContact CG2-CE1 3.7Å; I688-F755 HydrophobicContact CG2-CE2 4.33Å; I688-F755 HydrophobicContact CG2-CZ 3.62Å; I688-F755 PolarHBondContact N-O 3.35Å; I688-F755 PolarHBondContact O-N 3.39Å; I688-F755 VanDerWaalsContact O-N 3.13Å; I690-F755 HydrophobicContact CD1-CE1 4.12Å; I690-F755 HydrophobicContact CD1-CZ 4.37Å; F702-F755 AromaticContact CD1-CE2 3.9Å; F702-F755 HydrophobicContact CD1-CE2 3.9Å; F702-F755 AromaticContact CD1-CZ 3.53Å; F702-F755 HydrophobicContact CD1-CZ 3.53Å; F702-F755 HydrophobicContact CD2-CZ 4.4Å; F702-F755 AromaticContact CE1-CE2 3.69Å; F702-F755 HydrophobicContact CE1-CE2 3.69Å; F702-F755 AromaticContact CE1-CZ 3.67Å; F702-F755 HydrophobicContact CE1-CZ 3.67Å; F702-F755 AromaticContact CG-CZ 3.89Å; F702-F755 HydrophobicContact CG-CZ 3.89Å; F702-F755 HydrophobicContact CZ-CE2 4.32Å; F702-F755 HydrophobicContact CZ-CZ 4.16Å; T716-F755 CarbonylContact O-C 3.57Å; T716-F755 WeakPolarHBondContact O-CA 3.34Å; T716-F755 WeakPolarHBondContact O-CB 3.29Å; I724-F755 HydrophobicContact CD1-CB 3.67Å; I724-F755 HydrophobicContact CD1-CD1 3.49Å; I724-F755 VanDerWaalsContact CD1-CD1 3.49Å; I724-F755 HydrophobicContact CD1-CE1 4.32Å; I724-F755 HydrophobicContact CD1-CG 3.77Å; I743-F755 HydrophobicContact CG2-CE1 4.18Å; I743-F755 HydrophobicContact CG2-CZ 4.5Å; V753-F755 HydrophobicContact CG1-CD1 4.06Å; V753-F755 HydrophobicContact CG1-CE1 4.35Å; F755-L757 HydrophobicContact CD2-CD2 4.01Å; F755-L757 HydrophobicContact CD2-CG 4.26Å; F755-L757 HydrophobicContact CE2-CD2 3.85Å; F755-L757 HydrophobicContact CE2-CG 4.04Å
756	N	91.2	Very high	82.1	Confident	19 Å²	19	47.3 Å²	47.3	10%	0.102	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	136.2	170.8	-51.7	-42.5	0	0	0	109.8	N685 V686 S687 F715 T716 Q718	N685-N756 HydrophobicContact CB-CB 4.31Å; V686-N756 CarbonylContact O-C 3.54Å; V686-N756 WeakPolarHBondContact O-CA 3.28Å; S687-N756 VanDerWaalsContact CA-OD1 3.3Å; S687-N756 WeakPolarHBondContact CA-OD1 3.4Å; S687-N756 VanDerWaalsContact CB-OD1 3.31Å; S687-N756 WeakPolarHBondContact CB-OD1 3.41Å; S687-N756 PolarHBondContact OG-OD1 2.71Å; F715-N756 CarbonylContact C-O 3.59Å; F715-N756 WeakPolarHBondContact CA-O 3.36Å; F715-N756 WeakPolarHBondContact CB-O 3.42Å; T716-N756 PolarHBondContact N-O 2.92Å; T716-N756 PolarHBondContact O-N 2.82Å; T716-N756 WeakPolarHBondContact OG1-CB 3.41Å; Q718-N756 PolarHBondContact NE2-ND2 2.83Å; Q718-N756 PolarHBondContact NE2-OD1 3.4Å
757	L	91.8	Very high	81.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	138.3	165.6	-59.7	173.4	0	0	0	108.9	N685 V686 I688 F702 V704 Y712 F715 F755 F759	N685-L757 CarbonylContact C-O 3.6Å; N685-L757 WeakPolarHBondContact CA-O 3.44Å; V686-L757 PolarHBondContact N-O 3.28Å; V686-L757 PolarHBondContact O-N 3.35Å; I688-L757 HydrophobicContact CD1-CB 4.32Å; I688-L757 HydrophobicContact CD1-CD1 3.8Å; I688-L757 HydrophobicContact CD1-CG 3.71Å; F702-L757 HydrophobicContact CE1-CD1 3.78Å; F702-L757 HydrophobicContact CZ-CD1 4.01Å; V704-L757 HydrophobicContact CG2-CD1 3.45Å; V704-L757 VanDerWaalsContact CG2-CD1 3.45Å; Y712-L757 HydrophobicContact CE2-CD2 4.02Å; F715-L757 HydrophobicContact CB-CD2 3.91Å; F755-L757 HydrophobicContact CD2-CD2 4.01Å; F755-L757 HydrophobicContact CD2-CG 4.26Å; F755-L757 HydrophobicContact CE2-CD2 3.85Å; F755-L757 HydrophobicContact CE2-CG 4.04Å; L757-F759 HydrophobicContact CB-CD2 4.29Å; L757-F759 HydrophobicContact CB-CE2 3.58Å; L757-F759 HydrophobicContact CB-CZ 4.19Å; L757-F759 HydrophobicContact CD1-CE2 4.12Å; L757-F759 HydrophobicContact CD1-CZ 4.18Å
758	Q	92	Very high	80	Confident	53 Å²	53	54 Å²	54	25%	0.248	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	128.6	179.2	-174.2	172.9	-10.5	0	0	109.7	N685 E713 G714	N685-Q758 WeakPolarHBondContact OD1-CB 3.11Å; N685-Q758 WeakPolarHBondContact OD1-CG 3.33Å; E713-Q758 HydrophobicContact CB-CB 4.42Å; E713-Q758 HydrophobicContact CB-CG 4.11Å; E713-Q758 PolarHBondContact N-O 2.93Å; E713-Q758 PolarHBondContact OE2-NE2 3.48Å; G714-Q758 PolarHBondContact O-N 3.13Å
759	F	91.1	Very high	78.9	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	151.4	178.5	-64.4	-88.9	0	0	0	111	R683 F684 V686 V704 L710 D711 Y712 I739 L757 L773	R683-F759 WeakPolarHBondContact CA-O 3.4Å; F684-F759 HydrophobicContact CD1-CB 4.24Å; F684-F759 HydrophobicContact CD2-CB 4.35Å; F684-F759 HydrophobicContact CD2-CD2 4.43Å; F684-F759 HydrophobicContact CE1-CB 3.66Å; F684-F759 HydrophobicContact CE2-CB 3.78Å; F684-F759 AromaticContact CE2-CD2 3.77Å; F684-F759 HydrophobicContact CE2-CD2 3.77Å; F684-F759 HydrophobicContact CE2-CG 4.06Å; F684-F759 HydrophobicContact CZ-CB 3.42Å; F684-F759 VanDerWaalsContact CZ-CB 3.42Å; F684-F759 HydrophobicContact CZ-CD2 4.16Å; F684-F759 AromaticContact CZ-CG 3.97Å; F684-F759 HydrophobicContact CZ-CG 3.97Å; F684-F759 PolarHBondContact N-O 3.06Å; F684-F759 VanDerWaalsContact N-O 3.08Å; F684-F759 PolarHBondContact O-N 3.18Å; V686-F759 HydrophobicContact CG2-CD2 4.2Å; V686-F759 HydrophobicContact CG2-CE2 4.07Å; V704-F759 HydrophobicContact CG1-CZ 4.21Å; L710-F759 HydrophobicContact CD1-CB 4.12Å; L710-F759 HydrophobicContact CD2-CB 4.31Å; L710-F759 HydrophobicContact CD2-CD1 3.71Å; L710-F759 HydrophobicContact CD2-CE1 4.24Å; L710-F759 HydrophobicContact CD2-CG 4.1Å; L710-F759 HydrophobicContact CG-CB 4.21Å; L710-F759 HydrophobicContact CG-CD1 3.95Å; L710-F759 HydrophobicContact CG-CG 4.39Å; D711-F759 CarbonylContact O-C 3.57Å; D711-F759 WeakPolarHBondContact O-CA 3.48Å; Y712-F759 HydrophobicContact CD2-CD1 4.49Å; Y712-F759 HydrophobicContact CD2-CE1 4.13Å; Y712-F759 HydrophobicContact CD2-CZ 4.4Å; I739-F759 HydrophobicContact CD1-CE1 4.12Å; I739-F759 HydrophobicContact CD1-CZ 4.31Å; L757-F759 HydrophobicContact CB-CD2 4.29Å; L757-F759 HydrophobicContact CB-CE2 3.58Å; L757-F759 HydrophobicContact CB-CZ 4.19Å; L757-F759 HydrophobicContact CD1-CE2 4.12Å; L757-F759 HydrophobicContact CD1-CZ 4.18Å; F759-L773 HydrophobicContact CE2-CD1 4.14Å; F759-L773 HydrophobicContact CZ-CD1 4.48Å; F759-L773 HydrophobicContact CZ-CD2 4.49Å
760	S	88	Confident	78.1	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.014	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	146	175.3	179.7	0	0	0	0	110.7	D682 L710 D711 E762	D682-S760 WeakPolarHBondContact O-CA 3.44Å; L710-S760 WeakPolarHBondContact CD1-O 3.37Å; D711-S760 PolarHBondContact N-O 2.86Å; D711-S760 PolarHBondContact O-N 2.71Å; S760-E762 PolarHBondContact OG-N 3.37Å
761	T	81.4	Confident	77.7	Confident	7 Å²	7	46.2 Å²	46.2	4%	0.043	27%	0.268	C	S	.	.			trans	-103.2	13.8	180	57.9	0	0	0	0	114.8	I676 A680 D682 F684 L710 N763 V764	I676-T761 HydrophobicContact CD1-CG2 4Å; I676-T761 HydrophobicContact CG2-CG2 3.75Å; A680-T761 PolarHBondContact O-OG1 3.38Å; D682-T761 WeakPolarHBondContact CB-OG1 3.33Å; D682-T761 PolarHBondContact N-OG1 2.88Å; D682-T761 VanDerWaalsContact N-OG1 3.14Å; D682-T761 PolarHBondContact O-N 2.81Å; D682-T761 PolarHBondContact O-OG1 2.91Å; F684-T761 HydrophobicContact CD1-CG2 4.45Å; F684-T761 HydrophobicContact CE1-CG2 3.99Å; L710-T761 HydrophobicContact CD1-CG2 3.88Å; T761-N763 VanDerWaalsContact C-N 3.32Å; T761-N763 PolarHBondContact O-N 3.16Å; T761-V764 HydrophobicContact CG2-CG2 4.19Å; T761-V764 WeakPolarHBondContact O-CB 3.39Å; T761-V764 PolarHBondContact O-N 3.26Å; T761-V764 VanDerWaalsContact O-N 3.13Å
762	E	74.9	Confident	77.6	Confident	100 Å²	100	47.3 Å²	47.3	47%	0.467	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-43	-177	-174.5	169.3	-172.6	0	0	113.2	S760	S760-E762 PolarHBondContact OG-N 3.37Å
763	N	68.7	Low	77.7	Confident	99 Å²	99	45.3 Å²	45.3	53%	0.529	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	15.6	-179.5	-71	-50.5	0	0	0	114.4	G709 D711 T761 D765	G709-N763 WeakPolarHBondContact CA-O 3.42Å; G709-N763 CarbonylContact O-C 3.54Å; D711-N763 PolarHBondContact OD2-ND2 2.84Å; T761-N763 VanDerWaalsContact C-N 3.32Å; T761-N763 PolarHBondContact O-N 3.16Å; N763-D765 PolarHBondContact O-N 3.2Å
764	V	69.1	Low	77.9	Confident	10 Å²	10	48.4 Å²	48.4	6%	0.061	28%	0.278	C	S	.	.			trans	-82.1	65.3	178.8	-174.2	0	0	0	0	109.8	G709 L710 T761 I767 I771	G709-V764 WeakPolarHBondContact O-CG2 3.49Å; G709-V764 PolarHBondContact O-N 3.39Å; L710-V764 HydrophobicContact CB-CG2 4.45Å; L710-V764 HydrophobicContact CD1-CG2 4.38Å; T761-V764 HydrophobicContact CG2-CG2 4.19Å; T761-V764 WeakPolarHBondContact O-CB 3.39Å; T761-V764 PolarHBondContact O-N 3.26Å; T761-V764 VanDerWaalsContact O-N 3.13Å; V764-I767 HydrophobicContact CG1-CB 4.29Å; V764-I767 HydrophobicContact CG1-CD1 3.77Å; V764-I767 HydrophobicContact CG1-CG1 3.9Å; V764-I771 HydrophobicContact CG1-CD1 4.11Å; V764-I771 HydrophobicContact CG2-CD1 4.49Å
765	D	60.5	Low	78.1	Confident	119 Å²	119	42.8 Å²	42.8	64%	0.636	26%	0.257	S	S	*	.			trans	-93.7	104.1	174.1	-83.9	-15.6	0	0	0	109.5	N763	N763-D765 PolarHBondContact O-N 3.2Å
766	N	56.6	Low	78.2	Confident	101 Å²	101	45.2 Å²	45.2	54%	0.54	27%	0.269	S	S	.	.			trans	77	39.4	173.6	-53.3	-43.7	0	0	0	118.3	V768	N766-V768 VanDerWaalsContact C-N 3.34Å; N766-V768 PolarHBondContact O-N 3.31Å
767	I	57.2	Low	78.3	Confident	31 Å²	31	44.4 Å²	44.4	16%	0.159	27%	0.265	C	S	.	.			trans	-73	92.5	165.1	-57.3	-176.1	0	0	0	109.6	P707 V764 G769 I771	P707-I767 HydrophobicContact CB-CD1 4.16Å; P707-I767 HydrophobicContact CG-CD1 4.13Å; V764-I767 HydrophobicContact CG1-CB 4.29Å; V764-I767 HydrophobicContact CG1-CD1 3.77Å; V764-I767 HydrophobicContact CG1-CG1 3.9Å; I767-G769 PolarHBondContact O-N 3.14Å; I767-I771 HydrophobicContact CD1-CG1 4.46Å
768	V	54.3	Low	78.2	Confident	131 Å²	131	47.6 Å²	47.6	79%	0.794	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	86.8	175.9	-173.3	0	0	0	0	109	N766	N766-V768 VanDerWaalsContact C-N 3.34Å; N766-V768 PolarHBondContact O-N 3.31Å
769	G	59.9	Low	78	Confident	78 Å²	78	46.3 Å²	46.3	80%	0.804	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	153.9	-3.1	172.9	0	0	0	0	0	117.9	I767	I767-G769 PolarHBondContact O-N 3.14Å
770	G	68.8	Low	77.6	Confident	37 Å²	37	50.5 Å²	50.5	38%	0.381	30%	0.304	S	S	.	.			trans	93.8	161.7	-171.3	0	0	0	0	0	111.9
771	I	77.9	Confident	77.4	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.015	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	118.1	178.3	-56.7	171.4	0	0	0	107.5	P707 L710 V764 I767 I797 M799	P707-I771 HydrophobicContact CG-CG2 3.98Å; L710-I771 HydrophobicContact CD2-CG2 4.02Å; V764-I771 HydrophobicContact CG1-CD1 4.11Å; V764-I771 HydrophobicContact CG2-CD1 4.49Å; I767-I771 HydrophobicContact CD1-CG1 4.46Å; I771-I797 HydrophobicContact CB-CB 4.24Å; I771-I797 HydrophobicContact CB-CD1 4.25Å; I771-I797 HydrophobicContact CB-CG1 4.45Å; I771-I797 HydrophobicContact CG2-CD1 3.68Å; I771-I797 HydrophobicContact CG2-CG1 4.29Å; I771-I797 WeakPolarHBondContact O-CB 3.27Å; I771-I797 PolarHBondContact O-N 2.74Å; I771-M799 HydrophobicContact CD1-CE 4.14Å; I771-M799 HydrophobicContact CD1-SD 4.37Å; I771-M799 HydrophobicContact CG1-CE 4.32Å; I771-M799 HydrophobicContact CG1-SD 4.08Å
772	S	86.4	Confident	77.4	Confident	41 Å²	41	58.4 Å²	58.4	29%	0.287	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	138.9	172.5	63	0	0	0	0	110.6	I795 D796	S772-I795 WeakPolarHBondContact CA-O 3.35Å; S772-D796 WeakPolarHBondContact CB-OD1 3.42Å
773	L	91	Very high	77.9	Confident	0 Å²	0	55 Å²	55	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	120.4	173.6	-63.7	176.9	0	0	0	109	F684 V686 V704 A706 L710 F759 T794 I795 I797	F684-L773 HydrophobicContact CE2-CD1 4.28Å; V686-L773 HydrophobicContact CG2-CD1 3.74Å; V704-L773 HydrophobicContact CG1-CD2 4.32Å; A706-L773 HydrophobicContact CB-CD2 3.56Å; L710-L773 HydrophobicContact CD2-CD2 3.77Å; F759-L773 HydrophobicContact CE2-CD1 4.14Å; F759-L773 HydrophobicContact CZ-CD1 4.48Å; F759-L773 HydrophobicContact CZ-CD2 4.49Å; L773-T794 WeakPolarHBondContact O-CA 3.29Å; L773-I795 PolarHBondContact N-O 3.36Å; L773-I795 PolarHBondContact O-N 2.81Å; L773-I797 HydrophobicContact CD1-CD1 3.95Å; L773-I797 HydrophobicContact CG-CD1 4.1Å
774	H	93.4	Very high	78.7	Confident	67 Å²	67	53.3 Å²	53.3	31%	0.31	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	115.8	172.6	-58.5	-77.3	0	0	0	109.3	V704 I705 T794	V704-H774 WeakPolarHBondContact CA-O 3.49Å; I705-H774 HydrophobicContact CB-CB 4.23Å; I705-H774 PolarHBondContact N-O 3.16Å; I705-H774 PolarHBondContact O-N 2.95Å; H774-T794 PolarHBondContact ND1-OG1 3.25Å
775	L	94.5	Very high	79.4	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	128.6	-174.5	-55.2	153.3	0	0	0	107.8	M667 A669 F702 F703 V704 E792 V793 I795	M667-L775 VanDerWaalsContact CE-C 3.42Å; M667-L775 HydrophobicContact CE-CB 3.59Å; M667-L775 WeakPolarHBondContact CE-O 3.5Å; M667-L775 HydrophobicContact SD-CB 4.15Å; A669-L775 HydrophobicContact CB-CD1 3.47Å; A669-L775 VanDerWaalsContact CB-CD1 3.47Å; F702-L775 HydrophobicContact CE2-CB 4.08Å; F702-L775 HydrophobicContact CE2-CD2 4.04Å; F702-L775 HydrophobicContact CZ-CB 4.5Å; F702-L775 HydrophobicContact CZ-CD2 3.61Å; F703-L775 WeakPolarHBondContact O-CA 3.36Å; V704-L775 HydrophobicContact CB-CD2 4.37Å; V704-L775 HydrophobicContact CG1-CD2 3.96Å; V704-L775 HydrophobicContact CG2-CD2 3.7Å; L775-E792 WeakPolarHBondContact O-CA 3.43Å; L775-V793 HydrophobicContact CB-CB 4.5Å; L775-V793 VanDerWaalsContact CB-O 3.29Å; L775-V793 WeakPolarHBondContact CB-O 3.47Å; L775-V793 HydrophobicContact CD1-CB 4.35Å; L775-V793 HydrophobicContact CD1-CG1 4.39Å; L775-V793 PolarHBondContact N-O 3.16Å; L775-V793 PolarHBondContact O-N 3.41Å; L775-I795 HydrophobicContact CD1-CD1 3.76Å; L775-I795 HydrophobicContact CD1-CG1 3.91Å
776	I	94.2	Very high	80.5	Confident	52 Å²	52	55.8 Å²	55.8	27%	0.267	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	133.5	-176.4	-56.5	167.8	0	0	0	109	F702 F703 I705 E792	F702-I776 CarbonylContact C-O 3.54Å; F702-I776 WeakPolarHBondContact CA-O 3.33Å; F703-I776 HydrophobicContact CB-CB 4.44Å; F703-I776 PolarHBondContact N-O 3.31Å; F703-I776 PolarHBondContact O-N 3.4Å; I705-I776 HydrophobicContact CD1-CD1 4.3Å; I776-E792 HydrophobicContact CG1-CG 4.21Å
777	T	92.4	Very high	81.9	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.012	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	141.1	166.8	-164.9	0	0	0	0	111	L665 M667 I690 Q701 I743 N791	L665-T777 HydrophobicContact CB-CG2 4.1Å; L665-T777 HydrophobicContact CD1-CG2 4.45Å; M667-T777 HydrophobicContact CB-CG2 4.15Å; I690-T777 HydrophobicContact CG2-CG2 4.32Å; Q701-T777 WeakPolarHBondContact O-CA 3.3Å; Q701-T777 PolarHBondContact O-OG1 3.27Å; I743-T777 WeakPolarHBondContact CD1-OG1 3.2Å; T777-N791 HydrophobicContact CG2-CB 4.02Å; T777-N791 VanDerWaalsContact CG2-OD1 3.31Å; T777-N791 WeakPolarHBondContact CG2-OD1 3.5Å; T777-N791 PolarHBondContact N-O 2.89Å; T777-N791 WeakPolarHBondContact O-CB 3.33Å
778	N	90	Very high	83.2	Confident	67 Å²	67	55.4 Å²	55.4	36%	0.358	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	174	177.7	68.3	9.2	0	0	0	111.1	A700 Q701 F703	A700-N778 CarbonylContact C-O 3.5Å; A700-N778 WeakPolarHBondContact CA-O 3.2Å; Q701-N778 PolarHBondContact N-O 3.49Å; Q701-N778 PolarHBondContact O-N 3.21Å; F703-N778 WeakPolarHBondContact CE2-OD1 3.47Å
779	S	87.8	Confident	84.7	Confident	26 Å²	26	54 Å²	54	18%	0.182	35%	0.354	C	S	.	.			trans	-144.6	172.2	171.6	74	0	0	0	0	110.3	F698 N781	F698-S779 WeakPolarHBondContact O-CB 3.23Å; S779-N781 PolarHBondContact O-N 2.68Å; S779-N781 PolarHBondContact OG-N 2.87Å; S779-N781 PolarHBondContact OG-O 3.47Å
780	T	82.7	Confident	86.2	Confident	87 Å²	87	53 Å²	53	53%	0.534	33%	0.33	S	S	.	.	S	Bend	trans	-74.8	-11.9	173.5	50.3	0	0	0	0	113.5	F698 E699	F698-T780 PolarHBondContact O-N 3.25Å; F698-T780 PolarHBondContact O-OG1 2.76Å; E699-T780 HydrophobicContact CB-CG2 3.75Å; E699-T780 HydrophobicContact CG-CG2 4.25Å; E699-T780 WeakPolarHBondContact OE2-CG2 3.37Å
781	N	83.9	Confident	87.3	Confident	32 Å²	32	51.8 Å²	51.8	17%	0.171	32%	0.315	C	S	.	.	S	Bend	trans	-85.4	145.6	178	-64.7	104	0	0	0	111.4	C661 P663 F698 S779	C661-N781 WeakPolarHBondContact CB-ND2 3.01Å; C661-N781 WeakPolarHBondContact O-CB 3.37Å; C661-N781 PolarHBondContact O-ND2 3.16Å; P663-N781 HydrophobicContact CG-CB 3.74Å; F698-N781 WeakPolarHBondContact CD2-OD1 3.33Å; F698-N781 PolarHBondContact N-OD1 2.76Å; S779-N781 PolarHBondContact O-N 2.68Å; S779-N781 PolarHBondContact OG-N 2.87Å; S779-N781 PolarHBondContact OG-O 3.47Å
782	N	82	Confident	88	Confident	144 Å²	144	56.9 Å²	56.9	77%	0.77	34%	0.339	S	S	*	.			trans	-73.5	130.7	172.4	-79	-7.7	0	0	0	110.1
783	E	85.6	Confident	88.4	Confident	29 Å²	29	56.7 Å²	56.7	14%	0.136	34%	0.336	C	S	.	.			trans	-106	159.9	174.4	175.4	167.8	-173.1	0	0	110.7	L665 A785 T787 L788 N791	L665-E783 PolarHBondContact N-OE1 3.14Å; E783-A785 PolarHBondContact O-N 3.35Å; E783-T787 VanDerWaalsContact CD-OG1 3.3Å; E783-T787 WeakPolarHBondContact CG-OG1 3.46Å; E783-T787 VanDerWaalsContact OE1-CB 3.32Å; E783-T787 WeakPolarHBondContact OE1-CB 3.19Å; E783-T787 PolarHBondContact OE1-OG1 3.26Å; E783-L788 HydrophobicContact CB-CD2 4.01Å; E783-L788 HydrophobicContact CG-CD2 4.19Å; E783-N791 PolarHBondContact OE2-ND2 2.77Å
784	S	84.9	Confident	88.4	Confident	62 Å²	62	59.7 Å²	59.7	43%	0.434	35%	0.354	S	S	.	.			trans	-62.2	133	176.3	-176.7	0	0	0	0	111.3	S786 T787 L788	S784-S786 PolarHBondContact O-N 3.18Å; S784-S786 PolarHBondContact OG-OG 2.79Å; S784-T787 PolarHBondContact O-N 2.98Å; S784-T787 PolarHBondContact O-OG1 3.35Å; S784-T787 VanDerWaalsContact O-OG1 3.07Å; S784-L788 PolarHBondContact O-N 2.58Å
785	A	83.4	Confident	88.2	Confident	90 Å²	90	57.5 Å²	57.5	74%	0.744	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-19.4	178.5	0	0	0	0	0	114.1	E783	E783-A785 PolarHBondContact O-N 3.35Å
786	S	82.8	Confident	87.9	Confident	92 Å²	92	63.3 Å²	63.3	64%	0.643	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-22.8	177.4	59.8	0	0	0	0	114.6	S784	S784-S786 PolarHBondContact O-N 3.18Å; S784-S786 PolarHBondContact OG-OG 2.79Å
787	T	85.8	Confident	87.4	Confident	34 Å²	34	61.2 Å²	61.2	21%	0.209	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-28.2	-176.2	54.1	0	0	0	0	111.6	E783 S784 S789 D790	E783-T787 VanDerWaalsContact CD-OG1 3.3Å; E783-T787 WeakPolarHBondContact CG-OG1 3.46Å; E783-T787 VanDerWaalsContact OE1-CB 3.32Å; E783-T787 WeakPolarHBondContact OE1-CB 3.19Å; E783-T787 PolarHBondContact OE1-OG1 3.26Å; S784-T787 PolarHBondContact O-N 2.98Å; S784-T787 PolarHBondContact O-OG1 3.35Å; S784-T787 VanDerWaalsContact O-OG1 3.07Å; T787-S789 PolarHBondContact O-N 3.43Å; T787-D790 VanDerWaalsContact O-CG 3.28Å; T787-D790 PolarHBondContact O-N 3.17Å
788	L	85.4	Confident	86.8	Confident	90 Å²	90	64.1 Å²	64.1	47%	0.471	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-42.1	-27.4	-177.9	-67.9	176.8	0	0	0	117.7	E783 S784 D790 N791	E783-L788 HydrophobicContact CB-CD2 4.01Å; E783-L788 HydrophobicContact CG-CD2 4.19Å; S784-L788 PolarHBondContact O-N 2.58Å; L788-D790 VanDerWaalsContact C-N 3.31Å; L788-D790 PolarHBondContact O-N 3Å; L788-N791 WeakPolarHBondContact O-CB 3.27Å; L788-N791 PolarHBondContact O-N 3.39Å
789	S	86.7	Confident	86.1	Confident	101 Å²	101	62.9 Å²	62.9	71%	0.706	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-68.4	-22.3	177.3	55.8	0	0	0	0	114.8	T787 N791	T787-S789 PolarHBondContact O-N 3.43Å; S789-N791 VanDerWaalsContact C-N 3.29Å
790	D	91.6	Very high	85.5	Confident	58 Å²	58	67 Å²	67	31%	0.31	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-89.3	4.5	178.7	70.4	-0.8	0	0	0	113.7	R666 M667 T787 L788	R666-D790 HydrophobicContact CB-CB 4.43Å; R666-D790 WeakPolarHBondContact CB-OD2 3.34Å; M667-D790 PolarHBondContact N-O 3.2Å; T787-D790 VanDerWaalsContact O-CG 3.28Å; T787-D790 PolarHBondContact O-N 3.17Å; L788-D790 VanDerWaalsContact C-N 3.31Å; L788-D790 PolarHBondContact O-N 3Å
791	N	90.9	Very high	85.1	Confident	10 Å²	10	63.9 Å²	63.9	5%	0.053	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-86.4	-10.9	172.1	-76.9	-32.6	0	0	0	114.3	L665 M667 T777 E783 L788 S789	L665-N791 WeakPolarHBondContact CB-OD1 3.41Å; L665-N791 PolarHBondContact O-OD1 2.79Å; M667-N791 VanDerWaalsContact CE-O 3.3Å; M667-N791 WeakPolarHBondContact CE-O 3.16Å; T777-N791 HydrophobicContact CG2-CB 4.02Å; T777-N791 VanDerWaalsContact CG2-OD1 3.31Å; T777-N791 WeakPolarHBondContact CG2-OD1 3.5Å; T777-N791 PolarHBondContact N-O 2.89Å; T777-N791 WeakPolarHBondContact O-CB 3.33Å; E783-N791 PolarHBondContact OE2-ND2 2.77Å; L788-N791 WeakPolarHBondContact O-CB 3.27Å; L788-N791 PolarHBondContact O-N 3.39Å; S789-N791 VanDerWaalsContact C-N 3.29Å
792	E	93.2	Very high	84.9	Confident	110 Å²	110	67.6 Å²	67.6	51%	0.514	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	132.3	-175.9	-175.1	171.9	-173.1	0	0	111.1	L775 I776	L775-E792 WeakPolarHBondContact O-CA 3.43Å; I776-E792 HydrophobicContact CG1-CG 4.21Å
793	V	93.5	Very high	84.8	Confident	37 Å²	37	61.6 Å²	61.6	22%	0.224	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	131.8	176.9	-179.7	0	0	0	0	108.7	M667 A669 L775 I795	M667-V793 HydrophobicContact CE-CB 3.95Å; M667-V793 HydrophobicContact CE-CG2 3.86Å; M667-V793 HydrophobicContact CG-CG2 4.43Å; A669-V793 HydrophobicContact CB-CG1 4.33Å; L775-V793 HydrophobicContact CB-CB 4.5Å; L775-V793 VanDerWaalsContact CB-O 3.29Å; L775-V793 WeakPolarHBondContact CB-O 3.47Å; L775-V793 HydrophobicContact CD1-CB 4.35Å; L775-V793 HydrophobicContact CD1-CG1 4.39Å; L775-V793 PolarHBondContact N-O 3.16Å; L775-V793 PolarHBondContact O-N 3.41Å; V793-I795 HydrophobicContact CG1-CG1 4.35Å
794	T	92	Very high	84.8	Confident	64 Å²	64	62.7 Å²	62.7	39%	0.393	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.8	170.7	-59.8	0	0	0	0	109.4	L773 H774	L773-T794 WeakPolarHBondContact O-CA 3.29Å; H774-T794 PolarHBondContact ND1-OG1 3.25Å
795	I	90	Very high	85	Confident	20 Å²	20	59.8 Å²	59.8	10%	0.103	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	114.8	173.9	-63.6	-178.2	0	0	0	108.5	A669 V686 S772 L773 L775 V793 I797	A669-I795 HydrophobicContact CB-CD1 3.64Å; A669-I795 HydrophobicContact CB-CG1 4.48Å; V686-I795 HydrophobicContact CG1-CD1 3.68Å; S772-I795 WeakPolarHBondContact CA-O 3.35Å; L773-I795 PolarHBondContact N-O 3.36Å; L773-I795 PolarHBondContact O-N 2.81Å; L775-I795 HydrophobicContact CD1-CD1 3.76Å; L775-I795 HydrophobicContact CD1-CG1 3.91Å; V793-I795 HydrophobicContact CG1-CG1 4.35Å; I795-I797 HydrophobicContact CG2-CG1 4.35Å
796	D	86.9	Confident	85.4	Confident	122 Å²	122	58.9 Å²	58.9	65%	0.652	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.7	122.3	167.8	-62.9	-40.5	0	0	0	108.9	S772 P798	S772-D796 WeakPolarHBondContact CB-OD1 3.42Å; D796-P798 WeakPolarHBondContact O-CD 3.4Å
797	I	84	Confident	85.9	Confident	8 Å²	8	55 Å²	55	4%	0.041	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	113	-176.4	-50.2	-177.8	0	0	0	109.3	L671 I676 F684 I771 L773 I795	L671-I797 HydrophobicContact CD2-CG2 3.93Å; I676-I797 HydrophobicContact CD1-CD1 4.42Å; I676-I797 HydrophobicContact CD1-CG2 3.36Å; I676-I797 HydrophobicContact CG1-CG2 3.7Å; F684-I797 HydrophobicContact CE1-CD1 4.31Å; F684-I797 HydrophobicContact CE2-CD1 3.58Å; F684-I797 HydrophobicContact CZ-CD1 3.4Å; I771-I797 HydrophobicContact CB-CB 4.24Å; I771-I797 HydrophobicContact CB-CD1 4.25Å; I771-I797 HydrophobicContact CB-CG1 4.45Å; I771-I797 HydrophobicContact CG2-CD1 3.68Å; I771-I797 HydrophobicContact CG2-CG1 4.29Å; I771-I797 WeakPolarHBondContact O-CB 3.27Å; I771-I797 PolarHBondContact O-N 2.74Å; L773-I797 HydrophobicContact CD1-CD1 3.95Å; L773-I797 HydrophobicContact CG-CD1 4.1Å; I795-I797 HydrophobicContact CG2-CG1 4.35Å
798	P	79.3	Confident	86.3	Confident	63 Å²	63	55.9 Å²	55.9	41%	0.409	31%	0.305	S	S	.	.			trans	-62.6	136.3	174.9	23.4	-33.4	0	0	0	111.4	E674 A675 I676 D796	E674-P798 WeakPolarHBondContact O-CG 3.28Å; A675-P798 CarbonylContact C-O 3.56Å; A675-P798 VanDerWaalsContact CA-O 3.26Å; A675-P798 WeakPolarHBondContact CA-O 3.06Å; A675-P798 HydrophobicContact CB-CB 4.37Å; I676-P798 PolarHBondContact N-O 2.9Å; D796-P798 WeakPolarHBondContact O-CD 3.4Å
799	M	74.9	Confident	86.6	Confident	42 Å²	42	52.8 Å²	52.8	21%	0.207	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	140.6	-178.7	-58.1	174.8	77.7	0	0	110.1	I676 I678 I771	I676-M799 CarbonylContact O-C 3.54Å; I676-M799 WeakPolarHBondContact O-CA 3.49Å; I678-M799 HydrophobicContact CD1-CB 3.94Å; I678-M799 HydrophobicContact CD1-CE 3.69Å; I678-M799 HydrophobicContact CG1-CB 3.98Å; I678-M799 HydrophobicContact CG1-CE 3.64Å; I771-M799 HydrophobicContact CD1-CE 4.14Å; I771-M799 HydrophobicContact CD1-SD 4.37Å; I771-M799 HydrophobicContact CG1-CE 4.32Å; I771-M799 HydrophobicContact CG1-SD 4.08Å
800	E	75.4	Confident	86.9	Confident	112 Å²	112	52.6 Å²	52.6	52%	0.523	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	138.4	179.2	-171.6	-179.9	177.7	0	0	110.4	A675 I676 L677 I678	A675-E800 HydrophobicContact CB-CB 4.07Å; I676-E800 PolarHBondContact O-N 2.83Å; L677-E800 WeakPolarHBondContact CA-O 3Å; L677-E800 HydrophobicContact CD2-CB 4.22Å; L677-E800 HydrophobicContact CD2-CG 4.27Å; I678-E800 PolarHBondContact N-O 2.9Å
801	V	75	Confident	86.9	Confident	21 Å²	21	50.5 Å²	50.5	13%	0.127	28%	0.279	C	S	.	.			trans	-103.3	128.2	179.2	168.6	0	0	0	0	109.8	I678 T849 L1024 Y1026 I1031	I678-V801 HydrophobicContact CD1-CG2 3.75Å; I678-V801 HydrophobicContact CG1-CG2 4.41Å; V801-T849 HydrophobicContact CG1-CG2 3.91Å; V801-T849 HydrophobicContact CG2-CG2 4.47Å; V801-L1024 HydrophobicContact CG1-CD1 3.98Å; V801-L1024 HydrophobicContact CG1-CD2 4.17Å; V801-Y1026 HydrophobicContact CG2-CD2 4.07Å; V801-I1031 HydrophobicContact CB-CD1 3.74Å; V801-I1031 HydrophobicContact CG1-CD1 4.18Å; V801-I1031 HydrophobicContact CG2-CD1 4.39Å
802	K	78.7	Confident	86.7	Confident	111 Å²	111	57.5 Å²	57.5	48%	0.483	30%	0.304	S	S	.	.			trans	-119.4	95.5	173.9	-172.8	179.2	-179.1	-176.3	0	110.6	L677 D804 P848 T849	L677-K802 HydrophobicContact CD2-CB 3.96Å; K802-D804 PolarHBondContact O-N 3.38Å; K802-P848 HydrophobicContact CB-CG 4.36Å; K802-T849 PolarHBondContact N-OG1 3.2Å
803	A	80.2	Confident	86.3	Confident	18 Å²	18	56 Å²	56	15%	0.149	30%	0.3	C	S	.	.			trans	-82	110.6	169.8	0	0	0	0	0	109.4	L851 P1034	A803-L851 HydrophobicContact CB-CD2 3.6Å; A803-P1034 HydrophobicContact CB-CG 3.92Å; A803-P1034 WeakPolarHBondContact O-CG 3.38Å
804	D	86	Confident	85.6	Confident	52 Å²	52	61.4 Å²	61.4	28%	0.278	32%	0.323	S	S	.	.			trans	-136.3	120.6	173.2	-167.2	17.7	0	0	0	109.5	K802 N845 L846 G847 R1036	K802-D804 PolarHBondContact O-N 3.38Å; D804-N845 PolarHBondContact O-OD1 3.46Å; D804-L846 CarbonylContact O-C 3.57Å; D804-L846 WeakPolarHBondContact O-CA 3.14Å; D804-L846 PolarHBondContact O-N 3.46Å; D804-G847 PolarHBondContact O-N 2.99Å; D804-R1036 IonicContact OD1-NH2 3.57Å
805	F	89.5	Confident	85.3	Confident	1 Å²	1	62 Å²	62	0%	0.004	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	158.5	-179.9	70.8	-82.3	0	0	0	109.4	V807 I843 R844 L851 A1019 V1021 P1034 R1036	F805-V807 HydrophobicContact CD2-CG2 4.26Å; F805-V807 HydrophobicContact CE2-CG2 4Å; F805-I843 HydrophobicContact CD2-CG2 4.38Å; F805-R844 VanDerWaalsContact CA-O 3.29Å; F805-R844 WeakPolarHBondContact CA-O 3.49Å; F805-R844 WeakPolarHBondContact CB-O 3.49Å; F805-L851 HydrophobicContact CD1-CD1 4.38Å; F805-A1019 HydrophobicContact CE2-CB 3.71Å; F805-A1019 HydrophobicContact CZ-CB 4.36Å; F805-A1019 WeakPolarHBondContact CZ-O 3.37Å; F805-V1021 HydrophobicContact CD1-CG2 3.95Å; F805-V1021 HydrophobicContact CE1-CG2 3.54Å; F805-V1021 HydrophobicContact CZ-CG2 4.36Å; F805-P1034 HydrophobicContact CD1-CG 4.18Å; F805-P1034 HydrophobicContact CE1-CB 3.98Å; F805-P1034 HydrophobicContact CE1-CG 3.82Å; F805-P1034 VanDerWaalsContact CE1-O 3.29Å; F805-P1034 WeakPolarHBondContact CE1-O 3.28Å; F805-P1034 WeakPolarHBondContact CZ-O 3.42Å; F805-R1036 HydrophobicContact CD2-CB 4.33Å; F805-R1036 HydrophobicContact CD2-CG 4.09Å; F805-R1036 HydrophobicContact CE1-CG 4.2Å; F805-R1036 HydrophobicContact CE2-CB 3.62Å; F805-R1036 HydrophobicContact CE2-CG 3.64Å; F805-R1036 HydrophobicContact CZ-CB 3.94Å; F805-R1036 HydrophobicContact CZ-CG 3.7Å; F805-R1036 WeakPolarHBondContact O-CG 3.06Å; F805-R1036 PolarHBondContact O-NE 2.89Å
806	I	92.2	Very high	85.1	Confident	70 Å²	70	62.1 Å²	62.1	36%	0.359	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	145.2	178.2	-167.6	172.1	0	0	0	109.8	T808 I843 R844 L846	I806-T808 HydrophobicContact CD1-CG2 3.73Å; I806-T808 HydrophobicContact CG1-CG2 3.91Å; I806-I843 WeakPolarHBondContact O-CA 3.24Å; I806-R844 HydrophobicContact CG2-CB 3.97Å; I806-R844 PolarHBondContact N-O 2.88Å; I806-R844 PolarHBondContact O-N 3.08Å; I806-L846 HydrophobicContact CB-CD1 3.97Å; I806-L846 HydrophobicContact CG2-CD1 3.83Å; I806-L846 HydrophobicContact CG2-CG 4.07Å
807	V	93	Very high	85	Confident	11 Å²	11	61.1 Å²	61.1	7%	0.067	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	119.6	167.1	-174.2	0	0	0	0	106	F805 E842 I843 A1017 A1019 R1036 A1038	F805-V807 HydrophobicContact CD2-CG2 4.26Å; F805-V807 HydrophobicContact CE2-CG2 4Å; V807-E842 WeakPolarHBondContact CA-O 3.26Å; V807-I843 HydrophobicContact CG1-CG1 4.27Å; V807-I843 HydrophobicContact CG2-CG1 4.22Å; V807-A1017 HydrophobicContact CG1-CB 4.32Å; V807-A1019 HydrophobicContact CG2-CB 3.59Å; V807-R1036 HydrophobicContact CB-CB 4.43Å; V807-R1036 HydrophobicContact CG2-CB 3.78Å; V807-A1038 HydrophobicContact CB-CB 4.26Å; V807-A1038 HydrophobicContact CG1-CB 3.63Å
808	T	93.5	Very high	84.9	Confident	53 Å²	53	61 Å²	61	33%	0.325	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	159.9	171.9	54.9	0	0	0	0	108.8	I806 Y841 E842	I806-T808 HydrophobicContact CD1-CG2 3.73Å; I806-T808 HydrophobicContact CG1-CG2 3.91Å; T808-Y841 CarbonylContact O-C 3.56Å; T808-Y841 WeakPolarHBondContact O-CA 3.27Å; T808-E842 PolarHBondContact N-O 3.27Å; T808-E842 PolarHBondContact O-N 3.18Å; T808-E842 PolarHBondContact OG1-O 3.07Å
809	G	92.1	Very high	84.9	Confident	25 Å²	25	62.4 Å²	62.4	26%	0.258	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	151.4	173.1	0	0	0	0	0	111.8	V840 V1040	G809-V840 CarbonylContact C-O 3.47Å; G809-V840 WeakPolarHBondContact CA-O 3.3Å; G809-V1040 VanDerWaalsContact CA-CG2 3.45Å
810	V	93.3	Very high	85	Confident	97 Å²	97	62.6 Å²	62.6	59%	0.588	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.7	147.8	-178.8	-66.2	0	0	0	0	110.6	V840	V810-V840 HydrophobicContact CG2-CB 4.28Å; V810-V840 PolarHBondContact N-O 3.1Å; V810-V840 PolarHBondContact O-N 2.94Å
811	S	91.9	Very high	85.2	Confident	14 Å²	14	61.2 Å²	61.2	10%	0.098	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	132.4	167.9	-175.9	0	0	0	0	108.2	N813 T1042	S811-N813 WeakPolarHBondContact CB-O 3.41Å; S811-N813 PolarHBondContact O-N 2.71Å; S811-N813 PolarHBondContact OG-O 2.87Å; S811-T1042 PolarHBondContact OG-OG1 3.24Å; S811-T1042 VanDerWaalsContact OG-OG1 3.07Å
812	R	86.9	Confident	85.3	Confident	157 Å²	157	64 Å²	64	59%	0.592	34%	0.335	S	S	*	.	S	Bend	trans	-57.8	-35.1	-179.7	-173.7	177.8	179.3	-173.8	-0.5	111.9	S838	R812-S838 PolarHBondContact N-O 2.53Å
813	N	83.6	Confident	85.6	Confident	77 Å²	77	63.6 Å²	63.6	41%	0.412	33%	0.331	S	S	.	.	S	Bend	trans	-124.2	123	166.6	-66.6	-24.7	0	0	0	108.4	S811 T815 Y816	S811-N813 WeakPolarHBondContact CB-O 3.41Å; S811-N813 PolarHBondContact O-N 2.71Å; S811-N813 PolarHBondContact OG-O 2.87Å; N813-T815 VanDerWaalsContact C-N 3.32Å; N813-Y816 HydrophobicContact CB-CD2 4.41Å; N813-Y816 HydrophobicContact CB-CE1 4.25Å; N813-Y816 HydrophobicContact CB-CE2 3.61Å; N813-Y816 WeakPolarHBondContact CB-OH 2.92Å; N813-Y816 PolarHBondContact ND2-OH 2.89Å
814	E	79.4	Confident	85.7	Confident	151 Å²	151	68.8 Å²	68.8	71%	0.706	35%	0.347	S	S	*	.	S	Bend	trans	-73.2	-26.2	-178	-64.8	-176.9	174.5	0	0	112.6	I1043	E814-I1043 PolarHBondContact O-N 3.11Å
815	T	84.6	Confident	85.5	Confident	77 Å²	77	74.8 Å²	74.8	47%	0.472	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	135.1	-175.5	54.5	0	0	0	0	110.6	N813 I1043	N813-T815 VanDerWaalsContact C-N 3.32Å; T815-I1043 CarbonylContact C-O 3.41Å; T815-I1043 VanDerWaalsContact CA-O 3.3Å; T815-I1043 WeakPolarHBondContact CA-O 3.14Å; T815-I1043 HydrophobicContact CG2-CB 4.07Å; T815-I1043 HydrophobicContact CG2-CD1 4.32Å; T815-I1043 HydrophobicContact CG2-CG2 4.5Å
816	Y	86	Confident	85.1	Confident	23 Å²	23	81 Å²	81	9%	0.09	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	132.9	165.2	-72.3	-90.1	0	0	0	110	N813 P835 L836 V837 T1042 I1043 V1044 N1045	N813-Y816 HydrophobicContact CB-CD2 4.41Å; N813-Y816 HydrophobicContact CB-CE1 4.25Å; N813-Y816 HydrophobicContact CB-CE2 3.61Å; N813-Y816 WeakPolarHBondContact CB-OH 2.92Å; N813-Y816 PolarHBondContact ND2-OH 2.89Å; Y816-P835 HydrophobicContact CD1-CB 3.84Å; Y816-P835 HydrophobicContact CD1-CG 3.7Å; Y816-P835 HydrophobicContact CE1-CB 3.68Å; Y816-P835 HydrophobicContact CE1-CG 4.01Å; Y816-P835 HydrophobicContact CG-CG 4.41Å; Y816-L836 PolarHBondContact OH-O 3.23Å; Y816-V837 HydrophobicContact CD2-CG2 4.21Å; Y816-V837 HydrophobicContact CE2-CB 4.47Å; Y816-V837 HydrophobicContact CE2-CG2 3.74Å; Y816-T1042 HydrophobicContact CD2-CG2 3.34Å; Y816-T1042 HydrophobicContact CE2-CG2 3.68Å; Y816-I1043 PolarHBondContact N-O 3.04Å; Y816-V1044 VanDerWaalsContact O-CA 3.31Å; Y816-V1044 WeakPolarHBondContact O-CA 3.4Å; Y816-N1045 PolarHBondContact O-N 3.3Å
817	D	85.1	Confident	84.7	Confident	101 Å²	101	79.1 Å²	79.1	54%	0.54	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	133.9	171.2	-57.5	-39.5	0	0	0	108.6	N1045	D817-N1045 CarbonylContact C-O 3.19Å; D817-N1045 WeakPolarHBondContact CA-O 3.29Å; D817-N1045 PolarHBondContact OD1-ND2 3.23Å
818	Y	81.9	Confident	84.4	Confident	4 Å²	4	82.3 Å²	82.3	2%	0.016	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	145.5	-179.5	72.7	-84.6	0	0	0	111.5	F820 I1000 L1003 I1004 F1008 V1044 N1045 P1046 S1047	Y818-F820 HydrophobicContact CE2-CE1 4.46Å; Y818-I1000 HydrophobicContact CD2-CG2 4.49Å; Y818-L1003 HydrophobicContact CD1-CD1 4.14Å; Y818-L1003 HydrophobicContact CE1-CB 4.3Å; Y818-L1003 HydrophobicContact CE1-CD1 4.35Å; Y818-L1003 HydrophobicContact CE2-CB 4.11Å; Y818-L1003 HydrophobicContact CG-CD1 4.39Å; Y818-I1004 HydrophobicContact CD2-CG1 4.16Å; Y818-I1004 HydrophobicContact CE2-CG1 3.86Å; Y818-F1008 PolarHBondContact OH-O 3.43Å; Y818-V1044 HydrophobicContact CD1-CG1 3.5Å; Y818-V1044 HydrophobicContact CE1-CG1 3.72Å; Y818-N1045 WeakPolarHBondContact CD1-O 3.31Å; Y818-N1045 VanDerWaalsContact CE1-C 3.49Å; Y818-N1045 PolarHBondContact N-O 2.87Å; Y818-P1046 HydrophobicContact CE1-CB 4.17Å; Y818-P1046 HydrophobicContact CE2-CB 4.31Å; Y818-P1046 CarbonylContact O-C 3.46Å; Y818-P1046 VanDerWaalsContact O-CA 3.23Å; Y818-P1046 WeakPolarHBondContact O-CA 3.33Å; Y818-S1047 VanDerWaalsContact C-OG 3.28Å; Y818-S1047 PolarHBondContact N-OG 2.66Å; Y818-S1047 PolarHBondContact O-N 3.32Å; Y818-S1047 PolarHBondContact O-OG 2.9Å
819	E	80	Confident	84.1	Confident	94 Å²	94	84 Å²	84	44%	0.439	42%	0.416	S	S	.	.			trans	-99.2	145.5	173.4	-65.4	-174.6	-173.7	0	0	112.3	S821 E822	E819-S821 WeakPolarHBondContact CB-OG 3.44Å; E819-S821 PolarHBondContact O-N 2.85Å; E819-S821 VanDerWaalsContact O-N 3.08Å; E819-S821 PolarHBondContact OE2-OG 2.83Å; E819-E822 HydrophobicContact CB-CG 4.24Å; E819-E822 PolarHBondContact N-OE1 2.93Å; E819-E822 WeakPolarHBondContact O-CB 3.2Å; E819-E822 PolarHBondContact O-N 2.88Å
820	F	77.5	Confident	83.7	Confident	45 Å²	45	83 Å²	83	20%	0.197	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-61.5	-16.7	170.6	-67.1	-75.7	0	0	0	113.1	Y818 E822 I1004 P1046 I1052	Y818-F820 HydrophobicContact CE2-CE1 4.46Å; F820-E822 VanDerWaalsContact C-N 3.26Å; F820-E822 PolarHBondContact O-N 2.83Å; F820-I1004 HydrophobicContact CD1-CB 4.4Å; F820-I1004 HydrophobicContact CD1-CG1 3.97Å; F820-I1004 HydrophobicContact CD1-CG2 3.96Å; F820-I1004 HydrophobicContact CE1-CG1 4.44Å; F820-I1004 HydrophobicContact CE1-CG2 4.48Å; F820-P1046 HydrophobicContact CE2-CB 3.86Å; F820-P1046 HydrophobicContact CZ-CB 4.11Å; F820-I1052 HydrophobicContact CD1-CD1 4.42Å; F820-I1052 HydrophobicContact CE1-CD1 3.7Å; F820-I1052 HydrophobicContact CE1-CG1 4.49Å; F820-I1052 HydrophobicContact CE2-CD1 3.99Å; F820-I1052 HydrophobicContact CE2-CG1 4.17Å; F820-I1052 HydrophobicContact CZ-CD1 3.46Å; F820-I1052 VanDerWaalsContact CZ-CD1 3.46Å; F820-I1052 HydrophobicContact CZ-CG1 4.14Å
821	S	78.5	Confident	83.3	Confident	84 Å²	84	80.8 Å²	80.8	59%	0.587	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-71.7	-18.4	175.8	63.4	0	0	0	0	113	E819 Y823	E819-S821 WeakPolarHBondContact CB-OG 3.44Å; E819-S821 PolarHBondContact O-N 2.85Å; E819-S821 VanDerWaalsContact O-N 3.08Å; E819-S821 PolarHBondContact OE2-OG 2.83Å; S821-Y823 VanDerWaalsContact C-N 3.3Å; S821-Y823 PolarHBondContact O-N 2.73Å
822	E	77.6	Confident	83.1	Confident	78 Å²	78	81.4 Å²	81.4	36%	0.364	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-83	-2.1	-175.5	-66.7	174.7	-127.2	0	0	113.6	E819 F820 R824 I1000	E819-E822 HydrophobicContact CB-CG 4.24Å; E819-E822 PolarHBondContact N-OE1 2.93Å; E819-E822 WeakPolarHBondContact O-CB 3.2Å; E819-E822 PolarHBondContact O-N 2.88Å; F820-E822 VanDerWaalsContact C-N 3.26Å; F820-E822 PolarHBondContact O-N 2.83Å; E822-R824 PolarHBondContact O-N 2.63Å; E822-I1000 HydrophobicContact CB-CD1 4.08Å; E822-I1000 HydrophobicContact CB-CG2 4.07Å; E822-I1000 WeakPolarHBondContact OE2-CD1 3.5Å
823	Y	84.6	Confident	83.1	Confident	103 Å²	103	74 Å²	74	40%	0.404	37%	0.368	S	S	.	.			trans	-58.5	125.2	175.8	-175.5	-85.9	0	0	0	111.5	S821 N1001 I1004 E1005	S821-Y823 VanDerWaalsContact C-N 3.3Å; S821-Y823 PolarHBondContact O-N 2.73Å; Y823-N1001 HydrophobicContact CD2-CB 4.22Å; Y823-N1001 HydrophobicContact CE2-CB 4Å; Y823-I1004 HydrophobicContact CD2-CB 4.37Å; Y823-I1004 HydrophobicContact CD2-CD1 4.31Å; Y823-I1004 HydrophobicContact CD2-CG2 4.1Å; Y823-E1005 HydrophobicContact CE2-CG 4.38Å
824	R	83	Confident	83.4	Confident	128 Å²	128	70.6 Å²	70.6	48%	0.483	35%	0.352	S	S	.	.			trans	-124.2	133.9	176.6	-70.2	-169.2	-173.9	-170.1	15.5	111.6	E822 I827 D832 N1001	E822-R824 PolarHBondContact O-N 2.63Å; R824-I827 HydrophobicContact CB-CG1 4.41Å; R824-D832 IonicContact CZ-OD1 4Å; R824-D832 IonicContact NH1-OD1 2.9Å; R824-D832 PolarHBondContact NH1-OD1 3.44Å; R824-N1001 PolarHBondContact N-OD1 3.15Å; R824-N1001 PolarHBondContact O-ND2 3.27Å; R824-N1001 PolarHBondContact O-OD1 3.22Å
825	K	81	Confident	83.9	Confident	177 Å²	177	65.4 Å²	65.4	77%	0.77	33%	0.331	S	S	*	.	S	Bend	trans	-80.3	-37.5	179	-163.8	179	179.4	-174.1	0	113.1
826	D	82.3	Confident	84.1	Confident	132 Å²	132	64.3 Å²	64.3	71%	0.706	32%	0.322	S	S	*	.			trans	-112	99.1	-177.4	-55.6	-42.3	0	0	0	109
827	I	83.8	Confident	84.3	Confident	30 Å²	30	63.2 Å²	63.2	15%	0.154	32%	0.318	C	S	.	.			trans	-97.6	115.7	178.4	-61.7	171.9	0	0	0	107.4	R824 D832 A833 L899 W999	R824-I827 HydrophobicContact CB-CG1 4.41Å; I827-D832 HydrophobicContact CB-CB 4.46Å; I827-D832 HydrophobicContact CG2-CB 3.96Å; I827-A833 HydrophobicContact CG2-CB 4.01Å; I827-L899 HydrophobicContact CG2-CD1 3.82Å; I827-L899 HydrophobicContact CG2-CD2 3.79Å; I827-L899 HydrophobicContact CG2-CG 4.49Å; I827-L899 WeakPolarHBondContact O-CD2 3.34Å; I827-W999 HydrophobicContact CD1-CH2 3.99Å; I827-W999 HydrophobicContact CD1-CZ2 3.48Å; I827-W999 VanDerWaalsContact CD1-CZ2 3.48Å; I827-W999 HydrophobicContact CG2-CH2 4.2Å
828	V	85.3	Confident	84.6	Confident	79 Å²	79	58.5 Å²	58.5	48%	0.479	29%	0.293	S	S	.	.			trans	-117.2	-43.2	-177.1	-179.6	0	0	0	0	111.1	D832 T900	V828-D832 PolarHBondContact N-OD2 3.46Å; V828-T900 PolarHBondContact O-N 3.39Å
829	F	86.8	Confident	85.2	Confident	88 Å²	88	58.3 Å²	58.3	39%	0.386	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-94.6	150.5	175	-60.5	-81.7	0	0	0	110.4	S831 D832 T900 M902	F829-S831 PolarHBondContact O-N 3.22Å; F829-D832 WeakPolarHBondContact CD2-OD2 3.47Å; F829-D832 PolarHBondContact N-OD2 3.44Å; F829-D832 VanDerWaalsContact O-CB 3.31Å; F829-D832 WeakPolarHBondContact O-CB 3.31Å; F829-D832 PolarHBondContact O-N 3.08Å; F829-T900 WeakPolarHBondContact CA-O 3.3Å; F829-T900 HydrophobicContact CD1-CG2 4.03Å; F829-T900 HydrophobicContact CE1-CG2 4.02Å; F829-M902 HydrophobicContact CD1-CG 4.11Å; F829-M902 HydrophobicContact CD1-SD 4.39Å
830	D	84.7	Confident	85.9	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-57.4	-33.7	174.9	74.7	-51.4	0	0	0	112.3	D832 A833 T875 T900 M902 R997	D830-D832 PolarHBondContact O-N 3.5Å; D830-A833 WeakPolarHBondContact O-CB 3.11Å; D830-A833 PolarHBondContact O-N 3.1Å; D830-T875 HydrophobicContact CB-CG2 3.84Å; D830-T900 PolarHBondContact N-O 2.79Å; D830-M902 PolarHBondContact OD1-N 2.81Å; D830-R997 HydrophobicContact CB-CG 4.29Å; D830-R997 WeakPolarHBondContact O-CD 3.22Å; D830-R997 WeakPolarHBondContact O-CG 3.44Å; D830-R997 IonicContact OD1-NH2 3.57Å; D830-R997 IonicContact OD2-CZ 2.64Å; D830-R997 IonicContact OD2-NE 2.95Å; D830-R997 PolarHBondContact OD2-NE 2.79Å; D830-R997 IonicContact OD2-NH2 2.77Å; D830-R997 PolarHBondContact OD2-NH2 3.31Å
831	S	85.9	Confident	86.7	Confident	50 Å²	50	53.5 Å²	53.5	35%	0.35	27%	0.273	S	S	.	.	H	α-helix	trans	-66.9	-19.8	175	60.6	0	0	0	0	114.3	F829	F829-S831 PolarHBondContact O-N 3.22Å
832	D	87.3	Confident	87.5	Confident	27 Å²	27	52.2 Å²	52.2	14%	0.144	26%	0.258	C	S	.	.	H	α-helix	trans	-77.4	-23.4	176.8	-61.4	-35.5	0	0	0	112.4	R824 I827 V828 F829 D830	R824-D832 IonicContact CZ-OD1 4Å; R824-D832 IonicContact NH1-OD1 2.9Å; R824-D832 PolarHBondContact NH1-OD1 3.44Å; I827-D832 HydrophobicContact CB-CB 4.46Å; I827-D832 HydrophobicContact CG2-CB 3.96Å; V828-D832 PolarHBondContact N-OD2 3.46Å; F829-D832 WeakPolarHBondContact CD2-OD2 3.47Å; F829-D832 PolarHBondContact N-OD2 3.44Å; F829-D832 VanDerWaalsContact O-CB 3.31Å; F829-D832 WeakPolarHBondContact O-CB 3.31Å; F829-D832 PolarHBondContact O-N 3.08Å; D830-D832 PolarHBondContact O-N 3.5Å
833	A	87.2	Confident	88.3	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.008	24%	0.24	C	C	.	.	H	α-helix	trans	-71.8	-34.6	-179.6	0	0	0	0	0	112.4	I827 D830 L899 R997 L998 W999 I1000	I827-A833 HydrophobicContact CG2-CB 4.01Å; D830-A833 WeakPolarHBondContact O-CB 3.11Å; D830-A833 PolarHBondContact O-N 3.1Å; A833-L899 HydrophobicContact CB-CD1 4.29Å; A833-R997 HydrophobicContact CB-CB 4.25Å; A833-L998 CarbonylContact C-O 3.49Å; A833-W999 HydrophobicContact CB-CD2 4.28Å; A833-W999 HydrophobicContact CB-CE3 3.56Å; A833-W999 HydrophobicContact CB-CH2 4.46Å; A833-W999 HydrophobicContact CB-CZ3 3.68Å; A833-I1000 PolarHBondContact O-N 3.25Å
834	G	88.1	Confident	88.7	Confident	7 Å²	7	48.2 Å²	48.2	7%	0.072	24%	0.238	C	C	.	.			trans	151.3	-168.8	176	0	0	0	0	0	114.1	R997 L998	G834-R997 VanDerWaalsContact O-CD 3.27Å; G834-R997 WeakPolarHBondContact O-CD 3.4Å; G834-R997 PolarHBondContact O-NH1 3.25Å; G834-L998 VanDerWaalsContact CA-O 3.3Å; G834-L998 WeakPolarHBondContact CA-O 3.26Å
835	P	89.8	Confident	89.1	Confident	42 Å²	42	42.1 Å²	42.1	27%	0.273	22%	0.215	S	C	.	.			trans	-67.6	154.2	-177.2	28.3	-35.4	0	0	0	112.1	Y816 V837 R997 L998	Y816-P835 HydrophobicContact CD1-CB 3.84Å; Y816-P835 HydrophobicContact CD1-CG 3.7Å; Y816-P835 HydrophobicContact CE1-CB 3.68Å; Y816-P835 HydrophobicContact CE1-CG 4.01Å; Y816-P835 HydrophobicContact CG-CG 4.41Å; P835-V837 PolarHBondContact O-N 3.5Å; P835-R997 WeakPolarHBondContact O-CA 3.09Å; P835-L998 HydrophobicContact CG-CB 4.11Å; P835-L998 HydrophobicContact CG-CD2 4.16Å; P835-L998 PolarHBondContact O-N 3.01Å
836	L	89.6	Confident	89.4	Confident	53 Å²	53	37.6 Å²	37.6	28%	0.277	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	122.1	173.3	-173.3	74	0	0	0	109.5	Y816 D995 A996	Y816-L836 PolarHBondContact OH-O 3.23Å; L836-D995 HydrophobicContact CD1-CB 4.13Å; L836-A996 CarbonylContact C-O 3.58Å; L836-A996 WeakPolarHBondContact CA-O 3.33Å
837	V	91	Very high	89.5	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	124.2	170.4	179.2	0	0	0	0	108	Y816 P835 L872 A996 L998 T1042	Y816-V837 HydrophobicContact CD2-CG2 4.21Å; Y816-V837 HydrophobicContact CE2-CB 4.47Å; Y816-V837 HydrophobicContact CE2-CG2 3.74Å; P835-V837 PolarHBondContact O-N 3.5Å; V837-L872 HydrophobicContact CB-CD2 4.36Å; V837-L872 HydrophobicContact CG1-CD2 4.44Å; V837-L872 HydrophobicContact CG2-CD2 4.25Å; V837-A996 PolarHBondContact N-O 3.08Å; V837-A996 PolarHBondContact O-N 3.1Å; V837-L998 HydrophobicContact CG2-CB 3.8Å; V837-T1042 HydrophobicContact CG1-CG2 4.4Å; V837-T1042 WeakPolarHBondContact CG1-OG1 3.45Å
838	S	91.4	Very high	89.3	Confident	2 Å²	2	31 Å²	31	1%	0.014	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	119.9	179.2	-56.8	0	0	0	0	109.8	R812 I994 D995	R812-S838 PolarHBondContact N-O 2.53Å; S838-I994 WeakPolarHBondContact CA-O 3.08Å; S838-D995 WeakPolarHBondContact CB-OD1 3.32Å; S838-D995 PolarHBondContact OG-OD1 2.94Å
839	H	93.7	Very high	89.2	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	135.7	166.4	-65.5	177.9	0	0	0	109.6	Y841 W860 K993 I994 S1015 V1040 T1042	H839-Y841 HydrophobicContact CB-CE2 4.33Å; H839-W860 HydrophobicContact CB-CH2 4Å; H839-W860 HydrophobicContact CB-CZ3 3.64Å; H839-W860 AromaticContact CG-CH2 3.64Å; H839-W860 AromaticContact CG-CZ3 3.49Å; H839-W860 VanDerWaalsContact CG-CZ3 3.49Å; H839-W860 AromaticContact ND1-CH2 3.52Å; H839-W860 AromaticContact ND1-CZ3 3.14Å; H839-W860 WeakPolarHBondContact ND1-CZ3 3.28Å; H839-K993 WeakPolarHBondContact O-CA 3.09Å; H839-I994 PolarHBondContact N-O 3Å; H839-I994 PolarHBondContact O-N 3.35Å; H839-S1015 PolarHBondContact CE1-OG 2.88Å; H839-S1015 PolarHBondContact ND1-OG 2.96Å; H839-V1040 HydrophobicContact CB-CB 4.4Å; H839-V1040 HydrophobicContact CB-CG1 3.97Å; H839-V1040 PolarHBondContact CE1-O 3.31Å; H839-T1042 PolarHBondContact NE2-OG1 2.93Å
840	V	94	Very high	89	Confident	39 Å²	39	25.1 Å²	25.1	24%	0.236	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	124.5	179	-174.8	0	0	0	0	108.2	G809 V810 L991 L992 K993	G809-V840 CarbonylContact C-O 3.47Å; G809-V840 WeakPolarHBondContact CA-O 3.3Å; V810-V840 HydrophobicContact CG2-CB 4.28Å; V810-V840 PolarHBondContact N-O 3.1Å; V810-V840 PolarHBondContact O-N 2.94Å; V840-L991 HydrophobicContact CG1-CD2 4.2Å; V840-L992 WeakPolarHBondContact CA-O 3.19Å; V840-K993 HydrophobicContact CG2-CB 4.37Å; V840-K993 HydrophobicContact CG2-CG 4.15Å
841	Y	95.5	Very high	89	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	133	172.8	-68.2	-83	0	0	0	110	T808 H839 I858 L991 L992 S1015 V1016 A1017 A1038 V1040	T808-Y841 CarbonylContact O-C 3.56Å; T808-Y841 WeakPolarHBondContact O-CA 3.27Å; H839-Y841 HydrophobicContact CB-CE2 4.33Å; Y841-I858 HydrophobicContact CD2-CD1 4.22Å; Y841-I858 HydrophobicContact CE2-CG2 4.09Å; Y841-L991 CarbonylContact O-C 3.53Å; Y841-L991 WeakPolarHBondContact O-CA 3.43Å; Y841-L992 PolarHBondContact N-O 3.23Å; Y841-L992 PolarHBondContact O-N 3.07Å; Y841-S1015 WeakPolarHBondContact OH-CB 3.38Å; Y841-S1015 PolarHBondContact OH-O 3.28Å; Y841-S1015 VanDerWaalsContact OH-O 3.09Å; Y841-S1015 PolarHBondContact OH-OG 3.03Å; Y841-V1016 PolarHBondContact OH-N 2.74Å; Y841-A1017 HydrophobicContact CD1-CB 3.37Å; Y841-A1017 HydrophobicContact CD2-CB 4.32Å; Y841-A1017 HydrophobicContact CE1-CB 3.37Å; Y841-A1017 HydrophobicContact CE2-CB 4.34Å; Y841-A1017 HydrophobicContact CG-CB 3.85Å; Y841-A1038 HydrophobicContact CD1-CB 4.14Å; Y841-A1038 HydrophobicContact CE1-CB 4.11Å; Y841-V1040 HydrophobicContact CD1-CG2 4.11Å; Y841-V1040 HydrophobicContact CE1-CB 4.36Å; Y841-V1040 HydrophobicContact CE1-CG2 3.48Å; Y841-V1040 VanDerWaalsContact CE1-CG2 3.48Å; Y841-V1040 HydrophobicContact CE2-CG2 4.43Å
842	E	94.4	Very high	89	Confident	57 Å²	57	23.5 Å²	23.5	27%	0.266	12%	0.123	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	123.7	173.2	-177.3	179.9	-151.1	0	0	108.8	V807 T808 R989 V990 L991	V807-E842 WeakPolarHBondContact CA-O 3.26Å; T808-E842 PolarHBondContact N-O 3.27Å; T808-E842 PolarHBondContact O-N 3.18Å; T808-E842 PolarHBondContact OG1-O 3.07Å; E842-R989 WeakPolarHBondContact OE1-CD 3.33Å; E842-R989 IonicContact OE1-NH1 2.83Å; E842-V990 WeakPolarHBondContact CA-O 3.26Å; E842-L991 HydrophobicContact CB-CD2 3.66Å; E842-L991 HydrophobicContact CG-CD2 3.82Å
843	I	94.4	Very high	89.1	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	127	172.1	-58.4	88.4	0	0	0	106.8	F805 I806 V807 V856 I981 F984 R989 V990 L992	F805-I843 HydrophobicContact CD2-CG2 4.38Å; I806-I843 WeakPolarHBondContact O-CA 3.24Å; V807-I843 HydrophobicContact CG1-CG1 4.27Å; V807-I843 HydrophobicContact CG2-CG1 4.22Å; I843-V856 HydrophobicContact CD1-CG1 4.33Å; I843-V856 HydrophobicContact CG1-CG2 4.31Å; I843-I981 HydrophobicContact CB-CD1 4.21Å; I843-I981 HydrophobicContact CG2-CD1 4.01Å; I843-F984 HydrophobicContact CG2-CE1 3.86Å; I843-F984 HydrophobicContact CG2-CZ 4.04Å; I843-R989 CarbonylContact O-C 3.13Å; I843-R989 VanDerWaalsContact O-CA 3.25Å; I843-R989 WeakPolarHBondContact O-CA 3.49Å; I843-V990 PolarHBondContact N-O 3.3Å; I843-V990 PolarHBondContact O-N 3.08Å; I843-L992 HydrophobicContact CD1-CD1 3.8Å; I843-L992 HydrophobicContact CD1-CG 4.24Å
844	R	93.3	Very high	89.3	Confident	97 Å²	97	24.5 Å²	24.5	37%	0.366	13%	0.127	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	132.2	-179.5	-176.7	176.1	174.3	179.6	-2	111.4	F805 I806 L846 D987 E988 R989	F805-R844 VanDerWaalsContact CA-O 3.29Å; F805-R844 WeakPolarHBondContact CA-O 3.49Å; F805-R844 WeakPolarHBondContact CB-O 3.49Å; I806-R844 HydrophobicContact CG2-CB 3.97Å; I806-R844 PolarHBondContact N-O 2.88Å; I806-R844 PolarHBondContact O-N 3.08Å; R844-L846 HydrophobicContact CG-CD2 4.15Å; R844-L846 PolarHBondContact O-N 2.92Å; R844-D987 IonicContact CZ-OD1 3.88Å; R844-D987 IonicContact NE-OD1 2.73Å; R844-D987 IonicContact NH2-OD1 3.65Å; R844-D987 PolarHBondContact NH2-OD1 3.42Å; R844-E988 WeakPolarHBondContact CA-O 2.9Å; R844-R989 HydrophobicContact CB-CB 4.45Å
845	N	91.2	Very high	89.6	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	113.9	171.6	-170.1	3.2	0	0	0	109.2	D804 G847 T849 F984 K985 D987 E988	D804-N845 PolarHBondContact O-OD1 3.46Å; N845-G847 PolarHBondContact OD1-N 2.93Å; N845-G847 VanDerWaalsContact OD1-N 3.07Å; N845-G847 PolarHBondContact OD1-O 3.33Å; N845-T849 PolarHBondContact ND2-O 3.41Å; N845-T849 VanDerWaalsContact ND2-O 3.07Å; N845-F984 HydrophobicContact CB-CD1 3.78Å; N845-F984 HydrophobicContact CB-CE1 3.63Å; N845-F984 HydrophobicContact CB-CE2 4.4Å; N845-F984 HydrophobicContact CB-CG 4.23Å; N845-F984 HydrophobicContact CB-CZ 3.97Å; N845-F984 VanDerWaalsContact N-CZ 3.25Å; N845-F984 PolarHBondContact ND2-O 2.84Å; N845-K985 VanDerWaalsContact CB-O 3.26Å; N845-K985 WeakPolarHBondContact CB-O 3.37Å; N845-K985 PolarHBondContact ND2-O 3.04Å; N845-D987 WeakPolarHBondContact O-CA 3.47Å; N845-D987 PolarHBondContact O-N 2.93Å; N845-E988 PolarHBondContact N-O 3.08Å
846	L	88.8	Confident	89.9	Confident	82 Å²	82	23 Å²	23	43%	0.429	12%	0.117	S	C	.	.			trans	-96	-13.1	176.6	-62.3	179	0	0	0	111.9	D804 I806 R844	D804-L846 CarbonylContact O-C 3.57Å; D804-L846 WeakPolarHBondContact O-CA 3.14Å; D804-L846 PolarHBondContact O-N 3.46Å; I806-L846 HydrophobicContact CB-CD1 3.97Å; I806-L846 HydrophobicContact CG2-CD1 3.83Å; I806-L846 HydrophobicContact CG2-CG 4.07Å; R844-L846 HydrophobicContact CG-CD2 4.15Å; R844-L846 PolarHBondContact O-N 2.92Å
847	G	82.9	Confident	90.1	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.01	11%	0.111	C	C	.	.	S	Bend	trans	-79.4	154.5	-179.7	0	0	0	0	0	111.6	D804 N845 T849	D804-G847 PolarHBondContact O-N 2.99Å; N845-G847 PolarHBondContact OD1-N 2.93Å; N845-G847 VanDerWaalsContact OD1-N 3.07Å; N845-G847 PolarHBondContact OD1-O 3.33Å; G847-T849 VanDerWaalsContact C-N 3.28Å
848	P	81	Confident	90.2	Very high	23 Å²	23	21.9 Å²	21.9	15%	0.149	11%	0.111	C	C	.	.	S	Bend	trans	-69.2	-30.4	174.3	27.5	-32.4	0	0	0	111.9	I678 G679 A680 K802	I678-P848 CarbonylContact O-C 3.5Å; G679-P848 CarbonylContact C-O 3.55Å; G679-P848 WeakPolarHBondContact CA-O 3.39Å; G679-P848 WeakPolarHBondContact O-CB 3.38Å; A680-P848 HydrophobicContact CB-CB 3.68Å; A680-P848 HydrophobicContact CB-CG 4.15Å; K802-P848 HydrophobicContact CB-CG 4.36Å
849	T	81.3	Confident	90.3	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.123	C	C	.	.	S	Bend	trans	-80.5	132.8	-173.8	-46.1	0	0	0	0	112	I678 V801 K802 N845 G847	I678-T849 HydrophobicContact CB-CG2 4.24Å; I678-T849 HydrophobicContact CG2-CG2 4.39Å; I678-T849 VanDerWaalsContact O-CA 3.24Å; I678-T849 WeakPolarHBondContact O-CA 3.47Å; I678-T849 WeakPolarHBondContact O-CB 3.39Å; I678-T849 PolarHBondContact O-N 3.34Å; I678-T849 PolarHBondContact O-OG1 3.43Å; V801-T849 HydrophobicContact CG1-CG2 3.91Å; V801-T849 HydrophobicContact CG2-CG2 4.47Å; K802-T849 PolarHBondContact N-OG1 3.2Å; N845-T849 PolarHBondContact ND2-O 3.41Å; N845-T849 VanDerWaalsContact ND2-O 3.07Å; G847-T849 VanDerWaalsContact C-N 3.28Å
850	M	82.5	Confident	90.2	Very high	43 Å²	43	25.1 Å²	25.1	21%	0.212	12%	0.123	C	C	.	.	P	Polyproline II helix	trans	-66.5	131.5	169.6	179.5	-174.1	171.9	0	0	111.1	D983 F984 K985 P1025	M850-D983 HydrophobicContact CE-CB 3.2Å; M850-D983 VanDerWaalsContact CE-CG 3.41Å; M850-D983 WeakPolarHBondContact CE-OD1 3.23Å; M850-F984 WeakPolarHBondContact CA-O 3.32Å; M850-K985 HydrophobicContact CG-CG 4.31Å; M850-K985 HydrophobicContact SD-CG 4.45Å; M850-P1025 VanDerWaalsContact O-CD 3.31Å; M850-P1025 WeakPolarHBondContact O-CD 3.43Å; M850-P1025 WeakPolarHBondContact O-CG 3.43Å
851	L	86.2	Confident	90.1	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	118.3	179.9	-50.8	175.3	0	0	0	109	A803 F805 E853 V854 D983 F984 V1021 L1024	A803-L851 HydrophobicContact CB-CD2 3.6Å; F805-L851 HydrophobicContact CD1-CD1 4.38Å; L851-E853 PolarHBondContact O-N 3.22Å; L851-V854 HydrophobicContact CB-CG2 3.88Å; L851-V854 HydrophobicContact CD1-CG2 3.88Å; L851-D983 CarbonylContact O-C 3.59Å; L851-F984 HydrophobicContact CB-CB 4.31Å; L851-F984 HydrophobicContact CD1-CD1 4.33Å; L851-F984 PolarHBondContact N-O 2.74Å; L851-F984 PolarHBondContact O-N 2.93Å; L851-V1021 HydrophobicContact CB-CG1 4.41Å; L851-V1021 HydrophobicContact CD1-CG2 3.9Å; L851-V1021 HydrophobicContact CD2-CG1 4.26Å; L851-L1024 HydrophobicContact CD2-CD2 3.63Å
852	S	85.3	Confident	89.8	Confident	19 Å²	19	23.4 Å²	23.4	13%	0.133	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	-38.3	-174.5	-63.9	0	0	0	0	113.1	N982 D983 K1023 P1025	S852-N982 WeakPolarHBondContact O-CA 3.37Å; S852-D983 PolarHBondContact O-N 2.75Å; S852-K1023 WeakPolarHBondContact CB-O 3.3Å; S852-K1023 PolarHBondContact N-O 2.95Å; S852-K1023 VanDerWaalsContact N-O 3.11Å; S852-P1025 VanDerWaalsContact OG-CA 3.29Å; S852-P1025 WeakPolarHBondContact OG-CA 3.02Å; S852-P1025 VanDerWaalsContact OG-CD 3.27Å; S852-P1025 WeakPolarHBondContact OG-CD 3.23Å
853	E	89.5	Confident	89.5	Confident	50 Å²	50	21.2 Å²	21.2	23%	0.234	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	129.7	176.6	-165.2	-175.2	99.5	0	0	110.5	L851 I981 T1022 K1023	L851-E853 PolarHBondContact O-N 3.22Å; E853-I981 CarbonylContact C-O 3.55Å; E853-I981 WeakPolarHBondContact CA-O 3.43Å; E853-T1022 VanDerWaalsContact CB-OG1 3.31Å; E853-T1022 WeakPolarHBondContact CB-OG1 3.5Å; E853-T1022 VanDerWaalsContact CD-OG1 3.31Å; E853-T1022 VanDerWaalsContact CG-OG1 3.22Å; E853-T1022 WeakPolarHBondContact CG-OG1 3.47Å; E853-T1022 PolarHBondContact O-N 3.41Å; E853-T1022 PolarHBondContact O-OG1 2.79Å; E853-T1022 PolarHBondContact OE1-OG1 3.4Å; E853-K1023 HydrophobicContact CB-CB 3.66Å; E853-K1023 PolarHBondContact N-O 2.83Å; E853-K1023 VanDerWaalsContact N-O 3.12Å; E853-K1023 PolarHBondContact O-N 2.99Å
854	V	92.1	Very high	89	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	123	171.2	-176.9	0	0	0	0	108.3	L851 V856 I981 F984 A1019 E1020 V1021	L851-V854 HydrophobicContact CB-CG2 3.88Å; L851-V854 HydrophobicContact CD1-CG2 3.88Å; V854-V856 HydrophobicContact CG1-CG2 4.38Å; V854-I981 HydrophobicContact CB-CB 4.27Å; V854-I981 PolarHBondContact N-O 2.89Å; V854-I981 PolarHBondContact O-N 3.23Å; V854-F984 HydrophobicContact CG2-CD1 4.14Å; V854-A1019 HydrophobicContact CG1-CB 4.44Å; V854-E1020 CarbonylContact C-O 3.59Å; V854-E1020 WeakPolarHBondContact CA-O 3.37Å; V854-E1020 WeakPolarHBondContact CG1-O 3.47Å; V854-V1021 HydrophobicContact CG2-CG2 4.29Å
855	S	94	Very high	88.1	Confident	18 Å²	18	24.1 Å²	24.1	13%	0.126	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	131.4	174.7	-174.2	0	0	0	0	109.4	C979 A1019 E1020	S855-C979 CarbonylContact C-O 3.53Å; S855-C979 WeakPolarHBondContact CA-O 3.2Å; S855-A1019 CarbonylContact O-C 3.58Å; S855-A1019 VanDerWaalsContact O-CA 3.27Å; S855-A1019 WeakPolarHBondContact O-CA 3.12Å; S855-E1020 PolarHBondContact N-O 3.23Å; S855-E1020 PolarHBondContact O-N 2.85Å
856	V	94.8	Very high	86.9	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	112.2	177	-173.6	0	0	0	0	108.9	I843 V854 I858 C979 I981 L992 I1018 A1019	I843-V856 HydrophobicContact CD1-CG1 4.33Å; I843-V856 HydrophobicContact CG1-CG2 4.31Å; V854-V856 HydrophobicContact CG1-CG2 4.38Å; V856-I858 HydrophobicContact CG1-CG1 4.26Å; V856-C979 HydrophobicContact CB-CB 4.1Å; V856-C979 PolarHBondContact N-O 3.44Å; V856-C979 PolarHBondContact O-N 2.83Å; V856-I981 HydrophobicContact CG2-CD1 3.86Å; V856-I981 HydrophobicContact CG2-CG1 4.37Å; V856-L992 HydrophobicContact CG1-CD1 4.15Å; V856-I1018 CarbonylContact C-O 3.56Å; V856-I1018 VanDerWaalsContact CA-O 3.3Å; V856-I1018 WeakPolarHBondContact CA-O 3.36Å; V856-A1019 HydrophobicContact CB-CB 4.38Å; V856-A1019 HydrophobicContact CG1-CB 4.29Å; V856-A1019 HydrophobicContact CG2-CB 3.81Å
857	D	94.4	Very high	85.9	Confident	29 Å²	29	32.8 Å²	32.8	16%	0.155	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	123.6	174.1	-75.1	-62.8	0	0	0	109.7	Y859 Q976 W977 R978 A1017 I1018	D857-Y859 HydrophobicContact CB-CE2 4.05Å; D857-Q976 PolarHBondContact OD1-NE2 3.01Å; D857-W977 CarbonylContact C-O 3.45Å; D857-W977 WeakPolarHBondContact CA-O 2.93Å; D857-R978 IonicContact OD1-CZ 3.58Å; D857-R978 IonicContact OD1-NE 2.93Å; D857-R978 PolarHBondContact OD1-NE 2.96Å; D857-R978 IonicContact OD1-NH2 3.36Å; D857-R978 PolarHBondContact OD1-NH2 2.93Å; D857-R978 IonicContact OD2-NE 3.85Å; D857-R978 IonicContact OD2-NH2 3.72Å; D857-A1017 WeakPolarHBondContact O-CA 3.27Å; D857-I1018 PolarHBondContact N-O 2.83Å; D857-I1018 PolarHBondContact O-N 2.04Å
858	I	93.9	Very high	85.5	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	127.8	177.5	-55	176.7	0	0	0	109.5	Y841 V856 I878 Q976 W977 L992 I994 V1016 A1017	Y841-I858 HydrophobicContact CD2-CD1 4.22Å; Y841-I858 HydrophobicContact CE2-CG2 4.09Å; V856-I858 HydrophobicContact CG1-CG1 4.26Å; I858-I878 HydrophobicContact CD1-CD1 3.61Å; I858-Q976 VanDerWaalsContact O-CA 3.26Å; I858-Q976 WeakPolarHBondContact O-CA 3.31Å; I858-W977 HydrophobicContact CB-CE3 4.46Å; I858-W977 PolarHBondContact N-O 2.85Å; I858-W977 PolarHBondContact O-N 2.9Å; I858-L992 HydrophobicContact CD1-CB 4.1Å; I858-L992 HydrophobicContact CD1-CD1 3.67Å; I858-I994 HydrophobicContact CD1-CD1 4.31Å; I858-I994 HydrophobicContact CG2-CD1 3.65Å; I858-V1016 CarbonylContact C-O 3.49Å; I858-V1016 WeakPolarHBondContact CA-O 3.23Å; I858-A1017 HydrophobicContact CG1-CB 3.92Å
859	Y	93.2	Very high	85.7	Confident	70 Å²	70	40.5 Å²	40.5	28%	0.275	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	125.6	176.6	-60	-93.4	0	0	0	110.5	D857 Q976 S1015 V1016 I1018	D857-Y859 HydrophobicContact CB-CE2 4.05Å; Y859-Q976 HydrophobicContact CD1-CB 4.45Å; Y859-Q976 HydrophobicContact CD1-CG 4.34Å; Y859-Q976 HydrophobicContact CE1-CG 4.08Å; Y859-S1015 WeakPolarHBondContact O-CA 3.49Å; Y859-S1015 WeakPolarHBondContact O-CB 3.38Å; Y859-V1016 HydrophobicContact CD2-CG1 3.97Å; Y859-V1016 HydrophobicContact CG-CG1 4.24Å; Y859-V1016 PolarHBondContact N-O 3.38Å; Y859-V1016 PolarHBondContact O-N 3.19Å; Y859-V1016 VanDerWaalsContact O-N 3.07Å; Y859-I1018 HydrophobicContact CD2-CD1 4.42Å; Y859-I1018 HydrophobicContact CE2-CD1 3.96Å
860	W	92	Very high	86.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	127.5	-172.5	-176.4	-90.6	0	0	0	112.8	H839 S862 L872 C974 T975 W977 I994 A996	H839-W860 HydrophobicContact CB-CH2 4Å; H839-W860 HydrophobicContact CB-CZ3 3.64Å; H839-W860 AromaticContact CG-CH2 3.64Å; H839-W860 AromaticContact CG-CZ3 3.49Å; H839-W860 VanDerWaalsContact CG-CZ3 3.49Å; H839-W860 AromaticContact ND1-CH2 3.52Å; H839-W860 AromaticContact ND1-CZ3 3.14Å; H839-W860 WeakPolarHBondContact ND1-CZ3 3.28Å; W860-S862 VanDerWaalsContact C-N 3.3Å; W860-S862 PolarHBondContact O-N 2.97Å; W860-L872 HydrophobicContact CD2-CD1 4.49Å; W860-L872 HydrophobicContact CH2-CD1 4.11Å; W860-L872 HydrophobicContact CZ2-CB 3.93Å; W860-L872 HydrophobicContact CZ2-CD1 3.47Å; W860-L872 VanDerWaalsContact CZ2-CD1 3.47Å; W860-L872 HydrophobicContact CZ2-CG 4.27Å; W860-L872 VanDerWaalsContact NE1-CB 3.3Å; W860-L872 PolarHBondContact NE1-O 2.9Å; W860-C974 VanDerWaalsContact C-SG 3.52Å; W860-C974 CarbonylContact O-C 3.41Å; W860-C974 WeakPolarHBondContact O-CA 3.24Å; W860-C974 VanDerWaalsContact O-CB 3.22Å; W860-C974 WeakPolarHBondContact O-CB 3.39Å; W860-C974 PolarHBondContact O-SG 3.27Å; W860-C974 VanDerWaalsContact O-SG 3.34Å; W860-T975 PolarHBondContact N-O 2.87Å; W860-T975 PolarHBondContact O-N 2.76Å; W860-W977 HydrophobicContact CB-CE3 4.46Å; W860-W977 HydrophobicContact CB-CH2 4.19Å; W860-W977 HydrophobicContact CB-CZ3 3.48Å; W860-W977 VanDerWaalsContact CB-CZ3 3.48Å; W860-W977 HydrophobicContact CG-CH2 4.27Å; W860-W977 AromaticContact CG-CZ3 3.99Å; W860-W977 HydrophobicContact CG-CZ3 3.99Å; W860-I994 HydrophobicContact CD2-CG2 3.89Å; W860-I994 HydrophobicContact CE3-CB 4.18Å; W860-I994 HydrophobicContact CE3-CD1 3.83Å; W860-I994 HydrophobicContact CE3-CG2 3.8Å; W860-I994 HydrophobicContact CH2-CB 4.19Å; W860-I994 HydrophobicContact CH2-CG2 3.85Å; W860-I994 HydrophobicContact CZ2-CG2 3.94Å; W860-I994 HydrophobicContact CZ3-CB 3.87Å; W860-I994 HydrophobicContact CZ3-CD1 4.18Å; W860-I994 HydrophobicContact CZ3-CG2 3.77Å; W860-A996 HydrophobicContact CZ2-CB 3.56Å
861	P	91	Very high	86.4	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	76.6	-177.1	33.2	-35.3	0	0	0	111.9	L871 L872 C974 I1013	P861-L871 HydrophobicContact CB-CD2 4.34Å; P861-L872 HydrophobicContact CG-CD1 3.96Å; P861-L872 PolarHBondContact O-N 3.48Å; P861-C974 WeakPolarHBondContact CA-SG 3.34Å; P861-I1013 HydrophobicContact CB-CG2 4.42Å; P861-I1013 HydrophobicContact CG-CG2 3.59Å
862	S	89.3	Confident	86.6	Confident	3 Å²	3	39.1 Å²	39.1	2%	0.021	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	-36.2	179.1	-73	0	0	0	0	113.3	W860 L871 L872 L874 T975	W860-S862 VanDerWaalsContact C-N 3.3Å; W860-S862 PolarHBondContact O-N 2.97Å; S862-L871 PolarHBondContact O-N 3.04Å; S862-L872 PolarHBondContact O-N 3.08Å; S862-L874 WeakPolarHBondContact OG-CD1 3.49Å; S862-T975 VanDerWaalsContact CB-OG1 3.32Å; S862-T975 WeakPolarHBondContact CB-OG1 3.42Å; S862-T975 WeakPolarHBondContact OG-CB 3.45Å; S862-T975 PolarHBondContact OG-OG1 3Å
863	F	88.5	Confident	86.9	Confident	11 Å²	11	38.4 Å²	38.4	5%	0.048	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.8	-173.4	-52.3	-82.2	0	0	0	112.4	R865 F868 K869 H893 P896 A973	F863-R865 PolarHBondContact O-N 3.06Å; F863-F868 HydrophobicContact CD1-CB 4.32Å; F863-F868 HydrophobicContact CD1-CD1 4.48Å; F863-F868 WeakPolarHBondContact CD1-O 3.46Å; F863-F868 HydrophobicContact CD2-CD1 4.29Å; F863-F868 HydrophobicContact CE2-CD1 4.37Å; F863-F868 HydrophobicContact CG-CD1 4.35Å; F863-F868 HydrophobicContact CZ-CD1 4.49Å; F863-K869 CarbonylContact C-O 3.58Å; F863-K869 WeakPolarHBondContact CA-O 3.05Å; F863-H893 HydrophobicContact CE2-CB 4.06Å; F863-H893 AromaticContact CE2-CD2 3.79Å; F863-H893 AromaticContact CE2-CE1 3.92Å; F863-H893 AromaticContact CE2-CG 3.62Å; F863-H893 AromaticContact CE2-ND1 3.71Å; F863-H893 AromaticContact CE2-NE2 4Å; F863-H893 HydrophobicContact CZ-CB 4.31Å; F863-P896 HydrophobicContact CE1-CG 4.28Å; F863-P896 HydrophobicContact CZ-CG 4.22Å; F863-A973 HydrophobicContact CB-CB 4.12Å; F863-A973 HydrophobicContact CD2-CB 4.48Å; F863-A973 PolarHBondContact N-O 3.49Å; F863-A973 PolarHBondContact O-N 3.35Å
864	F	83	Confident	87	Confident	12 Å²	12	36.1 Å²	36.1	5%	0.053	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	109.9	173.4	-174.6	-104.5	0	0	0	110.2	K869 L871 M972 T1002 E1006 F1008	F864-K869 HydrophobicContact CB-CB 4.43Å; F864-K869 PolarHBondContact N-O 3.08Å; F864-L871 HydrophobicContact CB-CB 4.38Å; F864-M972 HydrophobicContact CD2-CE 3.84Å; F864-M972 HydrophobicContact CD2-SD 3.49Å; F864-M972 WeakPolarHBondContact CD2-SD 3.28Å; F864-M972 HydrophobicContact CE2-CE 3.58Å; F864-M972 HydrophobicContact CE2-SD 3.9Å; F864-M972 HydrophobicContact CG-SD 4.24Å; F864-T1002 HydrophobicContact CB-CG2 3.84Å; F864-T1002 HydrophobicContact CG-CG2 4.3Å; F864-E1006 HydrophobicContact CD1-CG 3.73Å; F864-E1006 HydrophobicContact CE1-CB 4.19Å; F864-E1006 VanDerWaalsContact CE1-CD 3.46Å; F864-E1006 HydrophobicContact CE1-CG 3.54Å; F864-E1006 WeakPolarHBondContact CE1-OE2 3.39Å; F864-E1006 HydrophobicContact CZ-CB 4.47Å; F864-E1006 HydrophobicContact CZ-CG 4.28Å; F864-F1008 HydrophobicContact CD2-CE2 4.36Å; F864-F1008 AromaticContact CD2-CZ 3.69Å; F864-F1008 HydrophobicContact CD2-CZ 3.69Å; F864-F1008 HydrophobicContact CE2-CE1 4.1Å; F864-F1008 HydrophobicContact CE2-CE2 4.23Å; F864-F1008 AromaticContact CE2-CZ 3.35Å; F864-F1008 HydrophobicContact CE2-CZ 3.35Å; F864-F1008 AromaticContact CZ-CZ 3.9Å; F864-F1008 HydrophobicContact CZ-CZ 3.9Å
865	R	75.2	Confident	86.7	Confident	146 Å²	146	36.7 Å²	36.7	55%	0.551	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	179.3	-176.7	-60.2	178.5	171.3	166.8	-0.4	113.8	F863 N867 M972	F863-R865 PolarHBondContact O-N 3.06Å; R865-N867 PolarHBondContact O-N 3.14Å; R865-M972 HydrophobicContact CG-SD 4.36Å; R865-M972 PolarHBondContact N-SD 3Å; R865-M972 VanDerWaalsContact N-SD 3.4Å
866	D	66.1	Low	86.4	Confident	131 Å²	131	39.6 Å²	39.6	70%	0.701	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-6	-176.3	-64.8	-31	0	0	0	115.2	F868	D866-F868 WeakPolarHBondContact O-CD2 3.31Å; D866-F868 PolarHBondContact O-N 2.74Å
867	N	66.9	Low	86.2	Confident	133 Å²	133	42.3 Å²	42.3	71%	0.711	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.7	9.5	-179.9	-72.4	-6.6	0	0	0	113.7	R865 K869	R865-N867 PolarHBondContact O-N 3.14Å; N867-K869 HydrophobicContact CB-CG 4.49Å; N867-K869 PolarHBondContact O-N 2.83Å
868	F	75.3	Confident	86	Confident	127 Å²	127	41.7 Å²	41.7	56%	0.557	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	27.5	-178.8	-66.4	-86.5	0	0	0	114.3	F863 D866 P870	F863-F868 HydrophobicContact CD1-CB 4.32Å; F863-F868 HydrophobicContact CD1-CD1 4.48Å; F863-F868 WeakPolarHBondContact CD1-O 3.46Å; F863-F868 HydrophobicContact CD2-CD1 4.29Å; F863-F868 HydrophobicContact CE2-CD1 4.37Å; F863-F868 HydrophobicContact CG-CD1 4.35Å; F863-F868 HydrophobicContact CZ-CD1 4.49Å; D866-F868 WeakPolarHBondContact O-CD2 3.31Å; D866-F868 PolarHBondContact O-N 2.74Å; F868-P870 WeakPolarHBondContact O-CD 2.97Å
869	K	85.6	Confident	85.9	Confident	59 Å²	59	45.5 Å²	45.5	26%	0.257	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	121	172.8	-73.7	-167.4	174.5	-163.4	0	109.2	F863 F864 N867 L871 E1005 E1006	F863-K869 CarbonylContact C-O 3.58Å; F863-K869 WeakPolarHBondContact CA-O 3.05Å; F864-K869 HydrophobicContact CB-CB 4.43Å; F864-K869 PolarHBondContact N-O 3.08Å; N867-K869 HydrophobicContact CB-CG 4.49Å; N867-K869 PolarHBondContact O-N 2.83Å; K869-L871 PolarHBondContact O-N 3.1Å; K869-E1005 IonicContact NZ-OE2 2.87Å; K869-E1005 PolarHBondContact NZ-OE2 3.06Å; K869-E1006 IonicContact NZ-OE1 2.72Å; K869-E1006 PolarHBondContact NZ-OE1 3.18Å
870	P	88.4	Confident	85.8	Confident	12 Å²	12	44.8 Å²	44.8	8%	0.078	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	138.1	-178.6	-23.2	33.3	0	0	0	112.3	F868 Y873 W999 T1002	F868-P870 WeakPolarHBondContact O-CD 2.97Å; P870-Y873 HydrophobicContact CB-CD2 4.1Å; P870-Y873 HydrophobicContact CG-CD2 4.48Å; P870-W999 HydrophobicContact CB-CB 4.23Å; P870-W999 HydrophobicContact CB-CD2 3.64Å; P870-W999 HydrophobicContact CB-CE3 3.81Å; P870-W999 HydrophobicContact CB-CG 3.84Å; P870-W999 HydrophobicContact CB-CZ3 4.35Å; P870-W999 HydrophobicContact CG-CD2 4.19Å; P870-W999 HydrophobicContact CG-CE3 4.41Å; P870-W999 HydrophobicContact CG-CH2 4.48Å; P870-W999 HydrophobicContact CG-CZ2 4.26Å; P870-W999 WeakPolarHBondContact O-CB 3.23Å; P870-T1002 WeakPolarHBondContact O-CB 3.32Å; P870-T1002 PolarHBondContact O-OG1 3.2Å
871	L	89.8	Confident	85.6	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.25	C	S	.	.	S	Bend	trans	-121.1	-67.3	176	-179.8	70.5	0	0	0	110.8	P861 S862 F864 K869 V967 W999 T1002 L1003 I1013	P861-L871 HydrophobicContact CB-CD2 4.34Å; S862-L871 PolarHBondContact O-N 3.04Å; F864-L871 HydrophobicContact CB-CB 4.38Å; K869-L871 PolarHBondContact O-N 3.1Å; L871-V967 HydrophobicContact CD2-CG1 3.53Å; L871-W999 WeakPolarHBondContact O-CB 3.39Å; L871-W999 PolarHBondContact O-N 3.36Å; L871-T1002 HydrophobicContact CD1-CG2 4.31Å; L871-L1003 HydrophobicContact CD1-CD2 4.25Å; L871-I1013 HydrophobicContact CD1-CD1 4.05Å; L871-I1013 HydrophobicContact CD2-CD1 4.36Å; L871-I1013 HydrophobicContact CD2-CG2 4.1Å; L871-I1013 HydrophobicContact CG-CD1 4.23Å
872	L	91.1	Very high	85.3	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	91.8	168.1	-65.9	-176.5	0	0	0	108.6	V837 W860 P861 S862 L874 A996 L998 I1013	V837-L872 HydrophobicContact CB-CD2 4.36Å; V837-L872 HydrophobicContact CG1-CD2 4.44Å; V837-L872 HydrophobicContact CG2-CD2 4.25Å; W860-L872 HydrophobicContact CD2-CD1 4.49Å; W860-L872 HydrophobicContact CH2-CD1 4.11Å; W860-L872 HydrophobicContact CZ2-CB 3.93Å; W860-L872 HydrophobicContact CZ2-CD1 3.47Å; W860-L872 VanDerWaalsContact CZ2-CD1 3.47Å; W860-L872 HydrophobicContact CZ2-CG 4.27Å; W860-L872 VanDerWaalsContact NE1-CB 3.3Å; W860-L872 PolarHBondContact NE1-O 2.9Å; P861-L872 HydrophobicContact CG-CD1 3.96Å; P861-L872 PolarHBondContact O-N 3.48Å; S862-L872 PolarHBondContact O-N 3.08Å; L872-L874 PolarHBondContact O-N 3.47Å; L872-A996 HydrophobicContact CB-CB 4.12Å; L872-L998 HydrophobicContact CD2-CD1 3.72Å; L872-I1013 HydrophobicContact CD1-CG2 3.67Å; L872-I1013 HydrophobicContact CG-CG2 4.05Å
873	Y	91.5	Very high	85.1	Confident	4 Å²	4	59 Å²	59	2%	0.016	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	114.4	-173	-175.7	-89.3	0	0	0	111.7	P870 T875 N895 P896 E897 L899 A996 R997 W999	P870-Y873 HydrophobicContact CB-CD2 4.1Å; P870-Y873 HydrophobicContact CG-CD2 4.48Å; Y873-T875 HydrophobicContact CD1-CG2 4.03Å; Y873-T875 HydrophobicContact CE1-CG2 4.27Å; Y873-T875 PolarHBondContact O-N 3.36Å; Y873-N895 WeakPolarHBondContact CE1-OD1 3.4Å; Y873-N895 VanDerWaalsContact OH-CA 3.27Å; Y873-N895 WeakPolarHBondContact OH-CA 3.5Å; Y873-N895 PolarHBondContact OH-O 3.03Å; Y873-N895 PolarHBondContact OH-OD1 3.06Å; Y873-P896 HydrophobicContact CD2-CG 4.35Å; Y873-P896 HydrophobicContact CE2-CG 3.72Å; Y873-E897 HydrophobicContact CE2-CB 3.91Å; Y873-E897 HydrophobicContact CE2-CG 3.79Å; Y873-E897 WeakPolarHBondContact OH-CB 3.24Å; Y873-E897 PolarHBondContact OH-N 3.44Å; Y873-L899 HydrophobicContact CD1-CD1 4.28Å; Y873-L899 HydrophobicContact CE1-CB 4.47Å; Y873-L899 HydrophobicContact CE1-CD1 3.77Å; Y873-L899 HydrophobicContact CE1-CG 4.15Å; Y873-A996 CarbonylContact O-C 3.58Å; Y873-A996 WeakPolarHBondContact O-CA 3.42Å; Y873-A996 WeakPolarHBondContact O-CB 3.18Å; Y873-R997 WeakPolarHBondContact CB-O 3.01Å; Y873-R997 PolarHBondContact N-O 3.1Å; Y873-R997 PolarHBondContact O-N 3.21Å; Y873-W999 HydrophobicContact CD1-CZ3 4.38Å; Y873-W999 AromaticContact CD2-CE3 3.79Å; Y873-W999 HydrophobicContact CD2-CE3 3.79Å; Y873-W999 HydrophobicContact CD2-CH2 4.36Å; Y873-W999 AromaticContact CD2-CZ3 3.43Å; Y873-W999 HydrophobicContact CD2-CZ3 3.43Å; Y873-W999 VanDerWaalsContact CD2-CZ3 3.43Å; Y873-W999 HydrophobicContact CE2-CH2 4.42Å; Y873-W999 AromaticContact CE2-CZ3 3.82Å; Y873-W999 HydrophobicContact CE2-CZ3 3.82Å; Y873-W999 AromaticContact CG-CE3 3.87Å; Y873-W999 HydrophobicContact CG-CE3 3.87Å; Y873-W999 AromaticContact CG-CZ3 3.74Å; Y873-W999 HydrophobicContact CG-CZ3 3.74Å
874	L	91.3	Very high	85.2	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.01	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	117.9	-178.8	-66.5	166.2	0	0	0	110.5	S862 L872 L894 N895 T975 W977 I994 A996	S862-L874 WeakPolarHBondContact OG-CD1 3.49Å; L872-L874 PolarHBondContact O-N 3.47Å; L874-L894 HydrophobicContact CB-CD1 4.26Å; L874-N895 WeakPolarHBondContact O-CA 3.26Å; L874-N895 PolarHBondContact O-N 3.18Å; L874-T975 HydrophobicContact CD1-CG2 3.8Å; L874-W977 HydrophobicContact CD1-CH2 3.4Å; L874-W977 VanDerWaalsContact CD1-CH2 3.4Å; L874-W977 HydrophobicContact CD1-CZ2 3.77Å; L874-W977 HydrophobicContact CD1-CZ3 4.48Å; L874-W977 HydrophobicContact CD2-CH2 3.62Å; L874-W977 HydrophobicContact CD2-CZ2 4.11Å; L874-W977 HydrophobicContact CG-CH2 4.15Å; L874-I994 HydrophobicContact CD2-CG2 3.7Å; L874-A996 HydrophobicContact CD2-CB 4.16Å
875	T	86.1	Confident	85.7	Confident	13 Å²	13	62.5 Å²	62.5	8%	0.08	32%	0.322	C	S	.	.			trans	-90.3	-36.6	177.8	50	0	0	0	0	112.3	D830 Y873 I901 R997	D830-T875 HydrophobicContact CB-CG2 3.84Å; Y873-T875 HydrophobicContact CD1-CG2 4.03Å; Y873-T875 HydrophobicContact CE1-CG2 4.27Å; Y873-T875 PolarHBondContact O-N 3.36Å; T875-I901 WeakPolarHBondContact O-CD1 3.36Å; T875-R997 HydrophobicContact CG2-CG 3.7Å
876	D	87.1	Confident	86.5	Confident	79 Å²	79	56.8 Å²	56.8	42%	0.422	31%	0.305	S	S	.	.	S	Bend	trans	-136	164.6	-179.6	-154.3	-4.7	0	0	0	110.2	H879 L894	D876-H879 IonicContact OD2-CE1 2.76Å; D876-H879 IonicContact OD2-NE2 3.92Å; D876-L894 VanDerWaalsContact O-CD1 3.3Å; D876-L894 WeakPolarHBondContact O-CD1 3.33Å
877	D	89.7	Confident	87.8	Confident	56 Å²	56	55.5 Å²	55.5	30%	0.299	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-70	170.6	175.6	-152.6	-12.1	0	0	0	110.7	H879 L894 W977	D877-H879 PolarHBondContact O-N 3.44Å; D877-L894 HydrophobicContact CB-CD2 4.5Å; D877-W977 PolarHBondContact OD1-NE1 2.83Å
878	I	91.2	Very high	89	Confident	16 Å²	16	49.6 Å²	49.6	8%	0.082	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-62.1	127.9	-179.1	-168.3	165.7	0	0	0	111.3	I858 C886 W977 L992 I994	I858-I878 HydrophobicContact CD1-CD1 3.61Å; I878-C886 HydrophobicContact CG2-CB 3.63Å; I878-W977 HydrophobicContact CB-CG 4.42Å; I878-W977 HydrophobicContact CD1-CG 4.49Å; I878-W977 HydrophobicContact CG2-CG 4.17Å; I878-L992 HydrophobicContact CD1-CB 3.9Å; I878-L992 HydrophobicContact CD1-CD2 4.36Å; I878-L992 HydrophobicContact CG1-CB 4.48Å; I878-I994 HydrophobicContact CB-CG1 4.32Å; I878-I994 HydrophobicContact CD1-CD1 3.88Å; I878-I994 HydrophobicContact CD1-CG1 3.59Å; I878-I994 HydrophobicContact CG1-CD1 4.47Å; I878-I994 HydrophobicContact CG1-CG1 3.65Å
879	H	91.2	Very high	89.7	Confident	81 Å²	81	47.3 Å²	47.3	38%	0.375	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	117.7	173	-64.5	-65.3	0	0	0	109.5	D876 D877 K993 D995	D876-H879 IonicContact OD2-CE1 2.76Å; D876-H879 IonicContact OD2-NE2 3.92Å; D877-H879 PolarHBondContact O-N 3.44Å; H879-K993 HydrophobicContact CB-CB 4.24Å; H879-K993 PolarHBondContact N-O 3.3Å; H879-K993 PolarHBondContact O-N 3.37Å; H879-D995 IonicContact CD2-OD2 3.7Å
880	S	91.3	Very high	89.9	Confident	55 Å²	55	47.4 Å²	47.4	39%	0.385	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	132.7	-179.4	60	0	0	0	0	112.6	V884 L991	S880-V884 VanDerWaalsContact CB-CG1 3.47Å; S880-L991 CarbonylContact C-O 3.57Å; S880-L991 WeakPolarHBondContact CA-O 3.22Å
881	E	87.2	Confident	89.6	Confident	129 Å²	129	54.5 Å²	54.5	60%	0.603	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.1	132.7	168.3	-54.8	-179.8	178.1	0	0	110	V990 L991	E881-V990 WeakPolarHBondContact O-CA 3.39Å; E881-L991 HydrophobicContact CB-CB 4.2Å; E881-L991 PolarHBondContact N-O 3.09Å; E881-L991 PolarHBondContact O-N 3Å
882	G	85	Confident	89.3	Confident	51 Å²	51	57.6 Å²	57.6	53%	0.526	32%	0.322	S	S	.	.	S	Bend	trans	107.1	-177.7	-175.7	0	0	0	0	0	113.1	V884	G882-V884 VanDerWaalsContact C-N 3.27Å; G882-V884 PolarHBondContact O-N 3.5Å
883	K	84.9	Confident	89.1	Confident	122 Å²	122	59 Å²	59	53%	0.53	33%	0.328	S	S	.	.	S	Bend	trans	-79.5	69.8	-178.4	-67.4	-179.3	-174.7	167.1	0	112.2
884	V	91.4	Very high	89	Confident	15 Å²	15	61.6 Å²	61.6	9%	0.091	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	141.9	-178.9	65.6	0	0	0	0	110.9	S880 G882 C979 K980 I981 V990 L992	S880-V884 VanDerWaalsContact CB-CG1 3.47Å; G882-V884 VanDerWaalsContact C-N 3.27Å; G882-V884 PolarHBondContact O-N 3.5Å; V884-C979 HydrophobicContact CG2-CB 3.7Å; V884-K980 WeakPolarHBondContact CA-O 3.29Å; V884-I981 HydrophobicContact CB-CG1 4.1Å; V884-I981 HydrophobicContact CG2-CG1 3.77Å; V884-V990 HydrophobicContact CB-CG1 3.69Å; V884-V990 HydrophobicContact CB-CG2 4.47Å; V884-V990 HydrophobicContact CG1-CG1 3.52Å; V884-V990 HydrophobicContact CG2-CG1 4.14Å; V884-L992 HydrophobicContact CG1-CD2 3.91Å; V884-L992 HydrophobicContact CG2-CD2 4.3Å
885	T	92.4	Very high	88.9	Confident	80 Å²	80	63.3 Å²	63.3	49%	0.491	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	119	172.8	54.9	0	0	0	0	109	C979 K980	T885-C979 CarbonylContact O-C 3.5Å; T885-C979 VanDerWaalsContact O-CA 3.26Å; T885-C979 WeakPolarHBondContact O-CA 3.34Å; T885-K980 PolarHBondContact N-O 3.05Å; T885-K980 PolarHBondContact O-N 3.15Å
886	C	93.7	Very high	88.9	Confident	27 Å²	27	65.4 Å²	65.4	18%	0.182	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	130.4	-178.1	-64.3	0	0	0	0	111.6	I878 C979	I878-C886 HydrophobicContact CG2-CB 3.63Å; C886-C979 HydrophobicContact CB-CB 4.08Å; C886-C979 WeakPolarHBondContact CB-SG 3.44Å; C886-C979 WeakPolarHBondContact SG-CB 3.47Å; C886-C979 CovalentContact SG-SG 2.04Å; C886-C979 PolarHBondContact SG-SG 2.78Å
887	D	92.9	Very high	88.8	Confident	103 Å²	103	67.1 Å²	67.1	55%	0.551	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	121.1	173	-69.4	-46.4	0	0	0	109.9	L889 W977 R978	D887-L889 PolarHBondContact O-N 3.22Å; D887-W977 WeakPolarHBondContact O-CA 3.27Å; D887-R978 PolarHBondContact N-O 2.85Å; D887-R978 PolarHBondContact O-N 3.43Å
888	L	92.8	Very high	88.6	Confident	9 Å²	9	67.1 Å²	67.1	5%	0.047	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	115.7	169.4	174.3	56.8	0	0	0	110	K891 L894 T975 W977	L888-K891 HydrophobicContact CG-CG 4.37Å; L888-L894 HydrophobicContact CD2-CB 4.23Å; L888-T975 HydrophobicContact CD1-CG2 3.27Å; L888-W977 HydrophobicContact CD1-CD2 4.17Å; L888-W977 HydrophobicContact CD1-CG 4.39Å; L888-W977 HydrophobicContact CD1-CZ2 4.15Å
889	L	89.9	Confident	88.4	Confident	80 Å²	80	66.9 Å²	66.9	42%	0.419	38%	0.383	S	S	.	.	S	Bend	trans	-73.1	-35.7	-176.3	-62	-173.5	0	0	0	112.5	D887 Q976 R978	D887-L889 PolarHBondContact O-N 3.22Å; L889-Q976 HydrophobicContact CD1-CB 4.14Å; L889-Q976 HydrophobicContact CD1-CG 3.79Å; L889-Q976 HydrophobicContact CG-CG 4.43Å; L889-Q976 PolarHBondContact N-O 2.99Å; L889-R978 HydrophobicContact CD2-CB 4.43Å
890	Q	88.4	Confident	88.2	Confident	61 Å²	61	66.7 Å²	66.7	29%	0.285	39%	0.388	S	S	.	.			trans	-109.6	69.7	178.2	-56.3	84.6	7.9	0	0	111.3	G892 H893 Q976	Q890-G892 PolarHBondContact O-N 3.39Å; Q890-H893 WeakPolarHBondContact O-CB 3.46Å; Q890-H893 PolarHBondContact O-N 2.64Å; Q890-Q976 PolarHBondContact OE1-O 3.47Å
891	K	81.8	Confident	87.7	Confident	161 Å²	161	68 Å²	68	70%	0.7	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-52.7	-28	-177.9	-67.5	-171	177.9	-174.2	0	115	L888 H893 L894	L888-K891 HydrophobicContact CG-CG 4.37Å; K891-H893 PolarHBondContact O-N 2.83Å; K891-L894 PolarHBondContact O-N 3.42Å
892	G	84.1	Confident	87	Confident	64 Å²	64	66.6 Å²	66.6	66%	0.66	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-67.8	-9.7	176.3	0	0	0	0	0	114.9	Q890 L894	Q890-G892 PolarHBondContact O-N 3.39Å; G892-L894 VanDerWaalsContact C-N 3.33Å
893	H	88	Confident	85.8	Confident	31 Å²	31	69.9 Å²	69.9	14%	0.144	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-85.6	-4.8	176.3	-62.3	-174.3	0	0	0	113.2	F863 Q890 K891 P896 T975	F863-H893 HydrophobicContact CE2-CB 4.06Å; F863-H893 AromaticContact CE2-CD2 3.79Å; F863-H893 AromaticContact CE2-CE1 3.92Å; F863-H893 AromaticContact CE2-CG 3.62Å; F863-H893 AromaticContact CE2-ND1 3.71Å; F863-H893 AromaticContact CE2-NE2 4Å; F863-H893 HydrophobicContact CZ-CB 4.31Å; Q890-H893 WeakPolarHBondContact O-CB 3.46Å; Q890-H893 PolarHBondContact O-N 2.64Å; K891-H893 PolarHBondContact O-N 2.83Å; H893-P896 WeakPolarHBondContact O-CD 3.11Å; H893-T975 HydrophobicContact CB-CG2 4.11Å; H893-T975 WeakPolarHBondContact CB-OG1 3.2Å; H893-T975 PolarHBondContact ND1-OG1 2.71Å
894	L	88.1	Confident	84.3	Confident	58 Å²	58	69.4 Å²	69.4	30%	0.304	41%	0.408	S	S	.	.	S	Bend	trans	-86.2	120.6	177.6	-176.5	66.2	0	0	0	110.4	L874 D876 D877 L888 K891 G892 P896	L874-L894 HydrophobicContact CB-CD1 4.26Å; D876-L894 VanDerWaalsContact O-CD1 3.3Å; D876-L894 WeakPolarHBondContact O-CD1 3.33Å; D877-L894 HydrophobicContact CB-CD2 4.5Å; L888-L894 HydrophobicContact CD2-CB 4.23Å; K891-L894 PolarHBondContact O-N 3.42Å; G892-L894 VanDerWaalsContact C-N 3.33Å; L894-P896 VanDerWaalsContact C-CD 3.5Å
895	N	89.2	Confident	81.9	Confident	39 Å²	39	75 Å²	75	21%	0.209	44%	0.443	C	S	.	.	S	Bend	trans	43.3	51.4	-177	-163.3	25.8	0	0	0	114.3	Y873 L874 E897 G898 L899	Y873-N895 WeakPolarHBondContact CE1-OD1 3.4Å; Y873-N895 VanDerWaalsContact OH-CA 3.27Å; Y873-N895 WeakPolarHBondContact OH-CA 3.5Å; Y873-N895 PolarHBondContact OH-O 3.03Å; Y873-N895 PolarHBondContact OH-OD1 3.06Å; L874-N895 WeakPolarHBondContact O-CA 3.26Å; L874-N895 PolarHBondContact O-N 3.18Å; N895-E897 VanDerWaalsContact C-N 3.29Å; N895-E897 PolarHBondContact O-N 2.71Å; N895-G898 PolarHBondContact O-N 3.08Å; N895-L899 PolarHBondContact ND2-O 2.91Å; N895-L899 PolarHBondContact OD1-N 3.03Å; N895-L899 VanDerWaalsContact OD1-N 3.1Å
896	P	86.8	Confident	79.2	Confident	56 Å²	56	79.8 Å²	79.8	36%	0.364	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.3	-169.7	25.5	-35	0	0	0	114.5	F863 Y873 H893 L894 G898	F863-P896 HydrophobicContact CE1-CG 4.28Å; F863-P896 HydrophobicContact CZ-CG 4.22Å; Y873-P896 HydrophobicContact CD2-CG 4.35Å; Y873-P896 HydrophobicContact CE2-CG 3.72Å; H893-P896 WeakPolarHBondContact O-CD 3.11Å; L894-P896 VanDerWaalsContact C-CD 3.5Å; P896-G898 VanDerWaalsContact C-N 3.32Å
897	E	85.3	Confident	76.4	Confident	116 Å²	116	87.4 Å²	87.4	54%	0.542	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-1.9	177.2	-62.4	-65	148.1	0	0	112.4	Y873 N895 L899 W999	Y873-E897 HydrophobicContact CE2-CB 3.91Å; Y873-E897 HydrophobicContact CE2-CG 3.79Å; Y873-E897 WeakPolarHBondContact OH-CB 3.24Å; Y873-E897 PolarHBondContact OH-N 3.44Å; N895-E897 VanDerWaalsContact C-N 3.29Å; N895-E897 PolarHBondContact O-N 2.71Å; E897-L899 VanDerWaalsContact C-N 3.33Å; E897-L899 HydrophobicContact CB-CD2 4.2Å; E897-L899 HydrophobicContact CB-CG 4.17Å; E897-L899 PolarHBondContact O-N 3.47Å; E897-W999 HydrophobicContact CB-CH2 4.49Å; E897-W999 HydrophobicContact CG-CH2 3.98Å
898	G	85.8	Confident	73.3	Confident	56 Å²	56	91.6 Å²	91.6	58%	0.577	51%	0.509	S	S	*	.			trans	65.2	32.2	178.2	0	0	0	0	0	114.2	N895 P896	N895-G898 PolarHBondContact O-N 3.08Å; P896-G898 VanDerWaalsContact C-N 3.32Å
899	L	87	Confident	70.3	Confident	11 Å²	11	95.2 Å²	95.2	6%	0.058	55%	0.548	C	S	.	.			trans	-63.1	149	179.9	-58.7	-174.5	0	0	0	111.7	I827 A833 Y873 N895 E897 I901 W999	I827-L899 HydrophobicContact CG2-CD1 3.82Å; I827-L899 HydrophobicContact CG2-CD2 3.79Å; I827-L899 HydrophobicContact CG2-CG 4.49Å; I827-L899 WeakPolarHBondContact O-CD2 3.34Å; A833-L899 HydrophobicContact CB-CD1 4.29Å; Y873-L899 HydrophobicContact CD1-CD1 4.28Å; Y873-L899 HydrophobicContact CE1-CB 4.47Å; Y873-L899 HydrophobicContact CE1-CD1 3.77Å; Y873-L899 HydrophobicContact CE1-CG 4.15Å; N895-L899 PolarHBondContact ND2-O 2.91Å; N895-L899 PolarHBondContact OD1-N 3.03Å; N895-L899 VanDerWaalsContact OD1-N 3.1Å; E897-L899 VanDerWaalsContact C-N 3.33Å; E897-L899 HydrophobicContact CB-CD2 4.2Å; E897-L899 HydrophobicContact CB-CG 4.17Å; E897-L899 PolarHBondContact O-N 3.47Å; L899-I901 PolarHBondContact O-N 3.41Å; L899-W999 HydrophobicContact CD1-CH2 4.15Å; L899-W999 HydrophobicContact CD1-CZ3 3.83Å
900	T	85.4	Confident	67.3	Low	77 Å²	77	94.2 Å²	94.2	47%	0.472	56%	0.557	S	S	.	*	B	Isolated β-bridge	trans	-78.6	113.2	174.4	-55.7	0	0	0	0	109.5	V828 F829 D830 M902	V828-T900 PolarHBondContact O-N 3.39Å; F829-T900 WeakPolarHBondContact CA-O 3.3Å; F829-T900 HydrophobicContact CD1-CG2 4.03Å; F829-T900 HydrophobicContact CE1-CG2 4.02Å; D830-T900 PolarHBondContact N-O 2.79Å; T900-M902 PolarHBondContact O-N 2.82Å
901	I	81.7	Confident	64.6	Low	82 Å²	82	99.4 Å²	99.4	42%	0.421	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-79.8	119	-177.8	-53.9	168.5	0	0	0	109.3	T875 L899	T875-I901 WeakPolarHBondContact O-CD1 3.36Å; L899-I901 PolarHBondContact O-N 3.41Å
902	M	72.7	Confident	62.3	Low	99 Å²	99	97.1 Å²	97.1	49%	0.488	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-78.2	129.7	173.8	-60.8	-166.3	81.1	0	0	110.5	F829 D830 T900 S904	F829-M902 HydrophobicContact CD1-CG 4.11Å; F829-M902 HydrophobicContact CD1-SD 4.39Å; D830-M902 PolarHBondContact OD1-N 2.81Å; T900-M902 PolarHBondContact O-N 2.82Å; M902-S904 PolarHBondContact O-N 2.91Å
903	P	60.4	Low	59.9	Low	120 Å²	120	103.2 Å²	103.2	78%	0.779	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-62.4	122.6	177.6	22.6	-29.9	0	0	0	110.1	T905	P903-T905 PolarHBondContact O-N 2.87Å
904	S	53.1	Low	57.2	Low	112 Å²	112	112.3 Å²	112.3	78%	0.783	64%	0.635	S	S	*	*			trans	-64.9	105.5	177.4	62.1	0	0	0	0	109.7	M902 Q906	M902-S904 PolarHBondContact O-N 2.91Å; S904-Q906 PolarHBondContact O-N 3.06Å
905	T	39.8	Very low	54.7	Low	134 Å²	134	119.7 Å²	119.7	82%	0.822	67%	0.665	S	S	*	*			trans	-58.8	109	164.7	37.6	0	0	0	0	108.4	P903 E907	P903-T905 PolarHBondContact O-N 2.87Å; T905-E907 PolarHBondContact O-N 3.02Å
906	Q	36.5	Very low	52.2	Low	179 Å²	179	126 Å²	126	84%	0.836	69%	0.691	S	S	*	*			trans	-50.6	124.6	162.9	-76.4	-173.9	-22	0	0	107.7	S904 Q908	S904-Q906 PolarHBondContact O-N 3.06Å; Q906-Q908 VanDerWaalsContact C-N 3.34Å; Q906-Q908 PolarHBondContact O-N 3.37Å
907	E	34.9	Very low	49.7	Very low	188 Å²	188	135 Å²	135	88%	0.879	72%	0.717	S	S	*	*			trans	-57.2	98.7	171.5	-74	-179	148	0	0	109	T905 G909	T905-E907 PolarHBondContact O-N 3.02Å; E907-G909 VanDerWaalsContact C-N 3.35Å; E907-G909 PolarHBondContact O-N 3.08Å
908	Q	28	Very low	47.3	Very low	191 Å²	191	137 Å²	137	89%	0.893	73%	0.732	S	S	*	*			trans	-66.9	95	163.1	-75.9	-175.2	-15.1	0	0	108	Q906 G910	Q906-Q908 VanDerWaalsContact C-N 3.34Å; Q906-Q908 PolarHBondContact O-N 3.37Å; Q908-G910 PolarHBondContact O-N 3.25Å
909	G	29.8	Very low	45	Very low	84 Å²	84	139.5 Å²	139.5	87%	0.866	74%	0.736	S	S	*	*			trans	-71.6	72.5	168.8	0	0	0	0	0	111.8	E907	E907-G909 VanDerWaalsContact C-N 3.35Å; E907-G909 PolarHBondContact O-N 3.08Å
910	G	27.3	Very low	42.9	Very low	60 Å²	60	147.1 Å²	147.1	62%	0.619	78%	0.776	S	S	*	*			trans	-78.4	136.6	162.7	0	0	0	0	0	111.1	Q908	Q908-G910 PolarHBondContact O-N 3.25Å
911	N	31.1	Very low	40.8	Very low	170 Å²	170	150.5 Å²	150.5	91%	0.909	79%	0.791	S	S	*	*			trans	78.5	94.2	169.3	-57.7	-26.4	0	0	0	117.8
912	S	34.1	Very low	38.8	Very low	113 Å²	113	149.5 Å²	149.5	79%	0.79	80%	0.795	S	S	*	*				-176.1	94	109.1	-163.3	0	0	0	0	110.8
913	H	33.4	Very low	37.3	Very low	192 Å²	192	150.5 Å²	150.5	89%	0.889	80%	0.802	S	S	*	*			trans	-56.7	138.4	148.9	-87.8	-75.4	0	0	0	108.1
914	R	31.5	Very low	36.4	Very low	222 Å²	222	152.6 Å²	152.6	84%	0.838	80%	0.804	S	S	*	*			trans	107.7	65.9	158	-152.6	-178.2	-157.1	-176.9	4.2	116
915	F	35.7	Very low	35.8	Very low	213 Å²	213	154.1 Å²	154.1	93%	0.934	80%	0.798	S	S	*	*			trans	-136.2	98.4	140	-111.2	-86.4	0	0	0	112.3
916	K	37.2	Very low	35.9	Very low	172 Å²	172	157.3 Å²	157.3	75%	0.748	80%	0.795	S	S	*	*			trans	-13.7	130.3	160.9	-68.3	169.1	172.8	178	0	117	N918	K916-N918 PolarHBondContact O-N 3.01Å; K916-N918 VanDerWaalsContact O-N 3.1Å
917	R	33.5	Very low	36.1	Very low	244 Å²	244	158.3 Å²	158.3	92%	0.921	79%	0.793	S	S	*	*	S	Bend		8.8	92.8	122.9	-84.7	176.5	166.1	147.3	-3.7	112.7
918	N	34.2	Very low	36.6	Very low	158 Å²	158	155.4 Å²	155.4	85%	0.845	78%	0.779	S	S	*	*			trans	-179.1	19	154.2	-96.4	-1.5	0	0	0	115.6	K916	K916-N918 PolarHBondContact O-N 3.01Å; K916-N918 VanDerWaalsContact O-N 3.1Å
919	T	38.9	Very low	37.6	Very low	108 Å²	108	153.7 Å²	153.7	66%	0.663	77%	0.771	S	S	*	*			trans	-128	24.9	-174.4	39.6	0	0	0	0	115.4
920	L	42.4	Very low	38.5	Very low	171 Å²	171	157.7 Å²	157.7	90%	0.895	76%	0.764	S	S	*	*	S	Bend	trans	-89.8	-5.1	170.8	-97.4	146.5	0	0	0	114.4
921	N	40	Very low	39.5	Very low	148 Å²	148	158.7 Å²	158.7	79%	0.791	76%	0.762	S	S	*	*	S	Bend	trans	-110.8	-0.2	177.4	-74	-7.8	0	0	0	114.5
922	A	40.4	Very low	40.6	Very low	61 Å²	61	159.5 Å²	159.5	50%	0.504	75%	0.754	S	S	.	*	S	Bend	trans	-95.8	-11.5	-177.1	0	0	0	0	0	114.3
923	N	42.4	Very low	41.6	Very low	121 Å²	121	159.8 Å²	159.8	65%	0.647	75%	0.746	S	S	*	*	S	Bend	trans	-93	-3.9	-176.6	-70.8	-17.3	0	0	0	114.2
924	M	40.6	Very low	42.7	Very low	163 Å²	163	156.2 Å²	156.2	80%	0.803	73%	0.731	S	S	*	*	S	Bend	trans	-87.6	-28.1	175.2	-153.8	163.6	84.6	0	0	112.6
925	H	40.9	Very low	44.4	Very low	145 Å²	145	152.1 Å²	152.1	67%	0.671	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-19	179.1	-98.8	-66.6	0	0	0	114.6
926	R	42.1	Very low	45.7	Very low	200 Å²	200	144.7 Å²	144.7	76%	0.755	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-8.6	-178.6	-147.5	173.1	-170.9	-177.3	1.2	113.7
927	Y	40.6	Very low	46.8	Very low	201 Å²	201	141.6 Å²	141.6	79%	0.788	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-22.7	176.7	-107.8	-88	0	0	0	113.3
928	E	45.7	Very low	48.2	Very low	126 Å²	126	138.6 Å²	138.6	59%	0.589	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-30.5	176.7	-77.8	-175.7	143.1	0	0	113.3	K930 S931	E928-K930 PolarHBondContact O-N 2.82Å; E928-S931 PolarHBondContact O-N 2.93Å
929	E	47.3	Very low	49.7	Very low	156 Å²	156	135.2 Å²	135.2	73%	0.729	66%	0.659	S	S	*	*	H	α-helix	trans	-74.4	-27.7	-175.7	-150.3	174.3	-164.1	0	0	113.2	S931	E929-S931 VanDerWaalsContact C-N 3.31Å; E929-S931 PolarHBondContact O-N 3.41Å
930	K	50.4	Low	50.7	Low	167 Å²	167	132.1 Å²	132.1	73%	0.726	65%	0.645	S	S	*	*	H	α-helix	trans	-73.2	-20.2	174.6	-101.8	-178	174.5	-178.4	0	113.6	E928 M934	E928-K930 PolarHBondContact O-N 2.82Å; K930-M934 PolarHBondContact O-N 3.46Å
931	S	48.2	Very low	51.5	Low	81 Å²	81	128.9 Å²	128.9	57%	0.566	63%	0.631	S	S	*	*	H	α-helix	trans	-77.3	-38.3	-179.2	-178	0	0	0	0	112.6	E928 E929 K935	E928-S931 PolarHBondContact O-N 2.93Å; E929-S931 VanDerWaalsContact C-N 3.31Å; E929-S931 PolarHBondContact O-N 3.41Å; S931-K935 PolarHBondContact O-N 2.96Å
932	Y	54.5	Low	52.3	Low	187 Å²	187	125 Å²	125	73%	0.733	62%	0.62	S	S	*	*	H	α-helix	trans	-73.2	-37.8	177.9	-81.8	-85.3	0	0	0	113.1	K935 A936	Y932-K935 PolarHBondContact O-N 2.99Å; Y932-A936 PolarHBondContact O-N 3.36Å
933	L	54.4	Low	53	Low	120 Å²	120	129.6 Å²	129.6	63%	0.628	63%	0.633	S	S	*	*	H	α-helix	trans	-67.7	-37.9	178.9	-170.2	67.5	0	0	0	112.3	K935 A936 L937	L933-K935 VanDerWaalsContact C-N 3.34Å; L933-A936 PolarHBondContact O-N 3.37Å; L933-L937 PolarHBondContact O-N 3.26Å
934	M	55.4	Low	53.7	Low	116 Å²	116	131 Å²	131	57%	0.571	64%	0.638	S	S	*	*	H	α-helix	trans	-70.9	-26.6	176.4	-88.3	-71	-164.3	0	0	113.5	K930 R938	K930-M934 PolarHBondContact O-N 3.46Å; M934-R938 PolarHBondContact O-N 3.37Å
935	K	67.1	Low	54	Low	136 Å²	136	132 Å²	132	59%	0.591	64%	0.637	S	S	*	*	H	α-helix	trans	-75.1	-44.9	173	-167	173.9	-179.2	-179.7	0	111.1	S931 Y932 L933 L937 R938 D939	S931-K935 PolarHBondContact O-N 2.96Å; Y932-K935 PolarHBondContact O-N 2.99Å; L933-K935 VanDerWaalsContact C-N 3.34Å; K935-L937 VanDerWaalsContact C-N 3.32Å; K935-L937 PolarHBondContact O-N 2.99Å; K935-R938 PolarHBondContact O-N 3.07Å; K935-D939 PolarHBondContact O-N 2.02Å
936	A	64.6	Low	54.5	Low	58 Å²	58	132.2 Å²	132.2	48%	0.479	64%	0.643	S	S	.	*	H	α-helix	trans	-61.6	-36.7	175.2	0	0	0	0	0	112.9	Y932 L933 A940	Y932-A936 PolarHBondContact O-N 3.36Å; L933-A936 PolarHBondContact O-N 3.37Å; A936-A940 WeakPolarHBondContact O-CB 3.33Å; A936-A940 PolarHBondContact O-N 3.16Å
937	L	60	Low	54.8	Low	107 Å²	107	128.1 Å²	128.1	56%	0.56	64%	0.641	S	S	*	*	H	α-helix	trans	-69.8	-38	175.6	-132.6	93.7	0	0	0	112.5	L933 K935 V941	L933-L937 PolarHBondContact O-N 3.26Å; K935-L937 VanDerWaalsContact C-N 3.32Å; K935-L937 PolarHBondContact O-N 2.99Å; L937-V941 VanDerWaalsContact O-CG2 3.27Å; L937-V941 WeakPolarHBondContact O-CG2 3.29Å; L937-V941 PolarHBondContact O-N 3.31Å
938	R	62.2	Low	54.9	Low	181 Å²	181	122.5 Å²	122.5	68%	0.683	64%	0.636	S	S	*	*	H	α-helix	trans	-67.1	-40.1	176.2	-102.3	-176.1	-95.1	-171.4	-9	112.1	M934 K935 V941 A942	M934-R938 PolarHBondContact O-N 3.37Å; K935-R938 PolarHBondContact O-N 3.07Å; R938-V941 PolarHBondContact O-N 2.82Å; R938-A942 WeakPolarHBondContact O-CB 3.47Å; R938-A942 PolarHBondContact O-N 2.73Å
939	D	66.8	Low	54.9	Low	86 Å²	86	122.9 Å²	122.9	46%	0.46	64%	0.642	S	S	.	*	H	α-helix	trans	-69.1	-37.1	177.4	-65.8	-20	0	0	0	111.4	K935 A942 M943	K935-D939 PolarHBondContact O-N 2.02Å; D939-A942 PolarHBondContact O-N 3.25Å; D939-M943 WeakPolarHBondContact O-CG 3.44Å; D939-M943 PolarHBondContact O-N 2.81Å; D939-M943 VanDerWaalsContact O-N 3.08Å
940	A	58.9	Low	54.9	Low	44 Å²	44	123.1 Å²	123.1	36%	0.364	65%	0.648	S	S	.	*	H	α-helix	trans	-67.2	-37.8	174.7	0	0	0	0	0	113.2	A936 M943 M944	A936-A940 WeakPolarHBondContact O-CB 3.33Å; A936-A940 PolarHBondContact O-N 3.16Å; A940-M943 PolarHBondContact O-N 3.38Å; A940-M944 PolarHBondContact O-N 3.14Å
941	V	60.1	Low	54.5	Low	102 Å²	102	121.5 Å²	121.5	62%	0.618	64%	0.641	S	S	*	*	H	α-helix	trans	-73.3	-30.4	176.3	173.1	0	0	0	0	111.7	L937 R938	L937-V941 VanDerWaalsContact O-CG2 3.27Å; L937-V941 WeakPolarHBondContact O-CG2 3.29Å; L937-V941 PolarHBondContact O-N 3.31Å; R938-V941 PolarHBondContact O-N 2.82Å
942	A	55.4	Low	54.4	Low	66 Å²	66	126.2 Å²	126.2	55%	0.545	65%	0.647	S	S	.	*	H	α-helix	trans	-69.3	-35.4	172.6	0	0	0	0	0	112.3	R938 D939	R938-A942 WeakPolarHBondContact O-CB 3.47Å; R938-A942 PolarHBondContact O-N 2.73Å; D939-A942 PolarHBondContact O-N 3.25Å
943	M	55.7	Low	54.1	Low	159 Å²	159	124.3 Å²	124.3	78%	0.783	65%	0.649	S	S	*	*	H	α-helix	trans	-77.1	-21.7	178.3	-72.8	-171.3	178.2	0	0	114.6	D939 A940 K945	D939-M943 WeakPolarHBondContact O-CG 3.44Å; D939-M943 PolarHBondContact O-N 2.81Å; D939-M943 VanDerWaalsContact O-N 3.08Å; A940-M943 PolarHBondContact O-N 3.38Å; M943-K945 VanDerWaalsContact C-N 3.34Å
944	M	56.1	Low	53.6	Low	151 Å²	151	123.6 Å²	123.6	74%	0.744	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	1	177.8	-72.7	-173.3	-162.5	0	0	114.3	A940	A940-M944 PolarHBondContact O-N 3.14Å
945	K	48.2	Very low	53.3	Low	182 Å²	182	121.1 Å²	121.1	79%	0.791	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-7.6	-174.9	-142.1	176.6	-177.4	-178	0	114.6	M943	M943-K945 VanDerWaalsContact C-N 3.34Å
946	D	51.3	Low	52.1	Low	150 Å²	150	116.1 Å²	116.1	80%	0.802	63%	0.626	S	S	*	*	S	Bend	trans	-100.1	2.7	-174.3	-83.9	-15.1	0	0	0	115.3
947	T	48.2	Very low	51.1	Low	115 Å²	115	121.6 Å²	121.6	71%	0.706	64%	0.641	S	S	*	*	S	Bend	trans	-135.2	132.2	-178.8	36.7	0	0	0	0	113.9
948	A	42.1	Very low	49.9	Very low	82 Å²	82	123.3 Å²	123.3	68%	0.678	65%	0.648	S	S	*	*			trans	83.6	76.9	157.8	0	0	0	0	0	118.1	D950	A948-D950 PolarHBondContact O-N 2.9Å; A948-D950 VanDerWaalsContact O-N 3.12Å
949	N	46	Very low	48.9	Very low	135 Å²	135	123.3 Å²	123.3	72%	0.722	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	8.4	158.2	-100.1	-28.8	0	0	0	114.9	R952	N949-R952 PolarHBondContact OD1-NH1 3.14Å
950	D	47.5	Very low	47.7	Very low	160 Å²	160	125.7 Å²	125.7	86%	0.856	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	-3.6	-172.8	-134.5	9.2	0	0	0	114.1	A948	A948-D950 PolarHBondContact O-N 2.9Å; A948-D950 VanDerWaalsContact O-N 3.12Å
951	F	41.1	Very low	46.9	Very low	133 Å²	133	127.7 Å²	127.7	58%	0.583	68%	0.676	S	S	*	*	S	Bend	trans	-92.8	2.1	176.1	-151.8	-118.4	0	0	0	113.1	N953 I955	F951-N953 PolarHBondContact O-N 2.83Å; F951-I955 HydrophobicContact CD1-CD1 3.23Å; F951-I955 HydrophobicContact CD1-CG1 3.45Å; F951-I955 VanDerWaalsContact CD1-CG1 3.45Å; F951-I955 HydrophobicContact CE1-CD1 3.38Å; F951-I955 HydrophobicContact CE1-CG1 3.41Å; F951-I955 VanDerWaalsContact CE1-CG1 3.41Å; F951-I955 HydrophobicContact CG-CD1 4.47Å; F951-I955 HydrophobicContact CG-CG1 4.48Å; F951-I955 HydrophobicContact CZ-CG1 4.43Å; F951-I955 PolarHBondContact O-N 3.45Å
952	R	47.4	Very low	46.1	Very low	181 Å²	181	130.1 Å²	130.1	68%	0.683	68%	0.684	S	S	*	*	H	α-helix	trans	-75.5	-25.1	-165.2	-141.7	171.1	-176.4	144.8	-2.3	114.1	N949 G956	N949-R952 PolarHBondContact OD1-NH1 3.14Å; R952-G956 PolarHBondContact O-N 2.91Å
953	N	47.7	Very low	45.8	Very low	146 Å²	146	134.4 Å²	134.4	78%	0.781	69%	0.693	S	S	*	*	H	α-helix	trans	-91	-27.6	-177.3	-71.6	-13.6	0	0	0	113.7	F951	F951-N953 PolarHBondContact O-N 2.83Å
954	T	43.9	Very low	46.1	Very low	106 Å²	106	133 Å²	133	65%	0.65	68%	0.679	S	S	*	*	H	α-helix	trans	-85.8	-34.2	178.2	-41.6	0	0	0	0	112	G956	T954-G956 VanDerWaalsContact C-N 3.25Å; T954-G956 PolarHBondContact O-N 2.96Å
955	I	49	Very low	46.8	Very low	64 Å²	64	130 Å²	130	33%	0.328	67%	0.666	S	S	.	*	H	α-helix	trans	-66.4	-29.6	166.8	-73.1	-169.9	0	0	0	111	F951 Q957 M958 R959	F951-I955 HydrophobicContact CD1-CD1 3.23Å; F951-I955 HydrophobicContact CD1-CG1 3.45Å; F951-I955 VanDerWaalsContact CD1-CG1 3.45Å; F951-I955 HydrophobicContact CE1-CD1 3.38Å; F951-I955 HydrophobicContact CE1-CG1 3.41Å; F951-I955 VanDerWaalsContact CE1-CG1 3.41Å; F951-I955 HydrophobicContact CG-CD1 4.47Å; F951-I955 HydrophobicContact CG-CG1 4.48Å; F951-I955 HydrophobicContact CZ-CG1 4.43Å; F951-I955 PolarHBondContact O-N 3.45Å; I955-Q957 PolarHBondContact O-N 2.81Å; I955-M958 CarbonylContact O-C 3.52Å; I955-M958 PolarHBondContact O-N 2.78Å; I955-R959 HydrophobicContact CG2-CB 4.27Å; I955-R959 HydrophobicContact CG2-CG 4.02Å; I955-R959 WeakPolarHBondContact O-CB 3.41Å; I955-R959 PolarHBondContact O-N 3.22Å
956	G	42.5	Very low	48	Very low	31 Å²	31	127.1 Å²	127.1	32%	0.32	65%	0.653	S	S	.	*	H	α-helix	trans	-56.2	-33.6	-177.9	0	0	0	0	0	114.3	R952 T954 I960	R952-G956 PolarHBondContact O-N 2.91Å; T954-G956 VanDerWaalsContact C-N 3.25Å; T954-G956 PolarHBondContact O-N 2.96Å; G956-I960 WeakPolarHBondContact O-CD1 3.32Å; G956-I960 WeakPolarHBondContact O-CG1 3.3Å
957	Q	43.5	Very low	49.2	Very low	172 Å²	172	120 Å²	120	80%	0.804	62%	0.615	S	S	*	*	H	α-helix	trans	-87.1	-24	176.5	-69.4	-174.5	-8.2	0	0	113.4	I955	I955-Q957 PolarHBondContact O-N 2.81Å
958	M	34.9	Very low	50.7	Low	144 Å²	144	115.9 Å²	115.9	71%	0.709	59%	0.588	S	S	*	*	H	α-helix	trans	-83.8	-25.8	173.8	-108.2	177	166.5	0	0	113.2	I955 I960 A961	I955-M958 CarbonylContact O-C 3.52Å; I955-M958 PolarHBondContact O-N 2.78Å; M958-I960 VanDerWaalsContact C-N 3.31Å; M958-I960 PolarHBondContact O-N 3.11Å; M958-A961 PolarHBondContact O-N 3.5Å
959	R	39.8	Very low	52.6	Low	180 Å²	180	113.6 Å²	113.6	68%	0.679	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-70.6	-24.3	177.6	-120.6	178.5	-178.6	153.9	0.1	113.3	I955 A961	I955-R959 HydrophobicContact CG2-CB 4.27Å; I955-R959 HydrophobicContact CG2-CG 4.02Å; I955-R959 WeakPolarHBondContact O-CB 3.41Å; I955-R959 PolarHBondContact O-N 3.22Å; R959-A961 VanDerWaalsContact C-N 3.32Å
960	I	42.2	Very low	54	Low	136 Å²	136	112.6 Å²	112.6	70%	0.697	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-76.7	-21.8	177.2	-62.6	170.6	0	0	0	111.2	G956 M958	G956-I960 WeakPolarHBondContact O-CD1 3.32Å; G956-I960 WeakPolarHBondContact O-CG1 3.3Å; M958-I960 VanDerWaalsContact C-N 3.31Å; M958-I960 PolarHBondContact O-N 3.11Å
961	A	41.4	Very low	55.1	Low	86 Å²	86	112.4 Å²	112.4	71%	0.711	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-94.5	-2.7	179.8	0	0	0	0	0	114.6	M958 R959	M958-A961 PolarHBondContact O-N 3.5Å; R959-A961 VanDerWaalsContact C-N 3.32Å
962	L	44.3	Very low	56.7	Low	153 Å²	153	107.1 Å²	107.1	80%	0.801	54%	0.537	S	S	*	.	S	Bend	trans	-127.7	14.6	-177	-81.7	164.6	0	0	0	113.1
963	Q	49.5	Very low	58.3	Low	157 Å²	157	99.5 Å²	99.5	73%	0.734	51%	0.513	S	S	*	.			trans	-89	112.5	176.8	-156.3	167.2	-2.6	0	0	108.7	I965	Q963-I965 PolarHBondContact O-N 2.64Å
964	R	61.3	Low	60.1	Low	130 Å²	130	93.7 Å²	93.7	49%	0.491	48%	0.484	S	S	.	.			trans	-50.8	132.2	174.2	-64.5	-166.9	166.2	162.1	-4.6	109.9	K966 D1010	R964-K966 PolarHBondContact O-N 3.41Å; R964-K966 VanDerWaalsContact O-N 3.16Å; R964-D1010 WeakPolarHBondContact CD-OD1 3.45Å; R964-D1010 HydrophobicContact CG-CB 4.45Å; R964-D1010 WeakPolarHBondContact CG-OD1 3.44Å; R964-D1010 WeakPolarHBondContact CG-OD2 3.45Å; R964-D1010 IonicContact CZ-OD1 2.77Å; R964-D1010 IonicContact CZ-OD2 2.9Å; R964-D1010 IonicContact NE-OD1 2.88Å; R964-D1010 PolarHBondContact NE-OD1 3.05Å; R964-D1010 VanDerWaalsContact NE-OD1 3.09Å; R964-D1010 IonicContact NE-OD2 3.75Å; R964-D1010 PolarHBondContact NE-OD2 3.38Å; R964-D1010 IonicContact NH2-OD2 3.95Å
965	I	70.4	Confident	62.4	Low	88 Å²	88	88.7 Å²	88.7	45%	0.451	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	112.3	177.2	-60.1	174.2	0	0	0	106.8	Q963 V967 F1008 D1010 A1011 M1012	Q963-I965 PolarHBondContact O-N 2.64Å; I965-V967 HydrophobicContact CG2-CG2 4.06Å; I965-F1008 HydrophobicContact CD1-CD1 4.39Å; I965-F1008 HydrophobicContact CG2-CE1 4.19Å; I965-D1010 PolarHBondContact N-O 2.99Å; I965-D1010 VanDerWaalsContact N-O 3.07Å; I965-A1011 WeakPolarHBondContact O-CA 3.07Å; I965-M1012 PolarHBondContact O-N 3.44Å
966	K	73.1	Confident	64.5	Low	121 Å²	121	86.9 Å²	86.9	53%	0.526	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	115.9	174.8	-168.3	-174.8	-179	-139.3	0	108.2	R964 D968	R964-K966 PolarHBondContact O-N 3.41Å; R964-K966 VanDerWaalsContact O-N 3.16Å; K966-D968 VanDerWaalsContact CE-OD2 3.28Å; K966-D968 WeakPolarHBondContact CE-OD2 3.09Å; K966-D968 IonicContact NZ-OD2 2.74Å; K966-D968 PolarHBondContact NZ-OD2 3.27Å
967	V	77.9	Confident	67	Low	1 Å²	1	85.4 Å²	85.4	1%	0.006	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	99.6	178	-175.7	0	0	0	0	107.1	L871 I965 M972 F1008 M1012 I1013 S1014	L871-V967 HydrophobicContact CD2-CG1 3.53Å; I965-V967 HydrophobicContact CG2-CG2 4.06Å; V967-M972 HydrophobicContact CG1-CE 4.11Å; V967-M972 HydrophobicContact CG1-CG 3.76Å; V967-M972 HydrophobicContact CG1-SD 4.05Å; V967-F1008 HydrophobicContact CG2-CE1 3.69Å; V967-F1008 HydrophobicContact CG2-CZ 4.23Å; V967-M1012 PolarHBondContact N-O 3.47Å; V967-I1013 HydrophobicContact CB-CG1 4.29Å; V967-I1013 WeakPolarHBondContact O-CA 3.3Å; V967-S1014 PolarHBondContact O-N 2.77Å
968	D	79	Confident	69.4	Low	27 Å²	27	81.9 Å²	81.9	14%	0.144	41%	0.407	C	S	.	.			trans	-129.1	174	179.7	66.9	26.8	0	0	0	111.5	K966 T970 M972	K966-D968 VanDerWaalsContact CE-OD2 3.28Å; K966-D968 WeakPolarHBondContact CE-OD2 3.09Å; K966-D968 IonicContact NZ-OD2 2.74Å; K966-D968 PolarHBondContact NZ-OD2 3.27Å; D968-T970 PolarHBondContact O-N 3.4Å; D968-T970 WeakPolarHBondContact OD1-CB 3.33Å; D968-T970 WeakPolarHBondContact OD1-CG2 3.22Å; D968-T970 PolarHBondContact OD1-N 3.21Å; D968-T970 VanDerWaalsContact OD1-N 3.1Å; D968-T970 PolarHBondContact OD1-OG1 3.24Å; D968-M972 WeakPolarHBondContact O-CB 3.45Å; D968-M972 WeakPolarHBondContact O-CG 3.41Å
969	C	81.8	Confident	72.3	Confident	34 Å²	34	75 Å²	75	23%	0.23	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	7.5	-176.4	-69	0	0	0	0	115.7	C974	C969-C974 WeakPolarHBondContact CA-SG 3.48Å; C969-C974 HydrophobicContact CB-CB 3.74Å; C969-C974 WeakPolarHBondContact CB-SG 3.39Å; C969-C974 WeakPolarHBondContact SG-CB 3.21Å; C969-C974 CovalentContact SG-SG 2.01Å; C969-C974 PolarHBondContact SG-SG 2.92Å
970	T	76.8	Confident	74.9	Confident	114 Å²	114	70.3 Å²	70.3	70%	0.699	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-33.6	176.5	64.7	0	0	0	0	112.4	D968	D968-T970 PolarHBondContact O-N 3.4Å; D968-T970 WeakPolarHBondContact OD1-CB 3.33Å; D968-T970 WeakPolarHBondContact OD1-CG2 3.22Å; D968-T970 PolarHBondContact OD1-N 3.21Å; D968-T970 VanDerWaalsContact OD1-N 3.1Å; D968-T970 PolarHBondContact OD1-OG1 3.24Å
971	E	70.5	Confident	77.3	Confident	156 Å²	156	63.9 Å²	63.9	73%	0.729	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.1	-1.1	-178.2	-63.5	-174.1	176.8	0	0	113.3
972	M	73.5	Confident	79.6	Confident	23 Å²	23	63 Å²	63	11%	0.113	31%	0.308	C	S	.	.	S	Bend	trans	-113.3	151.9	-175.4	-58.5	-63.7	149	0	0	111.5	F864 R865 V967 D968 C974	F864-M972 HydrophobicContact CD2-CE 3.84Å; F864-M972 HydrophobicContact CD2-SD 3.49Å; F864-M972 WeakPolarHBondContact CD2-SD 3.28Å; F864-M972 HydrophobicContact CE2-CE 3.58Å; F864-M972 HydrophobicContact CE2-SD 3.9Å; F864-M972 HydrophobicContact CG-SD 4.24Å; R865-M972 HydrophobicContact CG-SD 4.36Å; R865-M972 PolarHBondContact N-SD 3Å; R865-M972 VanDerWaalsContact N-SD 3.4Å; V967-M972 HydrophobicContact CG1-CE 4.11Å; V967-M972 HydrophobicContact CG1-CG 3.76Å; V967-M972 HydrophobicContact CG1-SD 4.05Å; D968-M972 WeakPolarHBondContact O-CB 3.45Å; D968-M972 WeakPolarHBondContact O-CG 3.41Å; M972-C974 PolarHBondContact O-N 3.11Å
973	A	80.3	Confident	81.7	Confident	21 Å²	21	59.6 Å²	59.6	17%	0.174	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	107.2	173.8	0	0	0	0	0	109.7	F863	F863-A973 HydrophobicContact CB-CB 4.12Å; F863-A973 HydrophobicContact CD2-CB 4.48Å; F863-A973 PolarHBondContact N-O 3.49Å; F863-A973 PolarHBondContact O-N 3.35Å
974	C	87.5	Confident	83.5	Confident	24 Å²	24	52.1 Å²	52.1	16%	0.162	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	150	-174.5	-75.1	0	0	0	0	114.3	W860 P861 C969 M972	W860-C974 VanDerWaalsContact C-SG 3.52Å; W860-C974 CarbonylContact O-C 3.41Å; W860-C974 WeakPolarHBondContact O-CA 3.24Å; W860-C974 VanDerWaalsContact O-CB 3.22Å; W860-C974 WeakPolarHBondContact O-CB 3.39Å; W860-C974 PolarHBondContact O-SG 3.27Å; W860-C974 VanDerWaalsContact O-SG 3.34Å; P861-C974 WeakPolarHBondContact CA-SG 3.34Å; C969-C974 WeakPolarHBondContact CA-SG 3.48Å; C969-C974 HydrophobicContact CB-CB 3.74Å; C969-C974 WeakPolarHBondContact CB-SG 3.39Å; C969-C974 WeakPolarHBondContact SG-CB 3.21Å; C969-C974 CovalentContact SG-SG 2.01Å; C969-C974 PolarHBondContact SG-SG 2.92Å; M972-C974 PolarHBondContact O-N 3.11Å
975	T	90.9	Very high	84.8	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	136.9	169.6	-57.4	0	0	0	0	109.1	W860 S862 L874 L888 H893 W977	W860-T975 PolarHBondContact N-O 2.87Å; W860-T975 PolarHBondContact O-N 2.76Å; S862-T975 VanDerWaalsContact CB-OG1 3.32Å; S862-T975 WeakPolarHBondContact CB-OG1 3.42Å; S862-T975 WeakPolarHBondContact OG-CB 3.45Å; S862-T975 PolarHBondContact OG-OG1 3Å; L874-T975 HydrophobicContact CD1-CG2 3.8Å; L888-T975 HydrophobicContact CD1-CG2 3.27Å; H893-T975 HydrophobicContact CB-CG2 4.11Å; H893-T975 WeakPolarHBondContact CB-OG1 3.2Å; H893-T975 PolarHBondContact ND1-OG1 2.71Å; T975-W977 HydrophobicContact CG2-CE3 4.46Å; T975-W977 HydrophobicContact CG2-CH2 3.93Å; T975-W977 HydrophobicContact CG2-CZ2 4.21Å; T975-W977 HydrophobicContact CG2-CZ3 4.06Å
976	Q	93	Very high	85.4	Confident	27 Å²	27	52.3 Å²	52.3	13%	0.126	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	127.5	-177.9	-175.4	-179.7	-10.4	0	0	111.2	D857 I858 Y859 L889 Q890	D857-Q976 PolarHBondContact OD1-NE2 3.01Å; I858-Q976 VanDerWaalsContact O-CA 3.26Å; I858-Q976 WeakPolarHBondContact O-CA 3.31Å; Y859-Q976 HydrophobicContact CD1-CB 4.45Å; Y859-Q976 HydrophobicContact CD1-CG 4.34Å; Y859-Q976 HydrophobicContact CE1-CG 4.08Å; L889-Q976 HydrophobicContact CD1-CB 4.14Å; L889-Q976 HydrophobicContact CD1-CG 3.79Å; L889-Q976 HydrophobicContact CG-CG 4.43Å; L889-Q976 PolarHBondContact N-O 2.99Å; Q890-Q976 PolarHBondContact OE1-O 3.47Å
977	W	94.7	Very high	86	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	139.4	163.3	-68.2	-95.3	0	0	0	110.1	D857 I858 W860 L874 D877 I878 D887 L888 T975 I994	D857-W977 CarbonylContact C-O 3.45Å; D857-W977 WeakPolarHBondContact CA-O 2.93Å; I858-W977 HydrophobicContact CB-CE3 4.46Å; I858-W977 PolarHBondContact N-O 2.85Å; I858-W977 PolarHBondContact O-N 2.9Å; W860-W977 HydrophobicContact CB-CE3 4.46Å; W860-W977 HydrophobicContact CB-CH2 4.19Å; W860-W977 HydrophobicContact CB-CZ3 3.48Å; W860-W977 VanDerWaalsContact CB-CZ3 3.48Å; W860-W977 HydrophobicContact CG-CH2 4.27Å; W860-W977 AromaticContact CG-CZ3 3.99Å; W860-W977 HydrophobicContact CG-CZ3 3.99Å; L874-W977 HydrophobicContact CD1-CH2 3.4Å; L874-W977 VanDerWaalsContact CD1-CH2 3.4Å; L874-W977 HydrophobicContact CD1-CZ2 3.77Å; L874-W977 HydrophobicContact CD1-CZ3 4.48Å; L874-W977 HydrophobicContact CD2-CH2 3.62Å; L874-W977 HydrophobicContact CD2-CZ2 4.11Å; L874-W977 HydrophobicContact CG-CH2 4.15Å; D877-W977 PolarHBondContact OD1-NE1 2.83Å; I878-W977 HydrophobicContact CB-CG 4.42Å; I878-W977 HydrophobicContact CD1-CG 4.49Å; I878-W977 HydrophobicContact CG2-CG 4.17Å; D887-W977 WeakPolarHBondContact O-CA 3.27Å; L888-W977 HydrophobicContact CD1-CD2 4.17Å; L888-W977 HydrophobicContact CD1-CG 4.39Å; L888-W977 HydrophobicContact CD1-CZ2 4.15Å; T975-W977 HydrophobicContact CG2-CE3 4.46Å; T975-W977 HydrophobicContact CG2-CH2 3.93Å; T975-W977 HydrophobicContact CG2-CZ2 4.21Å; T975-W977 HydrophobicContact CG2-CZ3 4.06Å; W977-I994 HydrophobicContact CE3-CD1 4.11Å; W977-I994 HydrophobicContact CH2-CD1 4.38Å; W977-I994 HydrophobicContact CH2-CG2 4.06Å; W977-I994 HydrophobicContact CZ3-CD1 3.89Å
978	R	94.7	Very high	86.6	Confident	98 Å²	98	52.2 Å²	52.2	37%	0.37	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	109.5	169.2	179.9	163.5	-68.4	159.4	-3.7	109.5	D857 D887 L889	D857-R978 IonicContact OD1-CZ 3.58Å; D857-R978 IonicContact OD1-NE 2.93Å; D857-R978 PolarHBondContact OD1-NE 2.96Å; D857-R978 IonicContact OD1-NH2 3.36Å; D857-R978 PolarHBondContact OD1-NH2 2.93Å; D857-R978 IonicContact OD2-NE 3.85Å; D857-R978 IonicContact OD2-NH2 3.72Å; D887-R978 PolarHBondContact N-O 2.85Å; D887-R978 PolarHBondContact O-N 3.43Å; L889-R978 HydrophobicContact CD2-CB 4.43Å
979	C	95.3	Very high	87.3	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	141.3	179.2	-59.7	0	0	0	0	110.9	S855 V856 V884 T885 C886 L992	S855-C979 CarbonylContact C-O 3.53Å; S855-C979 WeakPolarHBondContact CA-O 3.2Å; V856-C979 HydrophobicContact CB-CB 4.1Å; V856-C979 PolarHBondContact N-O 3.44Å; V856-C979 PolarHBondContact O-N 2.83Å; V884-C979 HydrophobicContact CG2-CB 3.7Å; T885-C979 CarbonylContact O-C 3.5Å; T885-C979 VanDerWaalsContact O-CA 3.26Å; T885-C979 WeakPolarHBondContact O-CA 3.34Å; C886-C979 HydrophobicContact CB-CB 4.08Å; C886-C979 WeakPolarHBondContact CB-SG 3.44Å; C886-C979 WeakPolarHBondContact SG-CB 3.47Å; C886-C979 CovalentContact SG-SG 2.04Å; C886-C979 PolarHBondContact SG-SG 2.78Å; C979-L992 HydrophobicContact CB-CD1 4.31Å
980	K	94.6	Very high	87.8	Confident	81 Å²	81	56.6 Å²	56.6	35%	0.352	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	123.5	174.1	-64.8	-173.7	177	-166.4	0	109.9	V884 T885	V884-K980 WeakPolarHBondContact CA-O 3.29Å; T885-K980 PolarHBondContact N-O 3.05Å; T885-K980 PolarHBondContact O-N 3.15Å
981	I	93.3	Very high	88.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	117.5	172.8	-51.2	171.2	0	0	0	106.6	I843 E853 V854 V856 V884 F984 V990	I843-I981 HydrophobicContact CB-CD1 4.21Å; I843-I981 HydrophobicContact CG2-CD1 4.01Å; E853-I981 CarbonylContact C-O 3.55Å; E853-I981 WeakPolarHBondContact CA-O 3.43Å; V854-I981 HydrophobicContact CB-CB 4.27Å; V854-I981 PolarHBondContact N-O 2.89Å; V854-I981 PolarHBondContact O-N 3.23Å; V856-I981 HydrophobicContact CG2-CD1 3.86Å; V856-I981 HydrophobicContact CG2-CG1 4.37Å; V884-I981 HydrophobicContact CB-CG1 4.1Å; V884-I981 HydrophobicContact CG2-CG1 3.77Å; I981-F984 HydrophobicContact CG2-CB 3.83Å; I981-F984 HydrophobicContact CG2-CD1 4.43Å; I981-F984 HydrophobicContact CG2-CD2 3.79Å; I981-F984 HydrophobicContact CG2-CE2 4.41Å; I981-F984 HydrophobicContact CG2-CG 3.8Å; I981-V990 HydrophobicContact CD1-CB 3.99Å; I981-V990 HydrophobicContact CD1-CG1 4.22Å; I981-V990 HydrophobicContact CD1-CG2 3.87Å; I981-V990 HydrophobicContact CG1-CG1 4.46Å; I981-V990 HydrophobicContact CG1-CG2 4.11Å; I981-V990 HydrophobicContact CG2-CG2 3.91Å
982	N	90.2	Very high	89.8	Confident	68 Å²	68	45.4 Å²	45.4	36%	0.364	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	145.3	178.4	-61.7	-44.6	0	0	0	109.6	S852 F984	S852-N982 WeakPolarHBondContact O-CA 3.37Å; N982-F984 VanDerWaalsContact C-N 3.33Å; N982-F984 PolarHBondContact O-N 3.28Å
983	D	86.6	Confident	90.8	Very high	82 Å²	82	47.6 Å²	47.6	44%	0.439	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	56.4	44.5	170	-69.3	-26.5	0	0	0	113.6	M850 L851 S852 K985	M850-D983 HydrophobicContact CE-CB 3.2Å; M850-D983 VanDerWaalsContact CE-CG 3.41Å; M850-D983 WeakPolarHBondContact CE-OD1 3.23Å; L851-D983 CarbonylContact O-C 3.59Å; S852-D983 PolarHBondContact O-N 2.75Å; D983-K985 PolarHBondContact O-N 2.76Å
984	F	89	Confident	91.4	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	101.3	-171.2	-166.1	-149	0	0	0	111.9	I843 N845 M850 L851 V854 I981 N982 E988 V990	I843-F984 HydrophobicContact CG2-CE1 3.86Å; I843-F984 HydrophobicContact CG2-CZ 4.04Å; N845-F984 HydrophobicContact CB-CD1 3.78Å; N845-F984 HydrophobicContact CB-CE1 3.63Å; N845-F984 HydrophobicContact CB-CE2 4.4Å; N845-F984 HydrophobicContact CB-CG 4.23Å; N845-F984 HydrophobicContact CB-CZ 3.97Å; N845-F984 VanDerWaalsContact N-CZ 3.25Å; N845-F984 PolarHBondContact ND2-O 2.84Å; M850-F984 WeakPolarHBondContact CA-O 3.32Å; L851-F984 HydrophobicContact CB-CB 4.31Å; L851-F984 HydrophobicContact CD1-CD1 4.33Å; L851-F984 PolarHBondContact N-O 2.74Å; L851-F984 PolarHBondContact O-N 2.93Å; V854-F984 HydrophobicContact CG2-CD1 4.14Å; I981-F984 HydrophobicContact CG2-CB 3.83Å; I981-F984 HydrophobicContact CG2-CD1 4.43Å; I981-F984 HydrophobicContact CG2-CD2 3.79Å; I981-F984 HydrophobicContact CG2-CE2 4.41Å; I981-F984 HydrophobicContact CG2-CG 3.8Å; N982-F984 VanDerWaalsContact C-N 3.33Å; N982-F984 PolarHBondContact O-N 3.28Å; F984-E988 HydrophobicContact CD2-CB 3.8Å; F984-E988 HydrophobicContact CD2-CG 3.93Å; F984-E988 VanDerWaalsContact CE2-C 3.46Å; F984-E988 HydrophobicContact CE2-CB 3.76Å; F984-E988 HydrophobicContact CE2-CG 3.95Å; F984-E988 WeakPolarHBondContact CE2-O 3.32Å; F984-E988 VanDerWaalsContact CZ-O 3.29Å; F984-E988 WeakPolarHBondContact CZ-O 3.3Å; F984-V990 HydrophobicContact CE2-CG2 4.21Å
985	K	87.1	Confident	91.6	Very high	106 Å²	106	46.4 Å²	46.4	46%	0.461	21%	0.206	S	C	.	.			trans	-79.3	165.3	-173.2	-63.1	-169.2	175	-161.4	0	112.9	N845 M850 D983 D987 E988	N845-K985 VanDerWaalsContact CB-O 3.26Å; N845-K985 WeakPolarHBondContact CB-O 3.37Å; N845-K985 PolarHBondContact ND2-O 3.04Å; M850-K985 HydrophobicContact CG-CG 4.31Å; M850-K985 HydrophobicContact SD-CG 4.45Å; D983-K985 PolarHBondContact O-N 2.76Å; K985-D987 PolarHBondContact O-N 2.05Å; K985-E988 HydrophobicContact CB-CB 4.34Å; K985-E988 PolarHBondContact N-OE2 2.76Å; K985-E988 VanDerWaalsContact O-CB 3.29Å; K985-E988 WeakPolarHBondContact O-CB 3.37Å; K985-E988 PolarHBondContact O-N 2.87Å
986	R	84.2	Confident	91.7	Very high	116 Å²	116	46.4 Å²	46.4	44%	0.438	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	134.2	171.1	178.8	-175.9	175.1	-173	-4.7	110.2	D681 E988	D681-R986 IonicContact OD2-NH1 3.87Å; D681-R986 PolarHBondContact OD2-NH1 3.22Å; R986-E988 PolarHBondContact O-N 3.48Å
987	D	85.4	Confident	91.6	Very high	81 Å²	81	47 Å²	47	43%	0.433	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	3.3	-179.9	-71.8	-55.6	0	0	0	116.3	R844 N845 K985	R844-D987 IonicContact CZ-OD1 3.88Å; R844-D987 IonicContact NE-OD1 2.73Å; R844-D987 IonicContact NH2-OD1 3.65Å; R844-D987 PolarHBondContact NH2-OD1 3.42Å; N845-D987 WeakPolarHBondContact O-CA 3.47Å; N845-D987 PolarHBondContact O-N 2.93Å; K985-D987 PolarHBondContact O-N 2.05Å
988	E	90.1	Very high	91.4	Very high	39 Å²	39	47 Å²	47	18%	0.182	21%	0.208	C	C	.	.			trans	-68.4	145.9	170.8	-167.6	171	-165	0	0	109.9	R844 N845 F984 K985 R986	R844-E988 WeakPolarHBondContact CA-O 2.9Å; N845-E988 PolarHBondContact N-O 3.08Å; F984-E988 HydrophobicContact CD2-CB 3.8Å; F984-E988 HydrophobicContact CD2-CG 3.93Å; F984-E988 VanDerWaalsContact CE2-C 3.46Å; F984-E988 HydrophobicContact CE2-CB 3.76Å; F984-E988 HydrophobicContact CE2-CG 3.95Å; F984-E988 WeakPolarHBondContact CE2-O 3.32Å; F984-E988 VanDerWaalsContact CZ-O 3.29Å; F984-E988 WeakPolarHBondContact CZ-O 3.3Å; K985-E988 HydrophobicContact CB-CB 4.34Å; K985-E988 PolarHBondContact N-OE2 2.76Å; K985-E988 VanDerWaalsContact O-CB 3.29Å; K985-E988 WeakPolarHBondContact O-CB 3.37Å; K985-E988 PolarHBondContact O-N 2.87Å; R986-E988 PolarHBondContact O-N 3.48Å
989	R	93	Very high	91.3	Very high	152 Å²	152	43.5 Å²	43.5	57%	0.574	19%	0.194	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-129.9	147.6	177.9	68.5	178	-178.7	178.3	0.5	111.5	E842 I843 R844	E842-R989 WeakPolarHBondContact OE1-CD 3.33Å; E842-R989 IonicContact OE1-NH1 2.83Å; I843-R989 CarbonylContact O-C 3.13Å; I843-R989 VanDerWaalsContact O-CA 3.25Å; I843-R989 WeakPolarHBondContact O-CA 3.49Å; R844-R989 HydrophobicContact CB-CB 4.45Å
990	V	94	Very high	91	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	130.6	173.1	172.3	0	0	0	0	107.9	E842 I843 E881 V884 I981 F984 L992	E842-V990 WeakPolarHBondContact CA-O 3.26Å; I843-V990 PolarHBondContact N-O 3.3Å; I843-V990 PolarHBondContact O-N 3.08Å; E881-V990 WeakPolarHBondContact O-CA 3.39Å; V884-V990 HydrophobicContact CB-CG1 3.69Å; V884-V990 HydrophobicContact CB-CG2 4.47Å; V884-V990 HydrophobicContact CG1-CG1 3.52Å; V884-V990 HydrophobicContact CG2-CG1 4.14Å; I981-V990 HydrophobicContact CD1-CB 3.99Å; I981-V990 HydrophobicContact CD1-CG1 4.22Å; I981-V990 HydrophobicContact CD1-CG2 3.87Å; I981-V990 HydrophobicContact CG1-CG1 4.46Å; I981-V990 HydrophobicContact CG1-CG2 4.11Å; I981-V990 HydrophobicContact CG2-CG2 3.91Å; F984-V990 HydrophobicContact CE2-CG2 4.21Å; V990-L992 HydrophobicContact CG1-CD2 4.14Å; V990-L992 HydrophobicContact CG1-CG 4.16Å
991	L	94.1	Very high	90.7	Very high	36 Å²	36	40.7 Å²	40.7	19%	0.188	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	129.6	176.1	-67.5	163.7	0	0	0	109.4	V840 Y841 E842 S880 E881	V840-L991 HydrophobicContact CG1-CD2 4.2Å; Y841-L991 CarbonylContact O-C 3.53Å; Y841-L991 WeakPolarHBondContact O-CA 3.43Å; E842-L991 HydrophobicContact CB-CD2 3.66Å; E842-L991 HydrophobicContact CG-CD2 3.82Å; S880-L991 CarbonylContact C-O 3.57Å; S880-L991 WeakPolarHBondContact CA-O 3.22Å; E881-L991 HydrophobicContact CB-CB 4.2Å; E881-L991 PolarHBondContact N-O 3.09Å; E881-L991 PolarHBondContact O-N 3Å
992	L	94.9	Very high	90.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	110.2	178.2	-61.9	177	0	0	0	108.2	V840 Y841 I843 V856 I858 I878 V884 C979 V990	V840-L992 WeakPolarHBondContact CA-O 3.19Å; Y841-L992 PolarHBondContact N-O 3.23Å; Y841-L992 PolarHBondContact O-N 3.07Å; I843-L992 HydrophobicContact CD1-CD1 3.8Å; I843-L992 HydrophobicContact CD1-CG 4.24Å; V856-L992 HydrophobicContact CG1-CD1 4.15Å; I858-L992 HydrophobicContact CD1-CB 4.1Å; I858-L992 HydrophobicContact CD1-CD1 3.67Å; I878-L992 HydrophobicContact CD1-CB 3.9Å; I878-L992 HydrophobicContact CD1-CD2 4.36Å; I878-L992 HydrophobicContact CG1-CB 4.48Å; V884-L992 HydrophobicContact CG1-CD2 3.91Å; V884-L992 HydrophobicContact CG2-CD2 4.3Å; C979-L992 HydrophobicContact CB-CD1 4.31Å; V990-L992 HydrophobicContact CG1-CD2 4.14Å; V990-L992 HydrophobicContact CG1-CG 4.16Å
993	K	94.2	Very high	90.2	Very high	68 Å²	68	37.6 Å²	37.6	30%	0.296	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	123.8	-177.8	176	177.8	-176.6	-115.7	0	110.1	H839 V840 H879 D995	H839-K993 WeakPolarHBondContact O-CA 3.09Å; V840-K993 HydrophobicContact CG2-CB 4.37Å; V840-K993 HydrophobicContact CG2-CG 4.15Å; H879-K993 HydrophobicContact CB-CB 4.24Å; H879-K993 PolarHBondContact N-O 3.3Å; H879-K993 PolarHBondContact O-N 3.37Å; K993-D995 WeakPolarHBondContact CE-OD1 3.42Å; K993-D995 WeakPolarHBondContact CE-OD2 3.29Å; K993-D995 IonicContact NZ-OD1 2.83Å; K993-D995 PolarHBondContact NZ-OD1 3.41Å; K993-D995 IonicContact NZ-OD2 3.09Å; K993-D995 PolarHBondContact NZ-OD2 3.11Å
994	I	93.5	Very high	90.1	Very high	2 Å²	2	35 Å²	35	1%	0.01	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.1	175.8	-58.3	168.3	0	0	0	107.7	S838 H839 I858 W860 L874 I878 W977	S838-I994 WeakPolarHBondContact CA-O 3.08Å; H839-I994 PolarHBondContact N-O 3Å; H839-I994 PolarHBondContact O-N 3.35Å; I858-I994 HydrophobicContact CD1-CD1 4.31Å; I858-I994 HydrophobicContact CG2-CD1 3.65Å; W860-I994 HydrophobicContact CD2-CG2 3.89Å; W860-I994 HydrophobicContact CE3-CB 4.18Å; W860-I994 HydrophobicContact CE3-CD1 3.83Å; W860-I994 HydrophobicContact CE3-CG2 3.8Å; W860-I994 HydrophobicContact CH2-CB 4.19Å; W860-I994 HydrophobicContact CH2-CG2 3.85Å; W860-I994 HydrophobicContact CZ2-CG2 3.94Å; W860-I994 HydrophobicContact CZ3-CB 3.87Å; W860-I994 HydrophobicContact CZ3-CD1 4.18Å; W860-I994 HydrophobicContact CZ3-CG2 3.77Å; L874-I994 HydrophobicContact CD2-CG2 3.7Å; I878-I994 HydrophobicContact CB-CG1 4.32Å; I878-I994 HydrophobicContact CD1-CD1 3.88Å; I878-I994 HydrophobicContact CD1-CG1 3.59Å; I878-I994 HydrophobicContact CG1-CD1 4.47Å; I878-I994 HydrophobicContact CG1-CG1 3.65Å; W977-I994 HydrophobicContact CE3-CD1 4.11Å; W977-I994 HydrophobicContact CH2-CD1 4.38Å; W977-I994 HydrophobicContact CH2-CG2 4.06Å; W977-I994 HydrophobicContact CZ3-CD1 3.89Å
995	D	91.7	Very high	89.8	Confident	18 Å²	18	39.3 Å²	39.3	10%	0.096	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	126.4	177.1	-75.3	-26	0	0	0	109.5	L836 S838 H879 K993	L836-D995 HydrophobicContact CD1-CB 4.13Å; S838-D995 WeakPolarHBondContact CB-OD1 3.32Å; S838-D995 PolarHBondContact OG-OD1 2.94Å; H879-D995 IonicContact CD2-OD2 3.7Å; K993-D995 WeakPolarHBondContact CE-OD1 3.42Å; K993-D995 WeakPolarHBondContact CE-OD2 3.29Å; K993-D995 IonicContact NZ-OD1 2.83Å; K993-D995 PolarHBondContact NZ-OD1 3.41Å; K993-D995 IonicContact NZ-OD2 3.09Å; K993-D995 PolarHBondContact NZ-OD2 3.11Å
996	A	92	Very high	89.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	158.9	177.9	0	0	0	0	0	110.8	L836 V837 W860 L872 Y873 L874	L836-A996 CarbonylContact C-O 3.58Å; L836-A996 WeakPolarHBondContact CA-O 3.33Å; V837-A996 PolarHBondContact N-O 3.08Å; V837-A996 PolarHBondContact O-N 3.1Å; W860-A996 HydrophobicContact CZ2-CB 3.56Å; L872-A996 HydrophobicContact CB-CB 4.12Å; Y873-A996 CarbonylContact O-C 3.58Å; Y873-A996 WeakPolarHBondContact O-CA 3.42Å; Y873-A996 WeakPolarHBondContact O-CB 3.18Å; L874-A996 HydrophobicContact CD2-CB 4.16Å
997	R	91.6	Very high	89	Confident	40 Å²	40	34.4 Å²	34.4	15%	0.151	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	131	171.1	-64.5	-73.7	-176.9	174.6	1	109.6	D830 A833 G834 P835 Y873 T875 W999	D830-R997 HydrophobicContact CB-CG 4.29Å; D830-R997 WeakPolarHBondContact O-CD 3.22Å; D830-R997 WeakPolarHBondContact O-CG 3.44Å; D830-R997 IonicContact OD1-NH2 3.57Å; D830-R997 IonicContact OD2-CZ 2.64Å; D830-R997 IonicContact OD2-NE 2.95Å; D830-R997 PolarHBondContact OD2-NE 2.79Å; D830-R997 IonicContact OD2-NH2 2.77Å; D830-R997 PolarHBondContact OD2-NH2 3.31Å; A833-R997 HydrophobicContact CB-CB 4.25Å; G834-R997 VanDerWaalsContact O-CD 3.27Å; G834-R997 WeakPolarHBondContact O-CD 3.4Å; G834-R997 PolarHBondContact O-NH1 3.25Å; P835-R997 WeakPolarHBondContact O-CA 3.09Å; Y873-R997 WeakPolarHBondContact CB-O 3.01Å; Y873-R997 PolarHBondContact N-O 3.1Å; Y873-R997 PolarHBondContact O-N 3.21Å; T875-R997 HydrophobicContact CG2-CG 3.7Å; R997-W999 PolarHBondContact O-N 2.93Å
998	L	90.9	Very high	88.4	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.005	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	118.4	172.4	-176.6	64.2	0	0	0	109.1	A833 G834 P835 V837 L872 I1000 L1003 I1013 V1044	A833-L998 CarbonylContact C-O 3.49Å; G834-L998 VanDerWaalsContact CA-O 3.3Å; G834-L998 WeakPolarHBondContact CA-O 3.26Å; P835-L998 HydrophobicContact CG-CB 4.11Å; P835-L998 HydrophobicContact CG-CD2 4.16Å; P835-L998 PolarHBondContact O-N 3.01Å; V837-L998 HydrophobicContact CG2-CB 3.8Å; L872-L998 HydrophobicContact CD2-CD1 3.72Å; L998-I1000 PolarHBondContact O-N 3.35Å; L998-I1000 VanDerWaalsContact O-N 3.14Å; L998-L1003 HydrophobicContact CD1-CD1 3.94Å; L998-L1003 HydrophobicContact CD2-CD1 3.73Å; L998-L1003 HydrophobicContact CG-CD1 3.68Å; L998-I1013 HydrophobicContact CD1-CD1 3.81Å; L998-V1044 HydrophobicContact CD1-CG2 4.26Å; L998-V1044 HydrophobicContact CD2-CG1 4.05Å; L998-V1044 HydrophobicContact CD2-CG2 4.04Å
999	W	91.1	Very high	87.3	Confident	23 Å²	23	34.7 Å²	34.7	9%	0.087	15%	0.154	C	C	.	.			trans	-81.5	95.5	-176	-158.3	-91.4	0	0	0	111.5	I827 A833 P870 L871 Y873 E897 L899 R997 N1001 T1002 L1003	I827-W999 HydrophobicContact CD1-CH2 3.99Å; I827-W999 HydrophobicContact CD1-CZ2 3.48Å; I827-W999 VanDerWaalsContact CD1-CZ2 3.48Å; I827-W999 HydrophobicContact CG2-CH2 4.2Å; A833-W999 HydrophobicContact CB-CD2 4.28Å; A833-W999 HydrophobicContact CB-CE3 3.56Å; A833-W999 HydrophobicContact CB-CH2 4.46Å; A833-W999 HydrophobicContact CB-CZ3 3.68Å; P870-W999 HydrophobicContact CB-CB 4.23Å; P870-W999 HydrophobicContact CB-CD2 3.64Å; P870-W999 HydrophobicContact CB-CE3 3.81Å; P870-W999 HydrophobicContact CB-CG 3.84Å; P870-W999 HydrophobicContact CB-CZ3 4.35Å; P870-W999 HydrophobicContact CG-CD2 4.19Å; P870-W999 HydrophobicContact CG-CE3 4.41Å; P870-W999 HydrophobicContact CG-CH2 4.48Å; P870-W999 HydrophobicContact CG-CZ2 4.26Å; P870-W999 WeakPolarHBondContact O-CB 3.23Å; L871-W999 WeakPolarHBondContact O-CB 3.39Å; L871-W999 PolarHBondContact O-N 3.36Å; Y873-W999 HydrophobicContact CD1-CZ3 4.38Å; Y873-W999 AromaticContact CD2-CE3 3.79Å; Y873-W999 HydrophobicContact CD2-CE3 3.79Å; Y873-W999 HydrophobicContact CD2-CH2 4.36Å; Y873-W999 AromaticContact CD2-CZ3 3.43Å; Y873-W999 HydrophobicContact CD2-CZ3 3.43Å; Y873-W999 VanDerWaalsContact CD2-CZ3 3.43Å; Y873-W999 HydrophobicContact CE2-CH2 4.42Å; Y873-W999 AromaticContact CE2-CZ3 3.82Å; Y873-W999 HydrophobicContact CE2-CZ3 3.82Å; Y873-W999 AromaticContact CG-CE3 3.87Å; Y873-W999 HydrophobicContact CG-CE3 3.87Å; Y873-W999 AromaticContact CG-CZ3 3.74Å; Y873-W999 HydrophobicContact CG-CZ3 3.74Å; E897-W999 HydrophobicContact CB-CH2 4.49Å; E897-W999 HydrophobicContact CG-CH2 3.98Å; L899-W999 HydrophobicContact CD1-CH2 4.15Å; L899-W999 HydrophobicContact CD1-CZ3 3.83Å; R997-W999 PolarHBondContact O-N 2.93Å; W999-N1001 VanDerWaalsContact C-N 3.29Å; W999-N1001 PolarHBondContact O-N 2.94Å; W999-T1002 PolarHBondContact O-N 3.26Å; W999-L1003 PolarHBondContact O-N 3.25Å
1000	I	88.8	Confident	86.4	Confident	8 Å²	8	29.7 Å²	29.7	4%	0.041	14%	0.139	C	C	.	.	H	α-helix	trans	-60.5	-38	-172.4	-66.4	171.4	0	0	0	112.2	Y818 E822 A833 L998 T1002 L1003 I1004	Y818-I1000 HydrophobicContact CD2-CG2 4.49Å; E822-I1000 HydrophobicContact CB-CD1 4.08Å; E822-I1000 HydrophobicContact CB-CG2 4.07Å; E822-I1000 WeakPolarHBondContact OE2-CD1 3.5Å; A833-I1000 PolarHBondContact O-N 3.25Å; L998-I1000 PolarHBondContact O-N 3.35Å; L998-I1000 VanDerWaalsContact O-N 3.14Å; I1000-T1002 VanDerWaalsContact C-N 3.28Å; I1000-T1002 PolarHBondContact O-N 2.99Å; I1000-L1003 WeakPolarHBondContact O-CA 3.37Å; I1000-L1003 WeakPolarHBondContact O-CB 3.41Å; I1000-L1003 PolarHBondContact O-N 3.07Å; I1000-I1004 HydrophobicContact CG2-CD1 3.57Å; I1000-I1004 HydrophobicContact CG2-CG1 4.14Å; I1000-I1004 WeakPolarHBondContact O-CG1 3.15Å; I1000-I1004 PolarHBondContact O-N 3.1Å
1001	N	89.1	Confident	85.8	Confident	14 Å²	14	29.7 Å²	29.7	8%	0.075	14%	0.139	C	C	.	.	H	α-helix	trans	-58.5	-40.5	-179.6	-71.3	7.9	0	0	0	112.2	Y823 R824 W999 L1003 I1004 E1005	Y823-N1001 HydrophobicContact CD2-CB 4.22Å; Y823-N1001 HydrophobicContact CE2-CB 4Å; R824-N1001 PolarHBondContact N-OD1 3.15Å; R824-N1001 PolarHBondContact O-ND2 3.27Å; R824-N1001 PolarHBondContact O-OD1 3.22Å; W999-N1001 VanDerWaalsContact C-N 3.29Å; W999-N1001 PolarHBondContact O-N 2.94Å; N1001-L1003 VanDerWaalsContact C-N 3.3Å; N1001-L1003 PolarHBondContact O-N 3.03Å; N1001-I1004 PolarHBondContact O-N 3.41Å; N1001-E1005 VanDerWaalsContact O-CB 3.31Å; N1001-E1005 WeakPolarHBondContact O-CB 3.18Å; N1001-E1005 VanDerWaalsContact O-CG 3.25Å; N1001-E1005 WeakPolarHBondContact O-CG 3.31Å; N1001-E1005 PolarHBondContact O-N 3.13Å
1002	T	87.9	Confident	85.4	Confident	4 Å²	4	31.1 Å²	31.1	3%	0.025	15%	0.145	C	C	.	.	H	α-helix	trans	-67.5	-36.2	178.4	-62.1	0	0	0	0	110.5	F864 P870 L871 W999 I1000 I1004 E1006	F864-T1002 HydrophobicContact CB-CG2 3.84Å; F864-T1002 HydrophobicContact CG-CG2 4.3Å; P870-T1002 WeakPolarHBondContact O-CB 3.32Å; P870-T1002 PolarHBondContact O-OG1 3.2Å; L871-T1002 HydrophobicContact CD1-CG2 4.31Å; W999-T1002 PolarHBondContact O-N 3.26Å; I1000-T1002 VanDerWaalsContact C-N 3.28Å; I1000-T1002 PolarHBondContact O-N 2.99Å; T1002-I1004 VanDerWaalsContact C-N 3.34Å; T1002-I1004 PolarHBondContact O-N 3.4Å; T1002-E1006 HydrophobicContact CG2-CG 4.3Å; T1002-E1006 WeakPolarHBondContact O-CB 3.43Å; T1002-E1006 WeakPolarHBondContact O-CG 3.46Å; T1002-E1006 PolarHBondContact O-N 2.86Å; T1002-E1006 VanDerWaalsContact O-N 3.11Å
1003	L	85.1	Confident	85.1	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.4	-40.9	176.1	-62.7	173	0	0	0	112.5	Y818 L871 L998 W999 I1000 N1001 V1007 F1008 I1013 V1044	Y818-L1003 HydrophobicContact CD1-CD1 4.14Å; Y818-L1003 HydrophobicContact CE1-CB 4.3Å; Y818-L1003 HydrophobicContact CE1-CD1 4.35Å; Y818-L1003 HydrophobicContact CE2-CB 4.11Å; Y818-L1003 HydrophobicContact CG-CD1 4.39Å; L871-L1003 HydrophobicContact CD1-CD2 4.25Å; L998-L1003 HydrophobicContact CD1-CD1 3.94Å; L998-L1003 HydrophobicContact CD2-CD1 3.73Å; L998-L1003 HydrophobicContact CG-CD1 3.68Å; W999-L1003 PolarHBondContact O-N 3.25Å; I1000-L1003 WeakPolarHBondContact O-CA 3.37Å; I1000-L1003 WeakPolarHBondContact O-CB 3.41Å; I1000-L1003 PolarHBondContact O-N 3.07Å; N1001-L1003 VanDerWaalsContact C-N 3.3Å; N1001-L1003 PolarHBondContact O-N 3.03Å; L1003-V1007 PolarHBondContact O-N 3.25Å; L1003-F1008 HydrophobicContact CD2-CB 4.36Å; L1003-F1008 HydrophobicContact CD2-CD2 3.9Å; L1003-F1008 HydrophobicContact CD2-CE2 4.31Å; L1003-F1008 HydrophobicContact CD2-CG 4.28Å; L1003-F1008 PolarHBondContact O-N 2.95Å; L1003-F1008 VanDerWaalsContact O-N 3.08Å; L1003-I1013 HydrophobicContact CD2-CD1 4.49Å; L1003-V1044 HydrophobicContact CD1-CG1 3.57Å; L1003-V1044 HydrophobicContact CD2-CG1 4.2Å; L1003-V1044 HydrophobicContact CG-CG1 4.5Å
1004	I	84.3	Confident	84.8	Confident	27 Å²	27	28 Å²	28	14%	0.138	13%	0.132	C	C	.	.	H	α-helix	trans	-74.2	-46.4	179.7	-68.1	173.3	0	0	0	111.6	Y818 F820 Y823 I1000 N1001 T1002 V1007	Y818-I1004 HydrophobicContact CD2-CG1 4.16Å; Y818-I1004 HydrophobicContact CE2-CG1 3.86Å; F820-I1004 HydrophobicContact CD1-CB 4.4Å; F820-I1004 HydrophobicContact CD1-CG1 3.97Å; F820-I1004 HydrophobicContact CD1-CG2 3.96Å; F820-I1004 HydrophobicContact CE1-CG1 4.44Å; F820-I1004 HydrophobicContact CE1-CG2 4.48Å; Y823-I1004 HydrophobicContact CD2-CB 4.37Å; Y823-I1004 HydrophobicContact CD2-CD1 4.31Å; Y823-I1004 HydrophobicContact CD2-CG2 4.1Å; I1000-I1004 HydrophobicContact CG2-CD1 3.57Å; I1000-I1004 HydrophobicContact CG2-CG1 4.14Å; I1000-I1004 WeakPolarHBondContact O-CG1 3.15Å; I1000-I1004 PolarHBondContact O-N 3.1Å; N1001-I1004 PolarHBondContact O-N 3.41Å; T1002-I1004 VanDerWaalsContact C-N 3.34Å; T1002-I1004 PolarHBondContact O-N 3.4Å; I1004-V1007 PolarHBondContact O-N 3.13Å
1005	E	83.2	Confident	84.8	Confident	91 Å²	91	28 Å²	28	43%	0.425	13%	0.133	S	C	.	.	H	α-helix	trans	-63	-41.7	-178.6	-78.3	179.3	-164.7	0	0	112.6	Y823 K869 N1001 V1007	Y823-E1005 HydrophobicContact CE2-CG 4.38Å; K869-E1005 IonicContact NZ-OE2 2.87Å; K869-E1005 PolarHBondContact NZ-OE2 3.06Å; N1001-E1005 VanDerWaalsContact O-CB 3.31Å; N1001-E1005 WeakPolarHBondContact O-CB 3.18Å; N1001-E1005 VanDerWaalsContact O-CG 3.25Å; N1001-E1005 WeakPolarHBondContact O-CG 3.31Å; N1001-E1005 PolarHBondContact O-N 3.13Å; E1005-V1007 VanDerWaalsContact C-N 3.32Å
1006	E	80.4	Confident	84.9	Confident	64 Å²	64	28.8 Å²	28.8	30%	0.299	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-0.5	-179.2	-57.4	-65.2	151	0	0	112.5	F864 K869 T1002 F1008	F864-E1006 HydrophobicContact CD1-CG 3.73Å; F864-E1006 HydrophobicContact CE1-CB 4.19Å; F864-E1006 VanDerWaalsContact CE1-CD 3.46Å; F864-E1006 HydrophobicContact CE1-CG 3.54Å; F864-E1006 WeakPolarHBondContact CE1-OE2 3.39Å; F864-E1006 HydrophobicContact CZ-CB 4.47Å; F864-E1006 HydrophobicContact CZ-CG 4.28Å; K869-E1006 IonicContact NZ-OE1 2.72Å; K869-E1006 PolarHBondContact NZ-OE1 3.18Å; T1002-E1006 HydrophobicContact CG2-CG 4.3Å; T1002-E1006 WeakPolarHBondContact O-CB 3.43Å; T1002-E1006 WeakPolarHBondContact O-CG 3.46Å; T1002-E1006 PolarHBondContact O-N 2.86Å; T1002-E1006 VanDerWaalsContact O-N 3.11Å; E1006-F1008 HydrophobicContact CB-CD2 3.83Å; E1006-F1008 HydrophobicContact CB-CE2 3.53Å; E1006-F1008 HydrophobicContact CB-CZ 4.32Å; E1006-F1008 HydrophobicContact CG-CE2 4.26Å
1007	V	74.1	Confident	84.9	Confident	54 Å²	54	28.8 Å²	28.8	33%	0.327	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	55.9	172.3	-158	0	0	0	0	113.1	L1003 I1004 E1005 Y1009 I1052	L1003-V1007 PolarHBondContact O-N 3.25Å; I1004-V1007 PolarHBondContact O-N 3.13Å; E1005-V1007 VanDerWaalsContact C-N 3.32Å; V1007-Y1009 HydrophobicContact CB-CE2 4.37Å; V1007-Y1009 HydrophobicContact CG1-CD2 4.14Å; V1007-Y1009 HydrophobicContact CG1-CE1 4.17Å; V1007-Y1009 HydrophobicContact CG1-CE2 3.35Å; V1007-Y1009 WeakPolarHBondContact CG1-OH 3.42Å; V1007-Y1009 WeakPolarHBondContact O-CD2 3.41Å; V1007-Y1009 PolarHBondContact O-N 2.92Å; V1007-I1052 HydrophobicContact CG1-CD1 4.13Å
1008	F	72.9	Confident	85.1	Confident	5 Å²	5	29.5 Å²	29.5	2%	0.022	14%	0.144	C	C	.	.			trans	-78.5	99.7	179.3	-73.8	-82.5	0	0	0	112.7	Y818 F864 I965 V967 L1003 E1006 A1011	Y818-F1008 PolarHBondContact OH-O 3.43Å; F864-F1008 HydrophobicContact CD2-CE2 4.36Å; F864-F1008 AromaticContact CD2-CZ 3.69Å; F864-F1008 HydrophobicContact CD2-CZ 3.69Å; F864-F1008 HydrophobicContact CE2-CE1 4.1Å; F864-F1008 HydrophobicContact CE2-CE2 4.23Å; F864-F1008 AromaticContact CE2-CZ 3.35Å; F864-F1008 HydrophobicContact CE2-CZ 3.35Å; F864-F1008 AromaticContact CZ-CZ 3.9Å; F864-F1008 HydrophobicContact CZ-CZ 3.9Å; I965-F1008 HydrophobicContact CD1-CD1 4.39Å; I965-F1008 HydrophobicContact CG2-CE1 4.19Å; V967-F1008 HydrophobicContact CG2-CE1 3.69Å; V967-F1008 HydrophobicContact CG2-CZ 4.23Å; L1003-F1008 HydrophobicContact CD2-CB 4.36Å; L1003-F1008 HydrophobicContact CD2-CD2 3.9Å; L1003-F1008 HydrophobicContact CD2-CE2 4.31Å; L1003-F1008 HydrophobicContact CD2-CG 4.28Å; L1003-F1008 PolarHBondContact O-N 2.95Å; L1003-F1008 VanDerWaalsContact O-N 3.08Å; E1006-F1008 HydrophobicContact CB-CD2 3.83Å; E1006-F1008 HydrophobicContact CB-CE2 3.53Å; E1006-F1008 HydrophobicContact CB-CZ 4.32Å; E1006-F1008 HydrophobicContact CG-CE2 4.26Å; F1008-A1011 HydrophobicContact CB-CB 4.09Å; F1008-A1011 HydrophobicContact CD1-CB 3.57Å; F1008-A1011 HydrophobicContact CE1-CB 4.25Å; F1008-A1011 HydrophobicContact CG-CB 4.12Å
1009	Y	66.6	Low	85.2	Confident	121 Å²	121	29.5 Å²	29.5	48%	0.475	14%	0.144	S	C	.	.	S	Bend	trans	-78.4	-29.5	179.7	-66.6	-77	0	0	0	115.1	V1007 P1046 I1052	V1007-Y1009 HydrophobicContact CB-CE2 4.37Å; V1007-Y1009 HydrophobicContact CG1-CD2 4.14Å; V1007-Y1009 HydrophobicContact CG1-CE1 4.17Å; V1007-Y1009 HydrophobicContact CG1-CE2 3.35Å; V1007-Y1009 WeakPolarHBondContact CG1-OH 3.42Å; V1007-Y1009 WeakPolarHBondContact O-CD2 3.41Å; V1007-Y1009 PolarHBondContact O-N 2.92Å; Y1009-P1046 HydrophobicContact CD1-CG 4.45Å; Y1009-P1046 WeakPolarHBondContact O-CD 3.46Å; Y1009-I1052 HydrophobicContact CE1-CD1 4.36Å
1010	D	74.5	Confident	85.2	Confident	47 Å²	47	32.9 Å²	32.9	25%	0.251	16%	0.161	S	C	.	.	S	Bend	trans	-160.7	102.1	174	-174.6	-19.5	0	0	0	106.9	R964 I965	R964-D1010 WeakPolarHBondContact CD-OD1 3.45Å; R964-D1010 HydrophobicContact CG-CB 4.45Å; R964-D1010 WeakPolarHBondContact CG-OD1 3.44Å; R964-D1010 WeakPolarHBondContact CG-OD2 3.45Å; R964-D1010 IonicContact CZ-OD1 2.77Å; R964-D1010 IonicContact CZ-OD2 2.9Å; R964-D1010 IonicContact NE-OD1 2.88Å; R964-D1010 PolarHBondContact NE-OD1 3.05Å; R964-D1010 VanDerWaalsContact NE-OD1 3.09Å; R964-D1010 IonicContact NE-OD2 3.75Å; R964-D1010 PolarHBondContact NE-OD2 3.38Å; R964-D1010 IonicContact NH2-OD2 3.95Å; I965-D1010 PolarHBondContact N-O 2.99Å; I965-D1010 VanDerWaalsContact N-O 3.07Å
1011	A	80.6	Confident	85.2	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	135.7	-175.9	0	0	0	0	0	111.6	I965 F1008 I1043 V1044	I965-A1011 WeakPolarHBondContact O-CA 3.07Å; F1008-A1011 HydrophobicContact CB-CB 4.09Å; F1008-A1011 HydrophobicContact CD1-CB 3.57Å; F1008-A1011 HydrophobicContact CE1-CB 4.25Å; F1008-A1011 HydrophobicContact CG-CB 4.12Å; A1011-I1043 WeakPolarHBondContact O-CA 3.33Å; A1011-V1044 PolarHBondContact N-O 3.3Å; A1011-V1044 VanDerWaalsContact N-O 3.15Å; A1011-V1044 PolarHBondContact O-N 3.22Å
1012	M	85.4	Confident	85.1	Confident	66 Å²	66	34.7 Å²	34.7	33%	0.325	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	101.5	173.9	-174.3	173.1	-175	0	0	108.1	I965 V967 S1041	I965-M1012 PolarHBondContact O-N 3.44Å; V967-M1012 PolarHBondContact N-O 3.47Å; M1012-S1041 WeakPolarHBondContact CE-OG 3.37Å
1013	I	88.4	Confident	84.9	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	114.4	179.8	-52.4	175.1	0	0	0	108	P861 L871 L872 V967 L998 L1003 S1041 T1042 V1044	P861-I1013 HydrophobicContact CB-CG2 4.42Å; P861-I1013 HydrophobicContact CG-CG2 3.59Å; L871-I1013 HydrophobicContact CD1-CD1 4.05Å; L871-I1013 HydrophobicContact CD2-CD1 4.36Å; L871-I1013 HydrophobicContact CD2-CG2 4.1Å; L871-I1013 HydrophobicContact CG-CD1 4.23Å; L872-I1013 HydrophobicContact CD1-CG2 3.67Å; L872-I1013 HydrophobicContact CG-CG2 4.05Å; V967-I1013 HydrophobicContact CB-CG1 4.29Å; V967-I1013 WeakPolarHBondContact O-CA 3.3Å; L998-I1013 HydrophobicContact CD1-CD1 3.81Å; L1003-I1013 HydrophobicContact CD2-CD1 4.49Å; I1013-S1041 CarbonylContact O-C 3.21Å; I1013-S1041 VanDerWaalsContact O-CA 3.28Å; I1013-S1041 WeakPolarHBondContact O-CA 3.32Å; I1013-T1042 PolarHBondContact N-O 2.8Å; I1013-T1042 PolarHBondContact O-N 3Å; I1013-V1044 HydrophobicContact CD1-CG2 3.89Å; I1013-V1044 HydrophobicContact CG1-CG2 4.41Å
1014	S	89.8	Confident	84.5	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.021	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	131.6	-172.9	-60.7	0	0	0	0	111.7	V967 V1040 S1041	V967-S1014 PolarHBondContact O-N 2.77Å; S1014-V1040 CarbonylContact C-O 3.53Å; S1014-V1040 VanDerWaalsContact CA-O 3.32Å; S1014-V1040 WeakPolarHBondContact CA-O 3.44Å; S1014-S1041 PolarHBondContact OG-OG 3.21Å
1015	S	92	Very high	83.7	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.014	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	158.9	164	65.9	0	0	0	0	109.8	H839 Y841 Y859 V1039 V1040	H839-S1015 PolarHBondContact CE1-OG 2.88Å; H839-S1015 PolarHBondContact ND1-OG 2.96Å; Y841-S1015 WeakPolarHBondContact OH-CB 3.38Å; Y841-S1015 PolarHBondContact OH-O 3.28Å; Y841-S1015 VanDerWaalsContact OH-O 3.09Å; Y841-S1015 PolarHBondContact OH-OG 3.03Å; Y859-S1015 WeakPolarHBondContact O-CA 3.49Å; Y859-S1015 WeakPolarHBondContact O-CB 3.38Å; S1015-V1039 WeakPolarHBondContact O-CA 3.48Å; S1015-V1040 PolarHBondContact N-O 3.41Å; S1015-V1040 PolarHBondContact O-N 3.19Å
1016	V	93.4	Very high	83	Confident	34 Å²	34	40.5 Å²	40.5	21%	0.206	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	135.3	-178.9	60.3	0	0	0	0	111.1	Y841 I858 Y859 I1018 A1038 V1039	Y841-V1016 PolarHBondContact OH-N 2.74Å; I858-V1016 CarbonylContact C-O 3.49Å; I858-V1016 WeakPolarHBondContact CA-O 3.23Å; Y859-V1016 HydrophobicContact CD2-CG1 3.97Å; Y859-V1016 HydrophobicContact CG-CG1 4.24Å; Y859-V1016 PolarHBondContact N-O 3.38Å; Y859-V1016 PolarHBondContact O-N 3.19Å; Y859-V1016 VanDerWaalsContact O-N 3.07Å; V1016-I1018 HydrophobicContact CG2-CG1 4.08Å; V1016-A1038 WeakPolarHBondContact CA-O 3.47Å; V1016-V1039 HydrophobicContact CB-CG2 4.41Å; V1016-V1039 HydrophobicContact CG2-CG2 4.08Å
1017	A	93.7	Very high	81.9	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.9	168.3	0	0	0	0	0	109.2	V807 Y841 D857 I858 Y1037 A1038	V807-A1017 HydrophobicContact CG1-CB 4.32Å; Y841-A1017 HydrophobicContact CD1-CB 3.37Å; Y841-A1017 HydrophobicContact CD2-CB 4.32Å; Y841-A1017 HydrophobicContact CE1-CB 3.37Å; Y841-A1017 HydrophobicContact CE2-CB 4.34Å; Y841-A1017 HydrophobicContact CG-CB 3.85Å; D857-A1017 WeakPolarHBondContact O-CA 3.27Å; I858-A1017 HydrophobicContact CG1-CB 3.92Å; A1017-Y1037 CarbonylContact O-C 3.48Å; A1017-Y1037 WeakPolarHBondContact O-CA 3.28Å; A1017-Y1037 WeakPolarHBondContact O-CB 3.11Å; A1017-A1038 PolarHBondContact N-O 3.14Å; A1017-A1038 PolarHBondContact O-N 2.81Å
1018	I	94.4	Very high	81.2	Confident	55 Å²	55	50.8 Å²	50.8	28%	0.282	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	126.6	177.8	-54.1	179.3	0	0	0	107.3	V856 D857 Y859 V1016 L1035	V856-I1018 CarbonylContact C-O 3.56Å; V856-I1018 VanDerWaalsContact CA-O 3.3Å; V856-I1018 WeakPolarHBondContact CA-O 3.36Å; D857-I1018 PolarHBondContact N-O 2.83Å; D857-I1018 PolarHBondContact O-N 2.04Å; Y859-I1018 HydrophobicContact CD2-CD1 4.42Å; Y859-I1018 HydrophobicContact CE2-CD1 3.96Å; V1016-I1018 HydrophobicContact CG2-CG1 4.08Å; I1018-L1035 HydrophobicContact CG2-CD1 4.2Å; I1018-L1035 HydrophobicContact CG2-CD2 4.15Å; I1018-L1035 HydrophobicContact CG2-CG 4.2Å
1019	A	93.2	Very high	80.3	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.008	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	136.5	178.9	0	0	0	0	0	111	F805 V807 V854 S855 V856 R1036	F805-A1019 HydrophobicContact CE2-CB 3.71Å; F805-A1019 HydrophobicContact CZ-CB 4.36Å; F805-A1019 WeakPolarHBondContact CZ-O 3.37Å; V807-A1019 HydrophobicContact CG2-CB 3.59Å; V854-A1019 HydrophobicContact CG1-CB 4.44Å; S855-A1019 CarbonylContact O-C 3.58Å; S855-A1019 VanDerWaalsContact O-CA 3.27Å; S855-A1019 WeakPolarHBondContact O-CA 3.12Å; V856-A1019 HydrophobicContact CB-CB 4.38Å; V856-A1019 HydrophobicContact CG1-CB 4.29Å; V856-A1019 HydrophobicContact CG2-CB 3.81Å; A1019-R1036 PolarHBondContact N-O 2.91Å; A1019-R1036 PolarHBondContact O-N 3.25Å
1020	E	92	Very high	80.1	Confident	94 Å²	94	56.9 Å²	56.9	44%	0.439	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	138.2	-177.4	-178.8	-179.7	-171.4	0	0	109.8	V854 S855 T1022	V854-E1020 CarbonylContact C-O 3.59Å; V854-E1020 WeakPolarHBondContact CA-O 3.37Å; V854-E1020 WeakPolarHBondContact CG1-O 3.47Å; S855-E1020 PolarHBondContact N-O 3.23Å; S855-E1020 PolarHBondContact O-N 2.85Å; E1020-T1022 PolarHBondContact O-N 2.95Å
1021	V	88.6	Confident	79.6	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	120.4	171.9	-173.7	0	0	0	0	108.6	F805 L851 V854 L1024 L1033 P1034	F805-V1021 HydrophobicContact CD1-CG2 3.95Å; F805-V1021 HydrophobicContact CE1-CG2 3.54Å; F805-V1021 HydrophobicContact CZ-CG2 4.36Å; L851-V1021 HydrophobicContact CB-CG1 4.41Å; L851-V1021 HydrophobicContact CD1-CG2 3.9Å; L851-V1021 HydrophobicContact CD2-CG1 4.26Å; V854-V1021 HydrophobicContact CG2-CG2 4.29Å; V1021-L1024 HydrophobicContact CG1-CD2 4.05Å; V1021-L1024 HydrophobicContact CG1-CG 4.44Å; V1021-L1033 HydrophobicContact CB-CB 4.29Å; V1021-L1033 HydrophobicContact CB-CD2 4.24Å; V1021-L1033 HydrophobicContact CG1-CD2 4.1Å; V1021-L1033 WeakPolarHBondContact O-CD1 3.15Å; V1021-P1034 HydrophobicContact CG2-CG 4.37Å
1022	T	86.5	Confident	79	Confident	60 Å²	60	63.7 Å²	63.7	37%	0.368	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	-26.3	-179.2	53.4	0	0	0	0	112.5	E853 E1020	E853-T1022 VanDerWaalsContact CB-OG1 3.31Å; E853-T1022 WeakPolarHBondContact CB-OG1 3.5Å; E853-T1022 VanDerWaalsContact CD-OG1 3.31Å; E853-T1022 VanDerWaalsContact CG-OG1 3.22Å; E853-T1022 WeakPolarHBondContact CG-OG1 3.47Å; E853-T1022 PolarHBondContact O-N 3.41Å; E853-T1022 PolarHBondContact O-OG1 2.79Å; E853-T1022 PolarHBondContact OE1-OG1 3.4Å; E1020-T1022 PolarHBondContact O-N 2.95Å
1023	K	83	Confident	78.5	Confident	126 Å²	126	63.6 Å²	63.6	55%	0.548	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	135.9	-178.4	-163.7	179.5	178.1	-173.3	0	112.4	S852 E853	S852-K1023 WeakPolarHBondContact CB-O 3.3Å; S852-K1023 PolarHBondContact N-O 2.95Å; S852-K1023 VanDerWaalsContact N-O 3.11Å; E853-K1023 HydrophobicContact CB-CB 3.66Å; E853-K1023 PolarHBondContact N-O 2.83Å; E853-K1023 VanDerWaalsContact N-O 3.12Å; E853-K1023 PolarHBondContact O-N 2.99Å
1024	L	78.3	Confident	78.1	Confident	27 Å²	27	64.5 Å²	64.5	14%	0.141	34%	0.335	C	S	.	.			trans	-108.2	154.2	168.9	-67.8	173.1	0	0	0	110.3	V801 L851 V1021 Y1026 I1031 L1033	V801-L1024 HydrophobicContact CG1-CD1 3.98Å; V801-L1024 HydrophobicContact CG1-CD2 4.17Å; L851-L1024 HydrophobicContact CD2-CD2 3.63Å; V1021-L1024 HydrophobicContact CG1-CD2 4.05Å; V1021-L1024 HydrophobicContact CG1-CG 4.44Å; L1024-Y1026 PolarHBondContact O-N 3.03Å; L1024-I1031 HydrophobicContact CD1-CD1 4.22Å; L1024-I1031 HydrophobicContact CD1-CG2 4.45Å; L1024-L1033 HydrophobicContact CD1-CD2 3.54Å; L1024-L1033 HydrophobicContact CD2-CD2 4.45Å; L1024-L1033 HydrophobicContact CG-CD2 3.86Å
1025	P	67.5	Low	77.9	Confident	41 Å²	41	68.6 Å²	68.6	27%	0.266	36%	0.356	S	S	.	.	S	Bend	trans	-66.9	-16.1	178.5	16	-22.2	0	0	0	113.6	M850 S852	M850-P1025 VanDerWaalsContact O-CD 3.31Å; M850-P1025 WeakPolarHBondContact O-CD 3.43Å; M850-P1025 WeakPolarHBondContact O-CG 3.43Å; S852-P1025 VanDerWaalsContact OG-CA 3.29Å; S852-P1025 WeakPolarHBondContact OG-CA 3.02Å; S852-P1025 VanDerWaalsContact OG-CD 3.27Å; S852-P1025 WeakPolarHBondContact OG-CD 3.23Å
1026	Y	67.4	Low	77.9	Confident	50 Å²	50	73.1 Å²	73.1	20%	0.196	37%	0.373	C	S	.	.	S	Bend	trans	-121.3	143.3	-177.2	-46.4	-79.4	0	0	0	111.1	I678 V801 L1024 H1028	I678-Y1026 HydrophobicContact CB-CE2 4.33Å; I678-Y1026 HydrophobicContact CD1-CD1 4.43Å; I678-Y1026 HydrophobicContact CD1-CD2 3.55Å; I678-Y1026 HydrophobicContact CD1-CE1 4.33Å; I678-Y1026 HydrophobicContact CD1-CE2 3.43Å; I678-Y1026 VanDerWaalsContact CD1-CE2 3.43Å; I678-Y1026 HydrophobicContact CD1-CG 4.07Å; I678-Y1026 HydrophobicContact CG1-CE2 4.44Å; I678-Y1026 HydrophobicContact CG2-CE2 3.61Å; I678-Y1026 WeakPolarHBondContact CG2-OH 3.46Å; V801-Y1026 HydrophobicContact CG2-CD2 4.07Å; L1024-Y1026 PolarHBondContact O-N 3.03Å; Y1026-H1028 PolarHBondContact O-N 3.44Å
1027	K	57.2	Low	77.9	Confident	217 Å²	217	79.1 Å²	79.1	94%	0.943	39%	0.393	S	S	*	.			trans	-84.4	94.6	171	-69.5	-179.1	179.6	178.3	0	108.6
1028	H	60.1	Low	77.8	Confident	117 Å²	117	79.6 Å²	79.6	54%	0.542	40%	0.397	S	S	.	.			trans	-110.6	126.5	168.5	-158.8	54.1	0	0	0	109.7	Y1026 D1030 I1031	Y1026-H1028 PolarHBondContact O-N 3.44Å; H1028-D1030 VanDerWaalsContact C-N 3.33Å; H1028-D1030 PolarHBondContact O-N 2.84Å; H1028-I1031 HydrophobicContact CB-CD1 3.8Å; H1028-I1031 HydrophobicContact CB-CG1 4.16Å
1029	P	54.8	Low	77.7	Confident	110 Å²	110	80.4 Å²	80.4	71%	0.714	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-11.7	-166.4	23.8	-31.6	0	0	0	116.3
1030	D	61.4	Low	77.6	Confident	144 Å²	144	80.5 Å²	80.5	77%	0.77	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.1	25.9	-167.9	-66.7	-45.8	0	0	0	116.1	H1028	H1028-D1030 VanDerWaalsContact C-N 3.33Å; H1028-D1030 PolarHBondContact O-N 2.84Å
1031	I	63.5	Low	77.5	Confident	55 Å²	55	77.3 Å²	77.3	28%	0.282	39%	0.393	S	S	.	.			trans	-95.6	118.2	-178.5	-55.6	-178.1	0	0	0	111.8	V801 L1024 H1028 L1033	V801-I1031 HydrophobicContact CB-CD1 3.74Å; V801-I1031 HydrophobicContact CG1-CD1 4.18Å; V801-I1031 HydrophobicContact CG2-CD1 4.39Å; L1024-I1031 HydrophobicContact CD1-CD1 4.22Å; L1024-I1031 HydrophobicContact CD1-CG2 4.45Å; H1028-I1031 HydrophobicContact CB-CD1 3.8Å; H1028-I1031 HydrophobicContact CB-CG1 4.16Å; I1031-L1033 HydrophobicContact CG2-CD2 4.33Å; I1031-L1033 PolarHBondContact O-N 3.33Å
1032	T	69	Low	77.6	Confident	135 Å²	135	77.4 Å²	77.4	83%	0.828	39%	0.394	S	S	*	.			trans	-73.5	113	164.3	51.2	0	0	0	0	110
1033	L	75	Confident	77.7	Confident	63 Å²	63	76.1 Å²	76.1	33%	0.33	38%	0.384	S	S	.	.			trans	-73.5	133.5	-178.5	-63.1	170.8	0	0	0	110.6	V1021 L1024 I1031	V1021-L1033 HydrophobicContact CB-CB 4.29Å; V1021-L1033 HydrophobicContact CB-CD2 4.24Å; V1021-L1033 HydrophobicContact CG1-CD2 4.1Å; V1021-L1033 WeakPolarHBondContact O-CD1 3.15Å; L1024-L1033 HydrophobicContact CD1-CD2 3.54Å; L1024-L1033 HydrophobicContact CD2-CD2 4.45Å; L1024-L1033 HydrophobicContact CG-CD2 3.86Å; I1031-L1033 HydrophobicContact CG2-CD2 4.33Å; I1031-L1033 PolarHBondContact O-N 3.33Å
1034	P	78.8	Confident	77.9	Confident	21 Å²	21	70.1 Å²	70.1	14%	0.136	36%	0.358	C	S	.	.			trans	-71.4	138.4	-177.8	18	-19	0	0	0	111.9	A803 F805 V1021	A803-P1034 HydrophobicContact CB-CG 3.92Å; A803-P1034 WeakPolarHBondContact O-CG 3.38Å; F805-P1034 HydrophobicContact CD1-CG 4.18Å; F805-P1034 HydrophobicContact CE1-CB 3.98Å; F805-P1034 HydrophobicContact CE1-CG 3.82Å; F805-P1034 VanDerWaalsContact CE1-O 3.29Å; F805-P1034 WeakPolarHBondContact CE1-O 3.28Å; F805-P1034 WeakPolarHBondContact CZ-O 3.42Å; V1021-P1034 HydrophobicContact CG2-CG 4.37Å
1035	L	87.3	Confident	78.2	Confident	89 Å²	89	70.7 Å²	70.7	47%	0.466	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	137.1	167.1	-175.5	149.2	0	0	0	109.1	I1018	I1018-L1035 HydrophobicContact CG2-CD1 4.2Å; I1018-L1035 HydrophobicContact CG2-CD2 4.15Å; I1018-L1035 HydrophobicContact CG2-CG 4.2Å
1036	R	91.2	Very high	78.7	Confident	97 Å²	97	69.3 Å²	69.3	37%	0.366	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	153.6	177.5	-62.7	-70.1	-174.7	-99.9	0.6	109.7	D804 F805 V807 A1019	D804-R1036 IonicContact OD1-NH2 3.57Å; F805-R1036 HydrophobicContact CD2-CB 4.33Å; F805-R1036 HydrophobicContact CD2-CG 4.09Å; F805-R1036 HydrophobicContact CE1-CG 4.2Å; F805-R1036 HydrophobicContact CE2-CB 3.62Å; F805-R1036 HydrophobicContact CE2-CG 3.64Å; F805-R1036 HydrophobicContact CZ-CB 3.94Å; F805-R1036 HydrophobicContact CZ-CG 3.7Å; F805-R1036 WeakPolarHBondContact O-CG 3.06Å; F805-R1036 PolarHBondContact O-NE 2.89Å; V807-R1036 HydrophobicContact CB-CB 4.43Å; V807-R1036 HydrophobicContact CG2-CB 3.78Å; A1019-R1036 PolarHBondContact N-O 2.91Å; A1019-R1036 PolarHBondContact O-N 3.25Å
1037	Y	93	Very high	78.8	Confident	159 Å²	159	69.7 Å²	69.7	62%	0.624	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.7	154.1	175.9	67.4	-87.4	0	0	0	111.1	A1017 V1039	A1017-Y1037 CarbonylContact O-C 3.48Å; A1017-Y1037 WeakPolarHBondContact O-CA 3.28Å; A1017-Y1037 WeakPolarHBondContact O-CB 3.11Å; Y1037-V1039 HydrophobicContact CD2-CG2 4.21Å; Y1037-V1039 HydrophobicContact CE2-CG2 4.36Å
1038	A	92	Very high	79.1	Confident	10 Å²	10	61.6 Å²	61.6	8%	0.083	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	140.6	170.7	0	0	0	0	0	109.8	V807 Y841 V1016 A1017	V807-A1038 HydrophobicContact CB-CB 4.26Å; V807-A1038 HydrophobicContact CG1-CB 3.63Å; Y841-A1038 HydrophobicContact CD1-CB 4.14Å; Y841-A1038 HydrophobicContact CE1-CB 4.11Å; V1016-A1038 WeakPolarHBondContact CA-O 3.47Å; A1017-A1038 PolarHBondContact N-O 3.14Å; A1017-A1038 PolarHBondContact O-N 2.81Å
1039	V	91.9	Very high	78.9	Confident	72 Å²	72	59.9 Å²	59.9	44%	0.436	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	123.3	174.5	-178.7	0	0	0	0	107.9	S1015 V1016 Y1037	S1015-V1039 WeakPolarHBondContact O-CA 3.48Å; V1016-V1039 HydrophobicContact CB-CG2 4.41Å; V1016-V1039 HydrophobicContact CG2-CG2 4.08Å; Y1037-V1039 HydrophobicContact CD2-CG2 4.21Å; Y1037-V1039 HydrophobicContact CE2-CG2 4.36Å
1040	V	91.9	Very high	78.8	Confident	4 Å²	4	60 Å²	60	2%	0.024	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	130.2	176.1	-178	0	0	0	0	108.6	G809 H839 Y841 S1014 S1015	G809-V1040 VanDerWaalsContact CA-CG2 3.45Å; H839-V1040 HydrophobicContact CB-CB 4.4Å; H839-V1040 HydrophobicContact CB-CG1 3.97Å; H839-V1040 PolarHBondContact CE1-O 3.31Å; Y841-V1040 HydrophobicContact CD1-CG2 4.11Å; Y841-V1040 HydrophobicContact CE1-CB 4.36Å; Y841-V1040 HydrophobicContact CE1-CG2 3.48Å; Y841-V1040 VanDerWaalsContact CE1-CG2 3.48Å; Y841-V1040 HydrophobicContact CE2-CG2 4.43Å; S1014-V1040 CarbonylContact C-O 3.53Å; S1014-V1040 VanDerWaalsContact CA-O 3.32Å; S1014-V1040 WeakPolarHBondContact CA-O 3.44Å; S1015-V1040 PolarHBondContact N-O 3.41Å; S1015-V1040 PolarHBondContact O-N 3.19Å
1041	S	90.2	Very high	78.3	Confident	27 Å²	27	62.6 Å²	62.6	19%	0.189	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	137.9	-176	-56.7	0	0	0	0	111.5	M1012 I1013 S1014	M1012-S1041 WeakPolarHBondContact CE-OG 3.37Å; I1013-S1041 CarbonylContact O-C 3.21Å; I1013-S1041 VanDerWaalsContact O-CA 3.28Å; I1013-S1041 WeakPolarHBondContact O-CA 3.32Å; S1014-S1041 PolarHBondContact OG-OG 3.21Å
1042	T	90.4	Very high	77.6	Confident	2 Å²	2	63.9 Å²	63.9	1%	0.012	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	128.6	166.9	-55.9	0	0	0	0	108.7	S811 Y816 V837 H839 I1013 V1044	S811-T1042 PolarHBondContact OG-OG1 3.24Å; S811-T1042 VanDerWaalsContact OG-OG1 3.07Å; Y816-T1042 HydrophobicContact CD2-CG2 3.34Å; Y816-T1042 HydrophobicContact CE2-CG2 3.68Å; V837-T1042 HydrophobicContact CG1-CG2 4.4Å; V837-T1042 WeakPolarHBondContact CG1-OG1 3.45Å; H839-T1042 PolarHBondContact NE2-OG1 2.93Å; I1013-T1042 PolarHBondContact N-O 2.8Å; I1013-T1042 PolarHBondContact O-N 3Å; T1042-V1044 HydrophobicContact CG2-CG2 4.38Å
1043	I	88.3	Confident	76.4	Confident	33 Å²	33	60.1 Å²	60.1	17%	0.169	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	135.7	174.8	-59.6	169.8	0	0	0	108.3	E814 T815 Y816 A1011	E814-I1043 PolarHBondContact O-N 3.11Å; T815-I1043 CarbonylContact C-O 3.41Å; T815-I1043 VanDerWaalsContact CA-O 3.3Å; T815-I1043 WeakPolarHBondContact CA-O 3.14Å; T815-I1043 HydrophobicContact CG2-CB 4.07Å; T815-I1043 HydrophobicContact CG2-CD1 4.32Å; T815-I1043 HydrophobicContact CG2-CG2 4.5Å; Y816-I1043 PolarHBondContact N-O 3.04Å; A1011-I1043 WeakPolarHBondContact O-CA 3.33Å
1044	V	87.2	Confident	75.1	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	122	-179.6	-174.2	0	0	0	0	109.7	Y816 Y818 L998 L1003 A1011 I1013 T1042	Y816-V1044 VanDerWaalsContact O-CA 3.31Å; Y816-V1044 WeakPolarHBondContact O-CA 3.4Å; Y818-V1044 HydrophobicContact CD1-CG1 3.5Å; Y818-V1044 HydrophobicContact CE1-CG1 3.72Å; L998-V1044 HydrophobicContact CD1-CG2 4.26Å; L998-V1044 HydrophobicContact CD2-CG1 4.05Å; L998-V1044 HydrophobicContact CD2-CG2 4.04Å; L1003-V1044 HydrophobicContact CD1-CG1 3.57Å; L1003-V1044 HydrophobicContact CD2-CG1 4.2Å; L1003-V1044 HydrophobicContact CG-CG1 4.5Å; A1011-V1044 PolarHBondContact N-O 3.3Å; A1011-V1044 VanDerWaalsContact N-O 3.15Å; A1011-V1044 PolarHBondContact O-N 3.22Å; I1013-V1044 HydrophobicContact CD1-CG2 3.89Å; I1013-V1044 HydrophobicContact CG1-CG2 4.41Å; T1042-V1044 HydrophobicContact CG2-CG2 4.38Å
1045	N	83.9	Confident	73.8	Confident	38 Å²	38	70.4 Å²	70.4	20%	0.203	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	147.8	-178.9	-47.7	-60.8	0	0	0	111.6	Y816 D817 Y818	Y816-N1045 PolarHBondContact O-N 3.3Å; D817-N1045 CarbonylContact C-O 3.19Å; D817-N1045 WeakPolarHBondContact CA-O 3.29Å; D817-N1045 PolarHBondContact OD1-ND2 3.23Å; Y818-N1045 WeakPolarHBondContact CD1-O 3.31Å; Y818-N1045 VanDerWaalsContact CE1-C 3.49Å; Y818-N1045 PolarHBondContact N-O 2.87Å
1046	P	78.4	Confident	72.6	Confident	12 Å²	12	70.1 Å²	70.1	8%	0.078	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	129.1	168.6	29.2	-29.4	0	0	0	111	Y818 F820 Y1009 D1048	Y818-P1046 HydrophobicContact CE1-CB 4.17Å; Y818-P1046 HydrophobicContact CE2-CB 4.31Å; Y818-P1046 CarbonylContact O-C 3.46Å; Y818-P1046 VanDerWaalsContact O-CA 3.23Å; Y818-P1046 WeakPolarHBondContact O-CA 3.33Å; F820-P1046 HydrophobicContact CE2-CB 3.86Å; F820-P1046 HydrophobicContact CZ-CB 4.11Å; Y1009-P1046 HydrophobicContact CD1-CG 4.45Å; Y1009-P1046 WeakPolarHBondContact O-CD 3.46Å; P1046-D1048 VanDerWaalsContact C-N 3.27Å; P1046-D1048 PolarHBondContact O-N 3.02Å
1047	S	70.3	Confident	71.5	Confident	59 Å²	59	68.2 Å²	68.2	41%	0.413	38%	0.375	S	S	.	.	S	Bend	trans	-66	-28.6	-178.5	-30.9	0	0	0	0	113.2	Y818	Y818-S1047 VanDerWaalsContact C-OG 3.28Å; Y818-S1047 PolarHBondContact N-OG 2.66Å; Y818-S1047 PolarHBondContact O-N 3.32Å; Y818-S1047 PolarHBondContact O-OG 2.9Å
1048	D	63.1	Low	70.5	Confident	47 Å²	47	63.4 Å²	63.4	25%	0.251	37%	0.374	S	S	.	.			trans	-126.7	84.7	178.3	-170.1	-8.1	0	0	0	109.7	P1046 T1050 R1051	P1046-D1048 VanDerWaalsContact C-N 3.27Å; P1046-D1048 PolarHBondContact O-N 3.02Å; D1048-T1050 PolarHBondContact O-N 3.4Å; D1048-T1050 WeakPolarHBondContact OD1-CA 3.45Å; D1048-T1050 WeakPolarHBondContact OD1-CB 3.22Å; D1048-T1050 PolarHBondContact OD1-N 3.08Å; D1048-T1050 PolarHBondContact OD1-OG1 3.12Å; D1048-R1051 WeakPolarHBondContact OD2-CG 3.49Å; D1048-R1051 IonicContact OD2-NE 3.49Å; D1048-R1051 PolarHBondContact OD2-NE 3.11Å
1049	P	55.2	Low	70.1	Confident	81 Å²	81	70.7 Å²	70.7	53%	0.526	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-5.8	175.7	25.6	-31.7	0	0	0	112.5
1050	T	53.2	Low	69.7	Low	112 Å²	112	70.7 Å²	70.7	69%	0.687	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-5.1	-168.6	67.8	0	0	0	0	115.4	D1048	D1048-T1050 PolarHBondContact O-N 3.4Å; D1048-T1050 WeakPolarHBondContact OD1-CA 3.45Å; D1048-T1050 WeakPolarHBondContact OD1-CB 3.22Å; D1048-T1050 PolarHBondContact OD1-N 3.08Å; D1048-T1050 PolarHBondContact OD1-OG1 3.12Å
1051	R	50.6	Low	69.2	Low	199 Å²	199	75.2 Å²	75.2	75%	0.751	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-5.9	176.8	-84.4	-173.5	-168.4	-149.9	3.6	116.5	D1048 G1053	D1048-R1051 WeakPolarHBondContact OD2-CG 3.49Å; D1048-R1051 IonicContact OD2-NE 3.49Å; D1048-R1051 PolarHBondContact OD2-NE 3.11Å; R1051-G1053 PolarHBondContact O-N 3.34Å
1052	I	48.2	Very low	69	Low	82 Å²	82	80.5 Å²	80.5	42%	0.421	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	38.8	163.1	-42.4	178.8	0	0	0	109.9	F820 V1007 Y1009 R1054	F820-I1052 HydrophobicContact CD1-CD1 4.42Å; F820-I1052 HydrophobicContact CE1-CD1 3.7Å; F820-I1052 HydrophobicContact CE1-CG1 4.49Å; F820-I1052 HydrophobicContact CE2-CD1 3.99Å; F820-I1052 HydrophobicContact CE2-CG1 4.17Å; F820-I1052 HydrophobicContact CZ-CD1 3.46Å; F820-I1052 VanDerWaalsContact CZ-CD1 3.46Å; F820-I1052 HydrophobicContact CZ-CG1 4.14Å; V1007-I1052 HydrophobicContact CG1-CD1 4.13Å; Y1009-I1052 HydrophobicContact CE1-CD1 4.36Å; I1052-R1054 PolarHBondContact O-N 3.48Å; I1052-R1054 VanDerWaalsContact O-N 3.13Å
1053	G	44.4	Very low	68.8	Low	56 Å²	56	84 Å²	84	58%	0.577	46%	0.46	S	S	*	.			trans	-69.3	101.2	151	0	0	0	0	0	106.4	R1051 G1055	R1051-G1053 PolarHBondContact O-N 3.34Å; G1053-G1055 PolarHBondContact O-N 2.83Å
1054	R	48	Very low	68.9	Low	234 Å²	234	85.3 Å²	85.3	88%	0.883	48%	0.477	S	S	*	.			trans	-38.3	108.3	163.5	-88	178.8	173.8	156.9	-0.9	106.5	I1052 V1056	I1052-R1054 PolarHBondContact O-N 3.48Å; I1052-R1054 VanDerWaalsContact O-N 3.13Å; R1054-V1056 PolarHBondContact O-N 3.35Å
1055	G	52.1	Low	69	Low	66 Å²	66	89.3 Å²	89.3	68%	0.68	50%	0.501	S	S	*	.			trans	-48.7	118.7	177.3	0	0	0	0	0	106.1	G1053 P1057	G1053-G1055 PolarHBondContact O-N 2.83Å; G1055-P1057 WeakPolarHBondContact O-CD 3.22Å
1056	V	60.6	Low	69.3	Low	82 Å²	82	91.9 Å²	91.9	50%	0.497	51%	0.514	S	S	.	.			trans	-50.2	115.8	-175.5	175	0	0	0	0	105.5	R1054 G1058 L1060 I1061	R1054-V1056 PolarHBondContact O-N 3.35Å; V1056-G1058 PolarHBondContact O-N 2.84Å; V1056-L1060 HydrophobicContact CG1-CB 3.37Å; V1056-L1060 HydrophobicContact CG1-CD1 4.1Å; V1056-L1060 HydrophobicContact CG1-CG 4.37Å; V1056-I1061 HydrophobicContact CB-CD1 4.46Å; V1056-I1061 HydrophobicContact CB-CG1 4.18Å; V1056-I1061 HydrophobicContact CG1-CG1 3.89Å
1057	P	68.5	Low	70	Confident	57 Å²	57	93.9 Å²	93.9	37%	0.37	53%	0.531	S	S	.	.			trans	-43.9	129.9	-177.9	-30.7	28.7	0	0	0	109.3	G1055 W1059 L1060	G1055-P1057 WeakPolarHBondContact O-CD 3.22Å; P1057-W1059 HydrophobicContact CB-CG 4.11Å; P1057-W1059 CarbonylContact O-C 3.46Å; P1057-W1059 PolarHBondContact O-N 3.13Å; P1057-L1060 HydrophobicContact CB-CD1 4.46Å; P1057-L1060 HydrophobicContact CG-CD1 4.06Å; P1057-L1060 WeakPolarHBondContact O-CB 3.47Å; P1057-L1060 PolarHBondContact O-N 3Å
1058	G	72.4	Confident	71	Confident	58 Å²	58	93 Å²	93	60%	0.598	53%	0.532	S	S	*	.	H	α-helix	trans	-52.3	-25.4	-171.3	0	0	0	0	0	113.8	V1056 I1061 F1062	V1056-G1058 PolarHBondContact O-N 2.84Å; G1058-I1061 PolarHBondContact O-N 3.24Å; G1058-F1062 WeakPolarHBondContact O-CB 3.26Å; G1058-F1062 PolarHBondContact O-N 3.34Å
1059	W	84.1	Confident	72.4	Confident	164 Å²	164	95 Å²	95	62%	0.621	54%	0.542	S	S	*	.	H	α-helix	trans	-64.7	-35	172.2	74.9	-99.8	0	0	0	114.2	P1057 F1062 V1063	P1057-W1059 HydrophobicContact CB-CG 4.11Å; P1057-W1059 CarbonylContact O-C 3.46Å; P1057-W1059 PolarHBondContact O-N 3.13Å; W1059-F1062 WeakPolarHBondContact O-CB 3Å; W1059-F1062 PolarHBondContact O-N 2.9Å; W1059-V1063 HydrophobicContact CE3-CG2 4.03Å; W1059-V1063 HydrophobicContact CZ3-CG2 4.42Å; W1059-V1063 WeakPolarHBondContact O-CB 3.12Å; W1059-V1063 VanDerWaalsContact O-CG2 3.25Å; W1059-V1063 WeakPolarHBondContact O-CG2 3.29Å; W1059-V1063 PolarHBondContact O-N 2.83Å
1060	L	83.6	Confident	74.1	Confident	72 Å²	72	93.9 Å²	93.9	38%	0.377	54%	0.54	S	S	.	.	H	α-helix	trans	-69.4	-37.7	176.1	-85.7	166.9	0	0	0	111.4	V1056 P1057 F1062 V1063 A1064	V1056-L1060 HydrophobicContact CG1-CB 3.37Å; V1056-L1060 HydrophobicContact CG1-CD1 4.1Å; V1056-L1060 HydrophobicContact CG1-CG 4.37Å; P1057-L1060 HydrophobicContact CB-CD1 4.46Å; P1057-L1060 HydrophobicContact CG-CD1 4.06Å; P1057-L1060 WeakPolarHBondContact O-CB 3.47Å; P1057-L1060 PolarHBondContact O-N 3Å; L1060-F1062 VanDerWaalsContact C-N 3.34Å; L1060-V1063 PolarHBondContact O-N 2.86Å; L1060-A1064 WeakPolarHBondContact O-CB 3.34Å; L1060-A1064 PolarHBondContact O-N 3.29Å
1061	I	81.3	Confident	75.9	Confident	99 Å²	99	92.8 Å²	92.8	51%	0.508	54%	0.536	S	S	.	.	H	α-helix	trans	-62.8	-45.4	171.7	-58.3	176.2	0	0	0	109.4	V1056 G1058 V1063 A1064 V1065	V1056-I1061 HydrophobicContact CB-CD1 4.46Å; V1056-I1061 HydrophobicContact CB-CG1 4.18Å; V1056-I1061 HydrophobicContact CG1-CG1 3.89Å; G1058-I1061 PolarHBondContact O-N 3.24Å; I1061-V1063 PolarHBondContact O-N 2.69Å; I1061-A1064 PolarHBondContact O-N 2.68Å; I1061-V1065 VanDerWaalsContact O-CG2 3.32Å; I1061-V1065 WeakPolarHBondContact O-CG2 3.22Å; I1061-V1065 PolarHBondContact O-N 2.9Å
1062	F	84.4	Confident	77.9	Confident	138 Å²	138	87.9 Å²	87.9	61%	0.605	52%	0.524	S	S	*	.	H	α-helix	trans	-61.3	-44	177.4	-174.8	-101.4	0	0	0	112.8	G1058 W1059 L1060 V1065 L1066	G1058-F1062 WeakPolarHBondContact O-CB 3.26Å; G1058-F1062 PolarHBondContact O-N 3.34Å; W1059-F1062 WeakPolarHBondContact O-CB 3Å; W1059-F1062 PolarHBondContact O-N 2.9Å; L1060-F1062 VanDerWaalsContact C-N 3.34Å; F1062-V1065 PolarHBondContact O-N 3.16Å; F1062-L1066 HydrophobicContact CD1-CD1 3.86Å; F1062-L1066 HydrophobicContact CE1-CD1 3.41Å; F1062-L1066 VanDerWaalsContact CE1-CD1 3.41Å; F1062-L1066 HydrophobicContact CE1-CG 4.34Å; F1062-L1066 HydrophobicContact CZ-CD1 3.92Å; F1062-L1066 PolarHBondContact O-N 2.92Å
1063	V	88.1	Confident	79.8	Confident	74 Å²	74	88.7 Å²	88.7	45%	0.448	53%	0.528	S	S	.	.	H	α-helix	trans	-65.1	-40.9	176.2	170.1	0	0	0	0	111.4	W1059 L1060 I1061 L1066 A1067	W1059-V1063 HydrophobicContact CE3-CG2 4.03Å; W1059-V1063 HydrophobicContact CZ3-CG2 4.42Å; W1059-V1063 WeakPolarHBondContact O-CB 3.12Å; W1059-V1063 VanDerWaalsContact O-CG2 3.25Å; W1059-V1063 WeakPolarHBondContact O-CG2 3.29Å; W1059-V1063 PolarHBondContact O-N 2.83Å; L1060-V1063 PolarHBondContact O-N 2.86Å; I1061-V1063 PolarHBondContact O-N 2.69Å; V1063-L1066 PolarHBondContact O-N 3.15Å; V1063-A1067 WeakPolarHBondContact O-CB 3.42Å; V1063-A1067 PolarHBondContact O-N 2.67Å
1064	A	88.5	Confident	81.9	Confident	62 Å²	62	90.7 Å²	90.7	51%	0.512	53%	0.525	S	S	.	.	H	α-helix	trans	-64.1	-40.3	177	0	0	0	0	0	112.3	L1060 I1061 A1067 G1068	L1060-A1064 WeakPolarHBondContact O-CB 3.34Å; L1060-A1064 PolarHBondContact O-N 3.29Å; I1061-A1064 PolarHBondContact O-N 2.68Å; A1064-A1067 PolarHBondContact O-N 3.04Å; A1064-G1068 PolarHBondContact O-N 3.43Å
1065	V	90.2	Very high	83.9	Confident	84 Å²	84	84 Å²	84	51%	0.509	51%	0.506	S	S	.	.	H	α-helix	trans	-64.5	-42.9	175.3	172	0	0	0	0	111.2	I1061 F1062 G1068 L1069	I1061-V1065 VanDerWaalsContact O-CG2 3.32Å; I1061-V1065 WeakPolarHBondContact O-CG2 3.22Å; I1061-V1065 PolarHBondContact O-N 2.9Å; F1062-V1065 PolarHBondContact O-N 3.16Å; V1065-G1068 PolarHBondContact O-N 3.03Å; V1065-L1069 HydrophobicContact CG1-CD1 4.08Å; V1065-L1069 WeakPolarHBondContact O-CB 3.49Å; V1065-L1069 PolarHBondContact O-N 3.07Å
1066	L	90.9	Very high	85.5	Confident	92 Å²	92	84.8 Å²	84.8	48%	0.482	49%	0.494	S	S	.	.	H	α-helix	trans	-63.9	-44.5	175.6	-78.5	172.9	0	0	0	112.4	F1062 V1063 L1069 A1070	F1062-L1066 HydrophobicContact CD1-CD1 3.86Å; F1062-L1066 HydrophobicContact CE1-CD1 3.41Å; F1062-L1066 VanDerWaalsContact CE1-CD1 3.41Å; F1062-L1066 HydrophobicContact CE1-CG 4.34Å; F1062-L1066 HydrophobicContact CZ-CD1 3.92Å; F1062-L1066 PolarHBondContact O-N 2.92Å; V1063-L1066 PolarHBondContact O-N 3.15Å; L1066-L1069 PolarHBondContact O-N 3.28Å; L1066-A1070 WeakPolarHBondContact O-CB 3.26Å; L1066-A1070 PolarHBondContact O-N 3.41Å
1067	A	91.4	Very high	86.6	Confident	53 Å²	53	86.5 Å²	86.5	44%	0.438	50%	0.498	S	S	.	.	H	α-helix	trans	-63.7	-41.5	176.2	0	0	0	0	0	111.6	V1063 A1064 A1070 C1071	V1063-A1067 WeakPolarHBondContact O-CB 3.42Å; V1063-A1067 PolarHBondContact O-N 2.67Å; A1064-A1067 PolarHBondContact O-N 3.04Å; A1067-A1070 PolarHBondContact O-N 3.08Å; A1067-C1071 WeakPolarHBondContact O-CB 3.3Å; A1067-C1071 PolarHBondContact O-N 3.39Å
1068	G	92.8	Very high	87.4	Confident	41 Å²	41	87.4 Å²	87.4	42%	0.423	50%	0.499	S	S	.	.	H	α-helix	trans	-61.5	-45.1	175.3	0	0	0	0	0	112.7	A1064 V1065 C1071 L1072	A1064-G1068 PolarHBondContact O-N 3.43Å; V1065-G1068 PolarHBondContact O-N 3.03Å; G1068-C1071 PolarHBondContact O-N 3.27Å; G1068-L1072 WeakPolarHBondContact O-CB 3.37Å; G1068-L1072 PolarHBondContact O-N 3.24Å
1069	L	92.6	Very high	88	Confident	89 Å²	89	86.9 Å²	86.9	47%	0.466	48%	0.482	S	S	.	.	H	α-helix	trans	-64.1	-41.9	175	-81.9	164.6	0	0	0	112.2	V1065 L1066 L1072 I1073	V1065-L1069 HydrophobicContact CG1-CD1 4.08Å; V1065-L1069 WeakPolarHBondContact O-CB 3.49Å; V1065-L1069 PolarHBondContact O-N 3.07Å; L1066-L1069 PolarHBondContact O-N 3.28Å; L1069-L1072 PolarHBondContact O-N 3.17Å; L1069-I1073 VanDerWaalsContact O-CG1 3.3Å; L1069-I1073 WeakPolarHBondContact O-CG1 3.39Å; L1069-I1073 PolarHBondContact O-N 3.04Å
1070	A	90	Very high	87.8	Confident	58 Å²	58	88.6 Å²	88.6	48%	0.479	49%	0.489	S	S	.	.	H	α-helix	trans	-63.3	-46.3	176.6	0	0	0	0	0	111.7	L1066 A1067 L1072 I1073 L1074	L1066-A1070 WeakPolarHBondContact O-CB 3.26Å; L1066-A1070 PolarHBondContact O-N 3.41Å; A1067-A1070 PolarHBondContact O-N 3.08Å; A1070-L1072 VanDerWaalsContact C-N 3.35Å; A1070-L1072 PolarHBondContact O-N 3.5Å; A1070-I1073 PolarHBondContact O-N 2.81Å; A1070-L1074 WeakPolarHBondContact O-CB 3.49Å; A1070-L1074 PolarHBondContact O-N 2.97Å
1071	C	91.8	Very high	87.8	Confident	89 Å²	89	93.7 Å²	93.7	60%	0.601	51%	0.508	S	S	*	.	H	α-helix	trans	-60.4	-42.5	173.5	-94	0	0	0	0	111.9	A1067 G1068 L1074 L1075	A1067-C1071 WeakPolarHBondContact O-CB 3.3Å; A1067-C1071 PolarHBondContact O-N 3.39Å; G1068-C1071 PolarHBondContact O-N 3.27Å; C1071-L1074 PolarHBondContact O-N 3.33Å; C1071-L1075 WeakPolarHBondContact O-CB 3.42Å; C1071-L1075 PolarHBondContact O-N 3.46Å
1072	L	91.1	Very high	87.5	Confident	96 Å²	96	96.8 Å²	96.8	50%	0.503	52%	0.518	S	S	.	.	H	α-helix	trans	-62	-45.9	178.1	-173.3	76.8	0	0	0	111.5	G1068 L1069 A1070 L1075 I1076	G1068-L1072 WeakPolarHBondContact O-CB 3.37Å; G1068-L1072 PolarHBondContact O-N 3.24Å; L1069-L1072 PolarHBondContact O-N 3.17Å; A1070-L1072 VanDerWaalsContact C-N 3.35Å; A1070-L1072 PolarHBondContact O-N 3.5Å; L1072-L1075 PolarHBondContact O-N 2.86Å; L1072-I1076 HydrophobicContact CD2-CD1 4.46Å; L1072-I1076 HydrophobicContact CG-CD1 4.01Å; L1072-I1076 WeakPolarHBondContact O-CB 3.45Å; L1072-I1076 VanDerWaalsContact O-CG1 3.24Å; L1072-I1076 WeakPolarHBondContact O-CG1 3.37Å; L1072-I1076 PolarHBondContact O-N 2.86Å
1073	I	89.6	Confident	86.9	Confident	99 Å²	99	91.5 Å²	91.5	51%	0.508	50%	0.503	S	S	.	.	H	α-helix	trans	-62.6	-44.4	177.3	-69.5	166.9	0	0	0	110.5	L1069 A1070 L1075 I1076 M1077	L1069-I1073 VanDerWaalsContact O-CG1 3.3Å; L1069-I1073 WeakPolarHBondContact O-CG1 3.39Å; L1069-I1073 PolarHBondContact O-N 3.04Å; A1070-I1073 PolarHBondContact O-N 2.81Å; I1073-L1075 VanDerWaalsContact C-N 3.34Å; I1073-L1075 PolarHBondContact O-N 3.23Å; I1073-I1076 PolarHBondContact O-N 2.77Å; I1073-M1077 WeakPolarHBondContact O-CG 3.34Å; I1073-M1077 PolarHBondContact O-N 2.76Å
1074	L	88.9	Confident	85.8	Confident	97 Å²	97	92.8 Å²	92.8	51%	0.508	50%	0.502	S	S	.	.	H	α-helix	trans	-63.9	-41	178.6	-150.1	164.1	0	0	0	111	A1070 C1071 M1077 L1078	A1070-L1074 WeakPolarHBondContact O-CB 3.49Å; A1070-L1074 PolarHBondContact O-N 2.97Å; C1071-L1074 PolarHBondContact O-N 3.33Å; L1074-M1077 PolarHBondContact O-N 2.76Å; L1074-L1078 HydrophobicContact CD2-CD1 3.5Å; L1074-L1078 HydrophobicContact CD2-CG 3.95Å; L1074-L1078 WeakPolarHBondContact O-CB 3.47Å; L1074-L1078 WeakPolarHBondContact O-CG 3.46Å; L1074-L1078 PolarHBondContact O-N 3.09Å
1075	L	88.4	Confident	84.7	Confident	94 Å²	94	95.8 Å²	95.8	49%	0.492	50%	0.504	S	S	.	.	H	α-helix	trans	-67	-41.5	176.4	-164.1	149.7	0	0	0	111.4	C1071 L1072 I1073 M1077 L1078 L1079	C1071-L1075 WeakPolarHBondContact O-CB 3.42Å; C1071-L1075 PolarHBondContact O-N 3.46Å; L1072-L1075 PolarHBondContact O-N 2.86Å; I1073-L1075 VanDerWaalsContact C-N 3.34Å; I1073-L1075 PolarHBondContact O-N 3.23Å; L1075-M1077 VanDerWaalsContact C-N 3.34Å; L1075-M1077 PolarHBondContact O-N 3.48Å; L1075-L1078 PolarHBondContact O-N 2.92Å; L1075-L1079 HydrophobicContact CD2-CD1 3.39Å; L1075-L1079 HydrophobicContact CD2-CG 3.79Å; L1075-L1079 WeakPolarHBondContact O-CB 3.17Å; L1075-L1079 VanDerWaalsContact O-CG 3.26Å; L1075-L1079 WeakPolarHBondContact O-CG 3.37Å; L1075-L1079 PolarHBondContact O-N 2.91Å
1076	I	85.5	Confident	83.2	Confident	82 Å²	82	100.6 Å²	100.6	42%	0.421	52%	0.518	S	S	.	.	H	α-helix	trans	-61.3	-43.7	172.9	-70.5	166.3	0	0	0	110.5	L1072 I1073 L1079 W1080	L1072-I1076 HydrophobicContact CD2-CD1 4.46Å; L1072-I1076 HydrophobicContact CG-CD1 4.01Å; L1072-I1076 WeakPolarHBondContact O-CB 3.45Å; L1072-I1076 VanDerWaalsContact O-CG1 3.24Å; L1072-I1076 WeakPolarHBondContact O-CG1 3.37Å; L1072-I1076 PolarHBondContact O-N 2.86Å; I1073-I1076 PolarHBondContact O-N 2.77Å; I1076-L1079 PolarHBondContact O-N 2.87Å; I1076-W1080 VanDerWaalsContact O-CB 3.26Å; I1076-W1080 WeakPolarHBondContact O-CB 3.22Å; I1076-W1080 PolarHBondContact O-N 3.28Å
1077	M	85.2	Confident	81.4	Confident	118 Å²	118	105.5 Å²	105.5	58%	0.581	53%	0.53	S	S	*	.	H	α-helix	trans	-64.3	-40.3	176.3	-72.5	-148.8	-68.1	0	0	112.4	I1073 L1074 L1075 W1080 K1081	I1073-M1077 WeakPolarHBondContact O-CG 3.34Å; I1073-M1077 PolarHBondContact O-N 2.76Å; L1074-M1077 PolarHBondContact O-N 2.76Å; L1075-M1077 VanDerWaalsContact C-N 3.34Å; L1075-M1077 PolarHBondContact O-N 3.48Å; M1077-W1080 PolarHBondContact O-N 3.5Å; M1077-K1081 VanDerWaalsContact O-CB 3.31Å; M1077-K1081 WeakPolarHBondContact O-CB 3.21Å; M1077-K1081 PolarHBondContact O-N 3.4Å
1078	L	85.7	Confident	79.3	Confident	76 Å²	76	113.2 Å²	113.2	40%	0.398	55%	0.554	S	S	.	*	H	α-helix	trans	-64.8	-48.4	173.9	-77	166.9	0	0	0	111.2	L1074 L1075 W1080 K1081 F1082	L1074-L1078 HydrophobicContact CD2-CD1 3.5Å; L1074-L1078 HydrophobicContact CD2-CG 3.95Å; L1074-L1078 WeakPolarHBondContact O-CB 3.47Å; L1074-L1078 WeakPolarHBondContact O-CG 3.46Å; L1074-L1078 PolarHBondContact O-N 3.09Å; L1075-L1078 PolarHBondContact O-N 2.92Å; L1078-W1080 VanDerWaalsContact C-N 3.26Å; L1078-W1080 PolarHBondContact O-N 2.99Å; L1078-K1081 CarbonylContact O-C 3.1Å; L1078-K1081 PolarHBondContact O-N 3.28Å; L1078-K1081 VanDerWaalsContact O-N 3.15Å; L1078-F1082 HydrophobicContact CB-CD2 4.27Å; L1078-F1082 HydrophobicContact CB-CE2 4.44Å; L1078-F1082 HydrophobicContact CD2-CD2 4.39Å; L1078-F1082 HydrophobicContact CD2-CE2 3.8Å; L1078-F1082 WeakPolarHBondContact O-CB 3.21Å; L1078-F1082 WeakPolarHBondContact O-CD2 3.28Å; L1078-F1082 PolarHBondContact O-N 2.99Å
1079	L	83.8	Confident	77.3	Confident	47 Å²	47	121.6 Å²	121.6	25%	0.246	57%	0.573	C	S	.	*	H	α-helix	trans	-61.4	-35.6	177.5	-72.8	-177.9	0	0	0	111.9	L1075 I1076 G1083 F1084 F1085	L1075-L1079 HydrophobicContact CD2-CD1 3.39Å; L1075-L1079 HydrophobicContact CD2-CG 3.79Å; L1075-L1079 WeakPolarHBondContact O-CB 3.17Å; L1075-L1079 VanDerWaalsContact O-CG 3.26Å; L1075-L1079 WeakPolarHBondContact O-CG 3.37Å; L1075-L1079 PolarHBondContact O-N 2.91Å; I1076-L1079 PolarHBondContact O-N 2.87Å; L1079-G1083 PolarHBondContact O-N 3.45Å; L1079-F1084 HydrophobicContact CB-CB 4.03Å; L1079-F1084 HydrophobicContact CD1-CD1 4.22Å; L1079-F1084 HydrophobicContact CD2-CB 3.82Å; L1079-F1084 HydrophobicContact CD2-CD1 4.01Å; L1079-F1084 HydrophobicContact CD2-CD2 4.17Å; L1079-F1084 HydrophobicContact CD2-CG 3.75Å; L1079-F1084 HydrophobicContact CG-CB 4.47Å; L1079-F1084 HydrophobicContact CG-CD1 4.5Å; L1079-F1084 VanDerWaalsContact O-CB 3.29Å; L1079-F1084 WeakPolarHBondContact O-CB 3.08Å; L1079-F1084 PolarHBondContact O-N 2.92Å; L1079-F1085 HydrophobicContact CB-CD2 4.28Å; L1079-F1085 HydrophobicContact CB-CE2 3.59Å; L1079-F1085 HydrophobicContact CB-CZ 4.2Å; L1079-F1085 HydrophobicContact CD1-CE2 4.43Å; L1079-F1085 HydrophobicContact CD1-CZ 4.21Å
1080	W	80.3	Confident	75.3	Confident	200 Å²	200	123 Å²	123	76%	0.758	59%	0.587	S	S	*	*	H	α-helix	trans	-68.3	-43.8	173.5	-171.4	68	0	0	0	111.8	I1076 M1077 L1078 G1083 F1085	I1076-W1080 VanDerWaalsContact O-CB 3.26Å; I1076-W1080 WeakPolarHBondContact O-CB 3.22Å; I1076-W1080 PolarHBondContact O-N 3.28Å; M1077-W1080 PolarHBondContact O-N 3.5Å; L1078-W1080 VanDerWaalsContact C-N 3.26Å; L1078-W1080 PolarHBondContact O-N 2.99Å; W1080-G1083 PolarHBondContact O-N 2.7Å; W1080-F1085 HydrophobicContact CB-CD2 4.4Å
1081	K	83.2	Confident	73.3	Confident	180 Å²	180	126.3 Å²	126.3	78%	0.783	60%	0.604	S	S	*	*	H	α-helix	trans	-68.4	-35.1	177.4	-169.9	172.3	-177.9	176.9	0	113.3	M1077 L1078 G1083	M1077-K1081 VanDerWaalsContact O-CB 3.31Å; M1077-K1081 WeakPolarHBondContact O-CB 3.21Å; M1077-K1081 PolarHBondContact O-N 3.4Å; L1078-K1081 CarbonylContact O-C 3.1Å; L1078-K1081 PolarHBondContact O-N 3.28Å; L1078-K1081 VanDerWaalsContact O-N 3.15Å; K1081-G1083 PolarHBondContact O-N 2.96Å
1082	F	76	Confident	71.1	Confident	164 Å²	164	133.7 Å²	133.7	72%	0.719	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	6.5	174.2	-74.3	-64.9	0	0	0	113.4	L1078 F1084	L1078-F1082 HydrophobicContact CB-CD2 4.27Å; L1078-F1082 HydrophobicContact CB-CE2 4.44Å; L1078-F1082 HydrophobicContact CD2-CD2 4.39Å; L1078-F1082 HydrophobicContact CD2-CE2 3.8Å; L1078-F1082 WeakPolarHBondContact O-CB 3.21Å; L1078-F1082 WeakPolarHBondContact O-CD2 3.28Å; L1078-F1082 PolarHBondContact O-N 2.99Å; F1082-F1084 PolarHBondContact O-N 3.2Å
1083	G	70.8	Confident	68.8	Low	27 Å²	27	132.3 Å²	132.3	28%	0.278	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	66.8	20.3	174.4	0	0	0	0	0	114	L1079 W1080 K1081 F1085 K1086	L1079-G1083 PolarHBondContact O-N 3.45Å; W1080-G1083 PolarHBondContact O-N 2.7Å; K1081-G1083 PolarHBondContact O-N 2.96Å; G1083-F1085 PolarHBondContact O-N 3.17Å; G1083-K1086 WeakPolarHBondContact O-CB 3.45Å; G1083-K1086 PolarHBondContact O-N 3.19Å
1084	F	65.7	Low	66.6	Low	100 Å²	100	137 Å²	137	44%	0.439	65%	0.647	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.9	-31.9	-179	-173.9	-98.4	0	0	0	112.2	L1079 F1082 K1086	L1079-F1084 HydrophobicContact CB-CB 4.03Å; L1079-F1084 HydrophobicContact CD1-CD1 4.22Å; L1079-F1084 HydrophobicContact CD2-CB 3.82Å; L1079-F1084 HydrophobicContact CD2-CD1 4.01Å; L1079-F1084 HydrophobicContact CD2-CD2 4.17Å; L1079-F1084 HydrophobicContact CD2-CG 3.75Å; L1079-F1084 HydrophobicContact CG-CB 4.47Å; L1079-F1084 HydrophobicContact CG-CD1 4.5Å; L1079-F1084 VanDerWaalsContact O-CB 3.29Å; L1079-F1084 WeakPolarHBondContact O-CB 3.08Å; L1079-F1084 PolarHBondContact O-N 2.92Å; F1082-F1084 PolarHBondContact O-N 3.2Å; F1084-K1086 PolarHBondContact O-N 3.38Å
1085	F	64.8	Low	64.1	Low	126 Å²	126	136.1 Å²	136.1	55%	0.553	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	2.3	175	-60.8	-71.8	0	0	0	114	L1079 W1080 G1083	L1079-F1085 HydrophobicContact CB-CD2 4.28Å; L1079-F1085 HydrophobicContact CB-CE2 3.59Å; L1079-F1085 HydrophobicContact CB-CZ 4.2Å; L1079-F1085 HydrophobicContact CD1-CE2 4.43Å; L1079-F1085 HydrophobicContact CD1-CZ 4.21Å; W1080-F1085 HydrophobicContact CB-CD2 4.4Å; G1083-F1085 PolarHBondContact O-N 3.17Å
1086	K	59.2	Low	61.6	Low	184 Å²	184	139.3 Å²	139.3	80%	0.8	67%	0.671	S	S	*	*			trans	-98.9	62.4	172.2	-64.7	-171.5	179	-179.1	0	111.3	G1083 F1084	G1083-K1086 WeakPolarHBondContact O-CB 3.45Å; G1083-K1086 PolarHBondContact O-N 3.19Å; F1084-K1086 PolarHBondContact O-N 3.38Å
1087	R	53.6	Low	59.3	Low	196 Å²	196	143 Å²	143	74%	0.74	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-97.6	117.7	171.1	-74.9	-171.5	-178.5	-165.3	0.1	112.2	R1089	R1087-R1089 PolarHBondContact O-N 2.88Å
1088	K	46.8	Very low	57.1	Low	214 Å²	214	143.1 Å²	143.1	93%	0.93	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-61.6	120.5	170	-75	179.8	174.4	179.5	0	109.6
1089	R	51.1	Low	54.6	Low	218 Å²	218	149 Å²	149	82%	0.823	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-77.1	143	171.5	-71.9	-179.8	177.8	177.3	-1.6	110.4	R1087	R1087-R1089 PolarHBondContact O-N 2.88Å
1090	P	50.6	Low	52.6	Low	117 Å²	117	152.2 Å²	152.2	76%	0.76	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-64.3	163.3	163.6	-12.3	27.3	0	0	0	111.5
1091	P	47.8	Very low	50.6	Low	129 Å²	129	148.4 Å²	148.4	84%	0.838	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-68.3	142.6	-161.8	-11.7	26.5	0	0	0	113.6	G1093	P1091-G1093 PolarHBondContact O-N 3.18Å
1092	R	44.1	Very low	48.2	Very low	244 Å²	244	148.4 Å²	148.4	92%	0.921	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-71.6	121.1	167.8	-86.7	177.7	167.7	158.1	-5.9	109.7
1093	G	44.4	Very low	46.1	Very low	67 Å²	67	145.6 Å²	145.6	69%	0.691	76%	0.76	S	S	*	*			trans	-166.6	119.2	165	0	0	0	0	0	110.2	P1091	P1091-G1093 PolarHBondContact O-N 3.18Å
1094	Q	43.6	Very low	44.3	Very low	197 Å²	197	152.5 Å²	152.5	92%	0.921	79%	0.785	S	S	*	*			trans	80.5	58.7	165.7	-60	174.2	-9.6	0	0	117.7
1095	A	36.1	Very low	42.7	Very low	79 Å²	79	157.8 Å²	157.8	65%	0.653	80%	0.804	S	S	*	*				-2.2	148.3	112.7	0	0	0	0	0	120
1096	L	35	Very low	41.1	Very low	160 Å²	160	161.7 Å²	161.7	84%	0.838	82%	0.816	S	S	*	*			trans	79.8	132.7	150.7	-52.6	148.5	0	0	0	113.7
1097	L	38	Very low	39.7	Very low	159 Å²	159	155.9 Å²	155.9	83%	0.832	81%	0.808	S	S	*	*			cis	-156.4	137.9	38	-80.2	91.9	0	0	0	110.1
1098	S	37.7	Very low	38.5	Very low	122 Å²	122	157.4 Å²	157.4	85%	0.853	82%	0.816	S	S	*	*				165.5	114.2	123.8	46.3	0	0	0	0	112.4
1099	K	33.1	Very low	37.7	Very low	200 Å²	200	151.5 Å²	151.5	87%	0.87	80%	0.802	S	S	*	*			trans	-66.5	-178	150.2	-73.8	171.5	153.7	-179.7	0	109.5
1100	P	43.1	Very low	36.7	Very low	114 Å²	114	146.8 Å²	146.8	74%	0.74	80%	0.797	S	S	*	*				-102.4	-160.1	-81.6	38.4	-18.4	0	0	0	109.6
1101	P	38.7	Very low	35.9	Very low	120 Å²	120	151.3 Å²	151.3	78%	0.779	80%	0.8	S	S	*	*				-141.8	168	70.1	35.2	-14.8	0	0	0	115.6
1102	E	32.6	Very low	35.2	Very low	179 Å²	179	150.3 Å²	150.3	84%	0.836	80%	0.797	S	S	*	*			trans	-47.3	149.9	161.6	-68.3	140.3	136	0	0	113.7
1103	A	32.3	Very low	34.8	Very low	105 Å²	105	143.9 Å²	143.9	87%	0.868	79%	0.789	S	S	*	*			trans	-153.7	133.2	134.7	0	0	0	0	0	109.5
1104	E	31.4	Very low	34.5	Very low	172 Å²	172	146.6 Å²	146.6	80%	0.804	79%	0.792	S	S	*	*			trans	-76.3	151.4	-164.2	-69.5	153.6	129.3	0	0	115
1105	Y	32.8	Very low	34.2	Very low	211 Å²	211	146.2 Å²	146.2	83%	0.827	79%	0.791	S	S	*	*				-4.6	159.1	128.7	-137.1	-104.8	0	0	0	118.7
1106	Y	30.8	Very low	34.3	Very low	209 Å²	209	148.3 Å²	148.3	82%	0.82	80%	0.798	S	S	*	*			trans	102.6	126.2	-179.8	-61.2	-70.5	0	0	0	112.9
1107	G	30	Very low	34.2	Very low	61 Å²	61	144.7 Å²	144.7	63%	0.629	80%	0.798	S	S	*	*			cis	111	113.1	25	0	0	0	0	0	109.7
1108	Y	29.1	Very low	34	Very low	228 Å²	228	140.9 Å²	140.9	89%	0.894	80%	0.798	S	S	*	*			trans	72.9	130.3	162.1	-81.7	-95.9	0	0	0	122
1109	S	29.7	Very low	33.6	Very low	91 Å²	91	144.6 Å²	144.6	64%	0.636	80%	0.799	S	S	*	*			trans	64.3	126.6	136.4	72.5	0	0	0	0	122.8
1110	T	30.4	Very low	33.7	Very low	118 Å²	118	141.4 Å²	141.4	72%	0.724	80%	0.796	S	S	*	*			trans	66.6	128.7	132.9	48.1	0	0	0	0	123.5
1111	Y	32.4	Very low	33.1	Very low	212 Å²	212	140.9 Å²	140.9	83%	0.831	79%	0.79	S	S	*	*			trans	77.6	117.8	143.5	-87	-87.5	0	0	0	123.5
1112	S	34.1	Very low	32.7	Very low	109 Å²	109	146 Å²	146	76%	0.762	80%	0.796	S	S	*	*			trans	45.4	133.2	138.4	78.9	0	0	0	0	124.2
1113	S	36	Very low	32.7	Very low	108 Å²	108	140.7 Å²	140.7	76%	0.755	79%	0.789	S	S	*	*			trans	-171.4	156.1	139	106.8	0	0	0	0	107.9
1114	T	36.8	Very low	32.8	Very low	125 Å²	125	142.6 Å²	142.6	77%	0.767	79%	0.785	S	S	*	*			cis	176.8	140.3	-29.8	16.2	0	0	0	0	105.5
1115	Q	38.1	Very low	33	Very low	189 Å²	189	140 Å²	140	88%	0.883	78%	0.782	S	S	*	*			trans	-170.4	153.6	141.1	-107.5	-165.9	12.8	0	0	110
1116	P	37.4	Very low	32.9	Very low	123 Å²	123	137 Å²	137	80%	0.799	78%	0.776	S	S	*	*				-126	166	-101.2	39.2	-27	0	0	0	114.7
1117	G	33.7	Very low	33	Very low	83 Å²	83	135.6 Å²	135.6	86%	0.856	77%	0.771	S	S	*	*			trans	133.6	118.6	147.1	0	0	0	0	0	116.7
1118	G	32.9	Very low	33	Very low	79 Å²	79	141.7 Å²	141.7	81%	0.814	78%	0.775	S	S	*	*			trans	120.9	68.6	139.7	0	0	0	0	0	118.1
1119	F	30.3	Very low	33	Very low	201 Å²	201	138.1 Å²	138.1	88%	0.882	77%	0.766	S	S	*	*			trans	-52.1	130.7	149.7	-89.7	-108	0	0	0	110.6
1120	V	34.9	Very low	33	Very low	132 Å²	132	140.5 Å²	140.5	80%	0.8	77%	0.772	S	S	*	*			trans	-153.3	130.2	132.5	-173.3	0	0	0	0	109.8
1121	T	30	Very low	33.3	Very low	103 Å²	103	145.3 Å²	145.3	63%	0.632	80%	0.801	S	S	*	*			trans	-67.2	-174.1	171.4	43.2	0	0	0	0	113.9
1122	Y	31.8	Very low	33.4	Very low	228 Å²	228	142 Å²	142	89%	0.894	80%	0.8	S	S	*	*			trans	83.7	125.7	178.1	-57.1	-85.1	0	0	0	113.6
1123	G	32.2	Very low	33.3	Very low	67 Å²	67	143.7 Å²	143.7	69%	0.691	80%	0.802	S	S	*	*			cis	163.7	140.4	9.8	0	0	0	0	0	106.9
1124	N	33.3	Very low	33.2	Very low	145 Å²	145	145.7 Å²	145.7	78%	0.775	81%	0.805	S	S	*	*			trans	-47.2	149.8	160	-144.3	-6.5	0	0	0	108.9	Q1126	N1124-Q1126 PolarHBondContact OD1-N 3.33Å
1125	P	36.6	Very low	33	Very low	117 Å²	117	146.9 Å²	146.9	76%	0.76	81%	0.807	S	S	*	*				-146.2	155.8	74.8	35.8	-16.3	0	0	0	115.8
1126	Q	29.7	Very low	32.6	Very low	150 Å²	150	144.3 Å²	144.3	70%	0.701	80%	0.802	S	S	*	*			trans	-27.3	149.7	143	-62.5	-168.2	-37.3	0	0	114.5	N1124	N1124-Q1126 PolarHBondContact OD1-N 3.33Å
1127	Y	33.3	Very low	32.3	Very low	178 Å²	178	145.7 Å²	145.7	70%	0.698	80%	0.802	S	S	*	*				173.8	107.7	119	-106.3	-98.6	0	0	0	106.3
1128	R	29.8	Very low	32.2	Very low	189 Å²	189	150.2 Å²	150.2	71%	0.713	80%	0.798	S	S	*	*				75.5	113.9	96.2	-116.3	-168.3	-155.4	174	5.3	113.6
1129	Q	29.8	Very low	32.2	Very low	154 Å²	154	155.7 Å²	155.7	72%	0.72	80%	0.797	S	S	*	*				51	133.5	125.7	-80.2	-177.1	-17.4	0	0	120.6
1130	N	29.5	Very low	32.3	Very low	140 Å²	140	151.9 Å²	151.9	75%	0.749	79%	0.79	S	S	*	*			trans	86	98.8	149.5	-57.7	-11.8	0	0	0	117
1131	T	37	Very low	32.1	Very low	220 Å²	220	153.7 Å²	153.7	100%	1.35	79%	0.789	S	S	*	*				-155.8	0	97.3	17	0	0	0	0	110.5

Retrieved 1,131 of 1,131 residues in 293.2 ms (Link to these results)

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