A0A087YDA5_POEFO Loading...

Leucine rich repeats and immunoglobulin like domains 2

AlphaFold DB , UniProt , Accession A0A087YDA5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,048 aa.

						>A0A087YDA5_POEFO|A0A087YDA5
MAEGWPTLPALVVLLLSFSAWVTDSCPAPCSCPKGQDEVHILECNRKRLSAAPLDVPDGITQVTMNHNDLAVFPFLGNVSSNITSLSLVHNRISELLMHELQPYISLETLDLTSNSISVLKVGAFPSIQLKYLNLSNNKISLLEPGCFENISSSLLVLRLNRNRLVTLPSKVFKLPQLQLLEMKRNKIKIVDSLTFKGLDSLKSLKMQRNGITKLMDGAFFGLNNIEELELEHNNLTEVNKVWLYGLRMLRILQISHNAIGVIRPDAWEFCQKLEELDLSHNHLTRLEESAFVGLGFLETLNLGENSISHLGEGVFSGLAHLRTLDIHNNEISWAIEDSIAVFDGMKKLNTLNLQRNKIKSITQKAFEGLDELKELDLGKNGIMSIHPEALSHLKLEVFVLNSSSLLCDCHMQWLGPWLKESQFLQSVSAVCAHPAGLLGRSILSISPDEFVCDDFPKPRITTHPETSVALRGNNMTLSCVASSSSDSPMTTAWRKDGEVLYDAEVENYARYQDGQLIYTTVLHLLNVNFTDEGLYQCVVSNHFGSNYSNRAMLTINEMPSFLKTPMDLTIRTGMTARLECAAEGHPSPQIAWQKDGGTDFPAARERRMHVMPDDDIFFIAKVKTEDMGVYSCTAQNAAGSLSANATLTVLETPSFVRDLEDRTVARGETAVLQCIAGGSPAPRLNWTKDDGPLMLTERHFFAAANQLLIIVDAGPADAGKYTCIMSNTVGTKRGHIYLSVSPLPSCDTAAGYDYDGWTTVGIVVIVVVCCVVGTSLVWVIVIYHMRRKNEDYSITNTDEMNLPADIPSYLSSQGTLSEPQEGYSNSEAGSHQQLMPPLSNGYIHKGTDGVCYGDTGSEVETEGNGMLHCKMGSLFTGRSSFHPGESREGLAGVSSGGAGPLVICSDCYDNANIYSRTREYCQYAYLGEDDSLDRALPSLKDGLGDAAHPEDTALDSLMHSNHTSAEQYVKDSLSRSLWREDEDPSSVSQPGASHLSAALHRTPALTSAADRAAEQSEAVANYFPRQPTQDHRSAYNRTNPQDHRAPT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.1	Very low	38.4	Very low	241 Å²	241	144.3 Å²	144.3	100%	1.187	83%	0.825	S	S	*	*				0	104.8	0	-64.4	167	176.3	0	0	104.8
2	A	32.4	Very low	38.2	Very low	90 Å²	90	142.6 Å²	142.6	74%	0.744	82%	0.819	S	S	*	*				64.6	132.8	63.3	0	0	0	0	0	111
3	E	40.1	Very low	37.8	Very low	192 Å²	192	140.3 Å²	140.3	90%	0.897	81%	0.809	S	S	*	*			cis	-169.7	169.1	1.5	-117.8	174.4	-174.5	0	0	108.8
4	G	34.5	Very low	37.5	Very low	66 Å²	66	140 Å²	140	68%	0.68	80%	0.802	S	S	*	*			trans	135	86.7	154	0	0	0	0	0	122.3
5	W	33.1	Very low	37.1	Very low	239 Å²	239	141.9 Å²	141.9	91%	0.905	81%	0.807	S	S	*	*			trans	19.3	165.8	134.9	-60.8	79.7	0	0	0	123.6
6	P	68.8	Low	36.9	Very low	94 Å²	94	140.8 Å²	140.8	61%	0.61	80%	0.798	S	S	*	*				-144.2	175.3	-50.3	40.1	-21.2	0	0	0	117.2
7	T	38.1	Very low	36.7	Very low	127 Å²	127	139.2 Å²	139.2	78%	0.779	80%	0.798	S	S	*	*			trans	122.3	131.2	147.6	62.8	0	0	0	0	122.5
8	L	30.1	Very low	36.5	Very low	160 Å²	160	141.7 Å²	141.7	84%	0.838	80%	0.798	S	S	*	*			trans	71.8	148.6	151.2	-73.2	165.2	0	0	0	120.9
9	P	46.2	Very low	36.4	Very low	119 Å²	119	138.7 Å²	138.7	77%	0.773	79%	0.787	S	S	*	*				-120.7	161.4	-74.1	35.6	-20.7	0	0	0	113.7
10	A	32.6	Very low	36.2	Very low	102 Å²	102	136.1 Å²	136.1	84%	0.843	78%	0.783	S	S	*	*			trans	-91	140	179	0	0	0	0	0	113.1
11	L	32.4	Very low	36.3	Very low	157 Å²	157	140.6 Å²	140.6	82%	0.822	79%	0.788	S	S	*	*			trans	-132.7	120.4	161.4	-156.7	146	0	0	0	108.3	V13	L11-V13 HydrophobicContact CD2-CG2 4.34Å; L11-V13 PolarHBondContact O-N 3.47Å
12	V	35.5	Very low	36.5	Very low	124 Å²	124	135 Å²	135	75%	0.752	77%	0.767	S	S	*	*			trans	-77	121	-174.5	174	0	0	0	0	109.7	L14	V12-L14 HydrophobicContact CG1-CD1 4.21Å
13	V	33.7	Very low	37	Very low	113 Å²	113	135.4 Å²	135.4	69%	0.685	76%	0.76	S	S	*	*			trans	-125.2	112.5	160.9	178	0	0	0	0	107.8	L11 L15	L11-V13 HydrophobicContact CD2-CG2 4.34Å; L11-V13 PolarHBondContact O-N 3.47Å; V13-L15 PolarHBondContact O-N 3.19Å
14	L	33.6	Very low	37.6	Very low	136 Å²	136	133.2 Å²	133.2	71%	0.712	75%	0.754	S	S	*	*			trans	-67.3	110	166.1	-76.2	100.9	0	0	0	108.6	V12 L16	V12-L14 HydrophobicContact CG1-CD1 4.21Å; L14-L16 VanDerWaalsContact C-N 3.29Å; L14-L16 PolarHBondContact O-N 3.2Å
15	L	31.8	Very low	39	Very low	168 Å²	168	133.5 Å²	133.5	88%	0.88	75%	0.746	S	S	*	*			trans	-81.9	86.6	155.6	-81.8	167.6	0	0	0	108	V13 S17	V13-L15 PolarHBondContact O-N 3.19Å; L15-S17 PolarHBondContact O-N 3.14Å; L15-S17 VanDerWaalsContact O-N 3.14Å
16	L	34	Very low	41	Very low	125 Å²	125	124 Å²	124	65%	0.654	72%	0.716	S	S	*	*			trans	-58.1	113.5	162.7	-81	162.6	0	0	0	108.1	L14 F18	L14-L16 VanDerWaalsContact C-N 3.29Å; L14-L16 PolarHBondContact O-N 3.2Å; L16-F18 VanDerWaalsContact C-N 3.26Å; L16-F18 HydrophobicContact CB-CD2 4.37Å; L16-F18 PolarHBondContact O-N 2.87Å
17	S	32.5	Very low	41.6	Very low	114 Å²	114	120.2 Å²	120.2	80%	0.797	69%	0.691	S	S	*	*			trans	-63	90.5	163.9	52.8	0	0	0	0	108.5	L15 S19	L15-S17 PolarHBondContact O-N 3.14Å; L15-S17 VanDerWaalsContact O-N 3.14Å; S17-S19 VanDerWaalsContact C-N 3.28Å; S17-S19 PolarHBondContact O-N 3.03Å
18	F	33.3	Very low	43.5	Very low	184 Å²	184	118.7 Å²	118.7	81%	0.807	69%	0.691	S	S	*	*			trans	-67.6	95.3	164.9	-101.2	-89.8	0	0	0	107.9	L16 A20	L16-F18 VanDerWaalsContact C-N 3.26Å; L16-F18 HydrophobicContact CB-CD2 4.37Å; L16-F18 PolarHBondContact O-N 2.87Å; F18-A20 PolarHBondContact O-N 2.93Å
19	S	34	Very low	46	Very low	84 Å²	84	114 Å²	114	59%	0.587	67%	0.671	S	S	*	*			trans	-52.9	107.8	152.3	40.9	0	0	0	0	107.3	S17 W21	S17-S19 VanDerWaalsContact C-N 3.28Å; S17-S19 PolarHBondContact O-N 3.03Å; S19-W21 PolarHBondContact O-N 3.04Å
20	A	33.9	Very low	48	Very low	86 Å²	86	108.9 Å²	108.9	71%	0.711	64%	0.638	S	S	*	*			trans	-64.4	108.2	163	0	0	0	0	0	106.3	F18 V22	F18-A20 PolarHBondContact O-N 2.93Å; A20-V22 PolarHBondContact O-N 3.23Å
21	W	37.2	Very low	50.6	Low	232 Å²	232	106.8 Å²	106.8	88%	0.879	62%	0.617	S	S	*	*			trans	-67.3	84.7	168	-78.2	53.5	0	0	0	107.4	S19 T23	S19-W21 PolarHBondContact O-N 3.04Å; W21-T23 PolarHBondContact O-N 2.84Å
22	V	38.3	Very low	52.9	Low	124 Å²	124	100 Å²	100	75%	0.752	58%	0.582	S	S	*	*			trans	-66.5	113.2	160.8	-179.3	0	0	0	0	105.2	A20 D24	A20-V22 PolarHBondContact O-N 3.23Å; V22-D24 PolarHBondContact O-N 2.72Å
23	T	42.7	Very low	54.4	Low	97 Å²	97	96.1 Å²	96.1	60%	0.595	56%	0.559	S	S	*	*			trans	-69.5	131	178.3	44.7	0	0	0	0	109.5	W21 S25	W21-T23 PolarHBondContact O-N 2.84Å; T23-S25 PolarHBondContact O-N 3.49Å; T23-S25 PolarHBondContact O-OG 3.12Å; T23-S25 VanDerWaalsContact O-OG 3.13Å; T23-S25 PolarHBondContact OG1-OG 3.33Å
24	D	52.9	Low	55.4	Low	146 Å²	146	100.1 Å²	100.1	78%	0.781	57%	0.567	S	S	*	*			trans	-66.8	60.6	166.8	-68.2	-53.4	0	0	0	111.2	V22	V22-D24 PolarHBondContact O-N 2.72Å
25	S	64.1	Low	56.3	Low	73 Å²	73	94.8 Å²	94.8	51%	0.51	55%	0.546	S	S	.	.			trans	-107.2	98.1	-178.1	48.7	0	0	0	0	108.8	T23	T23-S25 PolarHBondContact O-N 3.49Å; T23-S25 PolarHBondContact O-OG 3.12Å; T23-S25 VanDerWaalsContact O-OG 3.13Å; T23-S25 PolarHBondContact OG1-OG 3.33Å
26	C	74.8	Confident	57	Low	39 Å²	39	96.5 Å²	96.5	26%	0.264	55%	0.549	S	S	.	.			trans	-48	137.5	172.1	-62.5	0	0	0	0	111.5	A28 C32	C26-A28 PolarHBondContact O-N 3.3Å; C26-A28 VanDerWaalsContact O-N 3.13Å; C26-C32 HydrophobicContact CB-CB 4.32Å; C26-C32 WeakPolarHBondContact CB-SG 3.16Å; C26-C32 WeakPolarHBondContact SG-CB 3.44Å; C26-C32 PolarHBondContact SG-N 3.27Å; C26-C32 CovalentContact SG-SG 2.03Å; C26-C32 PolarHBondContact SG-SG 3.29Å
27	P	82.2	Confident	57.7	Low	14 Å²	14	97.6 Å²	97.6	9%	0.091	56%	0.556	C	S	.	*			trans	-67.8	115.1	-172.7	26.3	-35.4	0	0	0	110.5	C30 L42 P53 L54	P27-C30 WeakPolarHBondContact O-CA 3.4Å; P27-C30 WeakPolarHBondContact O-CB 3.43Å; P27-C30 PolarHBondContact O-N 3.33Å; P27-L42 HydrophobicContact CG-CD1 4.07Å; P27-P53 HydrophobicContact CB-CB 4.06Å; P27-P53 HydrophobicContact CG-CB 4.07Å; P27-L54 WeakPolarHBondContact CB-O 3.37Å
28	A	78	Confident	58.8	Low	95 Å²	95	97.6 Å²	97.6	79%	0.785	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	135.6	176.6	0	0	0	0	0	110	C26	C26-A28 PolarHBondContact O-N 3.3Å; C26-A28 VanDerWaalsContact O-N 3.13Å
29	P	83.1	Confident	60	Low	63 Å²	63	91.9 Å²	91.9	41%	0.409	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	cis	-96.7	16.4	13.9	40.2	-39.5	0	0	0	115	K47 L49	P29-K47 HydrophobicContact CB-CD 4.21Å; P29-K47 HydrophobicContact CG-CB 3.8Å; P29-K47 HydrophobicContact CG-CD 4.31Å; P29-K47 HydrophobicContact CG-CG 4.08Å; P29-K47 WeakPolarHBondContact O-CD 3.15Å; P29-K47 VanDerWaalsContact O-CE 3.22Å; P29-K47 WeakPolarHBondContact O-CE 3.27Å; P29-K47 PolarHBondContact O-NZ 3.12Å; P29-L49 HydrophobicContact CG-CD2 4.19Å
30	C	87.3	Confident	62.2	Low	11 Å²	11	92.6 Å²	92.6	7%	0.074	52%	0.517	C	S	.	.			trans	-79.5	165.2	179.6	-51.2	0	0	0	0	112.8	P27 L42 E43 C44	P27-C30 WeakPolarHBondContact O-CA 3.4Å; P27-C30 WeakPolarHBondContact O-CB 3.43Å; P27-C30 PolarHBondContact O-N 3.33Å; C30-L42 HydrophobicContact CB-CD1 3.87Å; C30-L42 HydrophobicContact CB-CG 4.49Å; C30-E43 CarbonylContact C-O 3.51Å; C30-E43 VanDerWaalsContact CA-O 3.31Å; C30-E43 WeakPolarHBondContact CA-O 3.23Å; C30-E43 WeakPolarHBondContact CB-O 3.5Å; C30-C44 HydrophobicContact CB-CB 4.04Å; C30-C44 WeakPolarHBondContact CB-SG 3.43Å; C30-C44 VanDerWaalsContact SG-CA 3.56Å; C30-C44 WeakPolarHBondContact SG-CB 3.44Å; C30-C44 CovalentContact SG-SG 2.03Å; C30-C44 PolarHBondContact SG-SG 3.19Å
31	S	86.7	Confident	64.8	Low	58 Å²	58	91 Å²	91	41%	0.406	50%	0.496	S	S	.	.	B	Isolated β-bridge	trans	-116.6	146.5	175.2	-55.2	0	0	0	0	109.7	E43	S31-E43 PolarHBondContact N-O 3.29Å; S31-E43 PolarHBondContact O-N 2.96Å
32	C	80.8	Confident	67.3	Low	14 Å²	14	79.9 Å²	79.9	10%	0.095	45%	0.454	C	S	.	.			trans	-118.2	143.6	155.4	-13.8	0	0	0	0	108.1	C26	C26-C32 HydrophobicContact CB-CB 4.32Å; C26-C32 WeakPolarHBondContact CB-SG 3.16Å; C26-C32 WeakPolarHBondContact SG-CB 3.44Å; C26-C32 PolarHBondContact SG-N 3.27Å; C26-C32 CovalentContact SG-SG 2.03Å; C26-C32 PolarHBondContact SG-SG 3.29Å
33	P	67	Low	69.8	Low	42 Å²	42	78.2 Å²	78.2	27%	0.273	44%	0.438	S	S	.	.			trans	-56.9	141.2	174.6	-23.9	34.8	0	0	0	111.7	E38 I41	P33-E38 HydrophobicContact CB-CB 4.35Å; P33-I41 WeakPolarHBondContact CD-O 3.48Å; P33-I41 HydrophobicContact CG-CB 4.36Å
34	K	55.9	Low	72.1	Confident	197 Å²	197	73.6 Å²	73.6	86%	0.857	41%	0.41	S	S	*	.			trans	-107	70.2	176.3	-72.5	-165.6	173.2	-168.1	0	111.1
35	G	52.9	Low	74	Confident	25 Å²	25	68.8 Å²	68.8	26%	0.258	38%	0.384	S	S	.	.			trans	-110.2	148.7	161.1	0	0	0	0	0	109.8	D37 E38	G35-D37 PolarHBondContact O-N 3.25Å; G35-E38 PolarHBondContact O-N 3.49Å; G35-E38 VanDerWaalsContact O-N 3.16Å
36	Q	46.4	Very low	75.4	Confident	204 Å²	204	74.6 Å²	74.6	95%	0.953	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-9.4	-173.8	-80.9	-178.1	-56.6	0	0	114.9
37	D	48.9	Very low	76.3	Confident	148 Å²	148	76.4 Å²	76.4	79%	0.791	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.1	15.3	175.6	-62.3	-68.9	0	0	0	113.1	G35	G35-D37 PolarHBondContact O-N 3.25Å
38	E	54	Low	76.7	Confident	114 Å²	114	85.9 Å²	85.9	53%	0.533	43%	0.432	S	S	.	.			trans	-113.6	16	-165.8	-69.3	-168.2	146	0	0	116.6	P33 G35 H40	P33-E38 HydrophobicContact CB-CB 4.35Å; G35-E38 PolarHBondContact O-N 3.49Å; G35-E38 VanDerWaalsContact O-N 3.16Å; E38-H40 PolarHBondContact O-N 2.66Å
39	V	58.9	Low	77.3	Confident	64 Å²	64	82.5 Å²	82.5	39%	0.388	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	51.6	-179.9	-161.4	0	0	0	0	112.2	G59 I60	V39-G59 CarbonylContact O-C 3.57Å; V39-I60 HydrophobicContact CG1-CD1 4.18Å
40	H	80.8	Confident	77.7	Confident	98 Å²	98	84.2 Å²	84.2	45%	0.454	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-13	177.9	-70.3	-40.5	0	0	0	113.6	E38 G59 T61 Q62	E38-H40 PolarHBondContact O-N 2.66Å; H40-G59 PolarHBondContact ND1-O 2.95Å; H40-T61 PolarHBondContact O-N 3.43Å; H40-T61 PolarHBondContact O-OG1 2.82Å; H40-Q62 PolarHBondContact O-N 2.99Å
41	I	87.2	Confident	77.7	Confident	52 Å²	52	86.5 Å²	86.5	27%	0.267	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	128.5	-174.4	-48.6	-176.8	0	0	0	110.9	P33 E43 Q62	P33-I41 WeakPolarHBondContact CD-O 3.48Å; P33-I41 HydrophobicContact CG-CB 4.36Å; I41-E43 HydrophobicContact CG2-CG 4.15Å; I41-Q62 CarbonylContact C-O 3.22Å; I41-Q62 WeakPolarHBondContact CA-O 3.45Å; I41-Q62 HydrophobicContact CG1-CB 4.19Å; I41-Q62 HydrophobicContact CG1-CG 4.45Å; I41-Q62 HydrophobicContact CG2-CB 4.4Å
42	L	89.9	Confident	77.7	Confident	0 Å²	0	84.9 Å²	84.9	0%	0	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	122.2	170.2	-179.4	69	0	0	0	110.4	P27 C30 P53 V56 I60 Q62 V63 T64	P27-L42 HydrophobicContact CG-CD1 4.07Å; C30-L42 HydrophobicContact CB-CD1 3.87Å; C30-L42 HydrophobicContact CB-CG 4.49Å; L42-P53 HydrophobicContact CD2-CG 4.19Å; L42-V56 HydrophobicContact CD2-CG1 4.05Å; L42-V56 HydrophobicContact CD2-CG2 4.07Å; L42-I60 HydrophobicContact CB-CD1 4.28Å; L42-I60 HydrophobicContact CB-CG1 4.46Å; L42-I60 HydrophobicContact CB-CG2 3.87Å; L42-Q62 PolarHBondContact N-O 3.46Å; L42-V63 HydrophobicContact CB-CG1 4.25Å; L42-V63 HydrophobicContact CB-CG2 4.27Å; L42-V63 HydrophobicContact CD2-CG1 4.06Å; L42-V63 HydrophobicContact CG-CG1 4.4Å; L42-V63 WeakPolarHBondContact O-CA 3.3Å; L42-T64 PolarHBondContact O-N 3.01Å
43	E	90.8	Very high	77.9	Confident	89 Å²	89	84.9 Å²	84.9	42%	0.416	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	108.7	179.9	-62.9	-162.5	166.2	0	0	112.9	C30 S31 I41	C30-E43 CarbonylContact C-O 3.51Å; C30-E43 VanDerWaalsContact CA-O 3.31Å; C30-E43 WeakPolarHBondContact CA-O 3.23Å; C30-E43 WeakPolarHBondContact CB-O 3.5Å; S31-E43 PolarHBondContact N-O 3.29Å; S31-E43 PolarHBondContact O-N 2.96Å; I41-E43 HydrophobicContact CG2-CG 4.15Å
44	C	92.3	Very high	78.6	Confident	0 Å²	0	89.8 Å²	89.8	0%	0	45%	0.447	C	S	.	.			trans	-115.7	28.5	-178.7	-66.8	0	0	0	0	111.9	C30 K47 L49 T64 M65 N68	C30-C44 HydrophobicContact CB-CB 4.04Å; C30-C44 WeakPolarHBondContact CB-SG 3.43Å; C30-C44 VanDerWaalsContact SG-CA 3.56Å; C30-C44 WeakPolarHBondContact SG-CB 3.44Å; C30-C44 CovalentContact SG-SG 2.03Å; C30-C44 PolarHBondContact SG-SG 3.19Å; C44-K47 WeakPolarHBondContact O-CG 3.21Å; C44-L49 HydrophobicContact CB-CD1 3.72Å; C44-T64 WeakPolarHBondContact CA-O 3.43Å; C44-T64 WeakPolarHBondContact CB-O 3.36Å; C44-T64 PolarHBondContact N-O 3.21Å; C44-M65 HydrophobicContact CB-CB 4.43Å; C44-M65 HydrophobicContact CB-CG 3.51Å; C44-N68 PolarHBondContact O-ND2 3.42Å
45	N	92.6	Very high	79.6	Confident	44 Å²	44	87.5 Å²	87.5	24%	0.235	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	138.9	-170.9	-59.4	-50.8	0	0	0	113.3	K47 T64 N66	N45-K47 VanDerWaalsContact C-N 3.33Å; N45-K47 WeakPolarHBondContact O-CD 3.27Å; N45-K47 VanDerWaalsContact O-CE 3.23Å; N45-K47 WeakPolarHBondContact O-CE 3.13Å; N45-K47 WeakPolarHBondContact O-CG 3.48Å; N45-K47 PolarHBondContact O-N 3.07Å; N45-T64 PolarHBondContact ND2-OG1 2.92Å; N45-T64 WeakPolarHBondContact OD1-CB 3.41Å; N45-T64 PolarHBondContact OD1-O 3.23Å; N45-T64 PolarHBondContact OD1-OG1 3.13Å; N45-N66 CarbonylContact C-O 3.56Å; N45-N66 VanDerWaalsContact CA-O 3.3Å; N45-N66 WeakPolarHBondContact CA-O 3.21Å; N45-N66 WeakPolarHBondContact OD1-CB 3.36Å; N45-N66 PolarHBondContact OD1-N 3.27Å
46	R	93.3	Very high	81.1	Confident	195 Å²	195	87.1 Å²	87.1	74%	0.736	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	36.5	177.3	-61.7	176.3	179.6	171.9	1.1	114.5	N66 H67	R46-N66 PolarHBondContact N-O 3.25Å; R46-H67 WeakPolarHBondContact CA-O 3.37Å; R46-H67 HydrophobicContact CG-CB 3.66Å
47	K	92.4	Very high	82.7	Confident	78 Å²	78	78.7 Å²	78.7	34%	0.339	40%	0.4	S	S	.	.	S	Bend	trans	-102.1	-0.1	-174.8	-56.6	-57.7	176.1	145	0	114.4	P29 C44 N45 L49 N68	P29-K47 HydrophobicContact CB-CD 4.21Å; P29-K47 HydrophobicContact CG-CB 3.8Å; P29-K47 HydrophobicContact CG-CD 4.31Å; P29-K47 HydrophobicContact CG-CG 4.08Å; P29-K47 WeakPolarHBondContact O-CD 3.15Å; P29-K47 VanDerWaalsContact O-CE 3.22Å; P29-K47 WeakPolarHBondContact O-CE 3.27Å; P29-K47 PolarHBondContact O-NZ 3.12Å; C44-K47 WeakPolarHBondContact O-CG 3.21Å; N45-K47 VanDerWaalsContact C-N 3.33Å; N45-K47 WeakPolarHBondContact O-CD 3.27Å; N45-K47 VanDerWaalsContact O-CE 3.23Å; N45-K47 WeakPolarHBondContact O-CE 3.13Å; N45-K47 WeakPolarHBondContact O-CG 3.48Å; N45-K47 PolarHBondContact O-N 3.07Å; K47-L49 VanDerWaalsContact C-N 3.27Å; K47-L49 HydrophobicContact CB-CD1 4.21Å; K47-L49 HydrophobicContact CB-CG 3.9Å; K47-L49 PolarHBondContact O-N 3.48Å; K47-N68 WeakPolarHBondContact CA-OD1 3Å; K47-N68 PolarHBondContact N-OD1 3.22Å
48	R	91.3	Very high	84	Confident	213 Å²	213	78.2 Å²	78.2	80%	0.804	40%	0.397	S	S	*	.			trans	56.3	37.4	-173.6	-57.8	-174.2	179.8	-168.3	-0.4	113.2	N68	R48-N68 PolarHBondContact N-OD1 2.85Å
49	L	90.6	Very high	85.3	Confident	24 Å²	24	74.2 Å²	74.2	13%	0.126	39%	0.387	C	S	.	.			trans	-70.2	129.5	177.5	-66	170.4	0	0	0	110.7	P29 C44 K47 N68 D69 L70	P29-L49 HydrophobicContact CG-CD2 4.19Å; C44-L49 HydrophobicContact CB-CD1 3.72Å; K47-L49 VanDerWaalsContact C-N 3.27Å; K47-L49 HydrophobicContact CB-CD1 4.21Å; K47-L49 HydrophobicContact CB-CG 3.9Å; K47-L49 PolarHBondContact O-N 3.48Å; L49-N68 HydrophobicContact CB-CB 4.15Å; L49-N68 PolarHBondContact N-OD1 2.88Å; L49-D69 CarbonylContact O-C 3.36Å; L49-D69 VanDerWaalsContact O-C 3.31Å; L49-D69 WeakPolarHBondContact O-CA 2.99Å; L49-D69 PolarHBondContact O-N 3Å; L49-L70 HydrophobicContact CB-CD2 4.3Å; L49-L70 PolarHBondContact O-N 2.03Å
50	S	91.2	Very high	86.6	Confident	98 Å²	98	71.2 Å²	71.2	69%	0.685	37%	0.368	S	S	*	.	S	Bend	trans	-98.5	-13.5	170.2	54.4	0	0	0	0	113.2
51	A	88.6	Confident	87.1	Confident	60 Å²	60	68.3 Å²	68.3	50%	0.496	36%	0.358	S	S	.	.	S	Bend	trans	-143	169.9	175.8	0	0	0	0	0	110.5
52	A	86.9	Confident	87.4	Confident	24 Å²	24	69.7 Å²	69.7	20%	0.198	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-62.9	149.9	174.2	0	0	0	0	0	112	P74 F75 L76	A52-P74 HydrophobicContact CB-CB 3.8Å; A52-F75 WeakPolarHBondContact CB-O 3.34Å; A52-L76 HydrophobicContact CB-CD2 4.05Å
53	P	85.2	Confident	87.6	Confident	14 Å²	14	69.7 Å²	69.7	9%	0.091	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-63.9	140.8	169.8	28.6	-34.8	0	0	0	111	P27 L42 V56 L76	P27-P53 HydrophobicContact CB-CB 4.06Å; P27-P53 HydrophobicContact CG-CB 4.07Å; L42-P53 HydrophobicContact CD2-CG 4.19Å; P53-V56 HydrophobicContact CG-CG2 4.06Å; P53-L76 HydrophobicContact CG-CD2 4.22Å
54	L	79.7	Confident	87.7	Confident	145 Å²	145	66.9 Å²	66.9	76%	0.759	35%	0.352	S	S	*	.	S	Bend	trans	-76.2	158	167.3	-64.5	169.6	0	0	0	109.8	P27 V56	P27-L54 WeakPolarHBondContact CB-O 3.37Å; L54-V56 PolarHBondContact O-N 3.13Å
55	D	78.3	Confident	87.8	Confident	148 Å²	148	66.9 Å²	66.9	79%	0.791	35%	0.352	S	S	*	.	S	Bend	trans	55.9	51.6	172.1	-49	-37.1	0	0	0	114.5
56	V	84	Confident	88	Confident	18 Å²	18	65.9 Å²	65.9	11%	0.109	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-67.3	132.2	170.9	179	0	0	0	0	110	L42 P53 L54 I60 L76 V79	L42-V56 HydrophobicContact CD2-CG1 4.05Å; L42-V56 HydrophobicContact CD2-CG2 4.07Å; P53-V56 HydrophobicContact CG-CG2 4.06Å; L54-V56 PolarHBondContact O-N 3.13Å; V56-I60 HydrophobicContact CG1-CB 4.43Å; V56-I60 HydrophobicContact CG1-CG1 4.2Å; V56-L76 HydrophobicContact CG2-CB 4.42Å; V56-L76 HydrophobicContact CG2-CD2 3.91Å; V56-V79 HydrophobicContact CB-CG2 4.19Å; V56-V79 HydrophobicContact CG1-CB 4.11Å; V56-V79 HydrophobicContact CG1-CG1 4.02Å; V56-V79 HydrophobicContact CG1-CG2 4.08Å; V56-V79 WeakPolarHBondContact O-CG2 3.31Å
57	P	80.9	Confident	88.2	Confident	27 Å²	27	60.5 Å²	60.5	18%	0.175	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-65.3	143.6	179.8	-22.8	34.2	0	0	0	113.6	G59 I60	P57-G59 PolarHBondContact O-N 3.5Å; P57-I60 HydrophobicContact CB-CG1 4.47Å; P57-I60 WeakPolarHBondContact O-CG1 3.49Å
58	D	75.6	Confident	88.3	Confident	137 Å²	137	57.1 Å²	57.1	73%	0.733	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	130.2	168.5	-68.4	-44.4	0	0	0	110.2
59	G	79.9	Confident	88.5	Confident	31 Å²	31	49.4 Å²	49.4	32%	0.32	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	114.2	-15	-179.9	0	0	0	0	0	115.2	V39 H40 P57 T61	V39-G59 CarbonylContact O-C 3.57Å; H40-G59 PolarHBondContact ND1-O 2.95Å; P57-G59 PolarHBondContact O-N 3.5Å; G59-T61 PolarHBondContact O-N 2.93Å
60	I	87.9	Confident	88.8	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	29%	0.285	C	S	.	.			trans	-63.6	133.7	171.3	-58.3	-63.7	0	0	0	110.1	V39 L42 V56 P57 Q62 V63 V79 I83	V39-I60 HydrophobicContact CG1-CD1 4.18Å; L42-I60 HydrophobicContact CB-CD1 4.28Å; L42-I60 HydrophobicContact CB-CG1 4.46Å; L42-I60 HydrophobicContact CB-CG2 3.87Å; V56-I60 HydrophobicContact CG1-CB 4.43Å; V56-I60 HydrophobicContact CG1-CG1 4.2Å; P57-I60 HydrophobicContact CB-CG1 4.47Å; P57-I60 WeakPolarHBondContact O-CG1 3.49Å; I60-Q62 WeakPolarHBondContact CG2-O 3.5Å; I60-V63 HydrophobicContact CG2-CG2 3.76Å; I60-V79 HydrophobicContact CB-CG1 4.14Å; I60-I83 HydrophobicContact CB-CD1 4.49Å; I60-I83 HydrophobicContact CG2-CD1 3.95Å; I60-I83 WeakPolarHBondContact O-CD1 3.47Å
61	T	90.8	Very high	88.9	Confident	38 Å²	38	46.1 Å²	46.1	23%	0.233	27%	0.272	C	S	.	.			trans	-123.9	-17.9	175.5	58.6	0	0	0	0	112.7	H40 G59 I83 T84 S85	H40-T61 PolarHBondContact O-N 3.43Å; H40-T61 PolarHBondContact O-OG1 2.82Å; G59-T61 PolarHBondContact O-N 2.93Å; T61-I83 CarbonylContact O-C 3.57Å; T61-I83 WeakPolarHBondContact O-CA 3.4Å; T61-T84 PolarHBondContact O-N 2.69Å; T61-T84 PolarHBondContact O-OG1 3.03Å; T61-S85 PolarHBondContact O-N 3.29Å
62	Q	92.5	Very high	89	Confident	81 Å²	81	47.4 Å²	47.4	38%	0.379	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	136.1	178.4	-47.3	-170	8.1	0	0	110.7	H40 I41 L42 I60 S85	H40-Q62 PolarHBondContact O-N 2.99Å; I41-Q62 CarbonylContact C-O 3.22Å; I41-Q62 WeakPolarHBondContact CA-O 3.45Å; I41-Q62 HydrophobicContact CG1-CB 4.19Å; I41-Q62 HydrophobicContact CG1-CG 4.45Å; I41-Q62 HydrophobicContact CG2-CB 4.4Å; L42-Q62 PolarHBondContact N-O 3.46Å; I60-Q62 WeakPolarHBondContact CG2-O 3.5Å; Q62-S85 CarbonylContact C-O 3.37Å; Q62-S85 WeakPolarHBondContact CA-O 3.21Å
63	V	93.9	Very high	89.4	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	129.9	-178.9	-172	0	0	0	0	111.3	L42 I60 M65 L76 I83 S85 L86 S87	L42-V63 HydrophobicContact CB-CG1 4.25Å; L42-V63 HydrophobicContact CB-CG2 4.27Å; L42-V63 HydrophobicContact CD2-CG1 4.06Å; L42-V63 HydrophobicContact CG-CG1 4.4Å; L42-V63 WeakPolarHBondContact O-CA 3.3Å; I60-V63 HydrophobicContact CG2-CG2 3.76Å; V63-M65 HydrophobicContact CG1-CE 3.69Å; V63-M65 HydrophobicContact CG1-CG 4.34Å; V63-L76 HydrophobicContact CB-CD1 4.41Å; V63-L76 HydrophobicContact CG1-CD1 4.29Å; V63-L76 HydrophobicContact CG2-CD1 3.92Å; V63-I83 HydrophobicContact CG2-CD1 3.63Å; V63-I83 HydrophobicContact CG2-CG1 4.18Å; V63-I83 HydrophobicContact CG2-CG2 4.33Å; V63-S85 PolarHBondContact N-O 3.28Å; V63-L86 HydrophobicContact CB-CD1 3.93Å; V63-L86 HydrophobicContact CG1-CD1 4.29Å; V63-S87 PolarHBondContact O-N 2.65Å
64	T	94.3	Very high	89.7	Confident	29 Å²	29	46.4 Å²	46.4	18%	0.178	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	116.5	174.9	63.1	0	0	0	0	110.5	L42 C44 N45	L42-T64 PolarHBondContact O-N 3.01Å; C44-T64 WeakPolarHBondContact CA-O 3.43Å; C44-T64 WeakPolarHBondContact CB-O 3.36Å; C44-T64 PolarHBondContact N-O 3.21Å; N45-T64 PolarHBondContact ND2-OG1 2.92Å; N45-T64 WeakPolarHBondContact OD1-CB 3.41Å; N45-T64 PolarHBondContact OD1-O 3.23Å; N45-T64 PolarHBondContact OD1-OG1 3.13Å
65	M	94.6	Very high	90.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.254	C	S	.	.			trans	-122.1	41.3	-178.2	-91.1	-176	-78.6	0	0	110.3	C44 V63 N68 L70 P74 L76 L86 S87 L88 N91	C44-M65 HydrophobicContact CB-CB 4.43Å; C44-M65 HydrophobicContact CB-CG 3.51Å; V63-M65 HydrophobicContact CG1-CE 3.69Å; V63-M65 HydrophobicContact CG1-CG 4.34Å; M65-N68 PolarHBondContact O-ND2 2.82Å; M65-L70 HydrophobicContact CB-CD1 4.09Å; M65-L70 HydrophobicContact SD-CD1 4.11Å; M65-P74 HydrophobicContact CE-CB 3.85Å; M65-P74 HydrophobicContact CE-CG 3.59Å; M65-P74 HydrophobicContact SD-CB 4.23Å; M65-P74 HydrophobicContact SD-CG 4.34Å; M65-L76 HydrophobicContact CE-CD1 4.23Å; M65-L76 HydrophobicContact CE-CD2 3.9Å; M65-L76 HydrophobicContact CE-CG 4.42Å; M65-L86 HydrophobicContact CE-CD1 4.05Å; M65-S87 PolarHBondContact N-O 3.36Å; M65-L88 HydrophobicContact CB-CD2 3.74Å; M65-L88 HydrophobicContact CE-CD2 4.17Å; M65-N91 PolarHBondContact O-ND2 3.01Å
66	N	96.3	Very high	90.9	Very high	23 Å²	23	38.9 Å²	38.9	12%	0.123	22%	0.218	C	C	.	.			trans	-81.8	149.4	-169.5	-57.6	-30.4	0	0	0	113	N45 R46 N68 S87 L88 V89	N45-N66 CarbonylContact C-O 3.56Å; N45-N66 VanDerWaalsContact CA-O 3.3Å; N45-N66 WeakPolarHBondContact CA-O 3.21Å; N45-N66 WeakPolarHBondContact OD1-CB 3.36Å; N45-N66 PolarHBondContact OD1-N 3.27Å; R46-N66 PolarHBondContact N-O 3.25Å; N66-N68 PolarHBondContact O-ND2 3.47Å; N66-S87 PolarHBondContact ND2-OG 3.32Å; N66-S87 PolarHBondContact OD1-O 3.39Å; N66-S87 VanDerWaalsContact OD1-O 3.06Å; N66-S87 PolarHBondContact OD1-OG 3.29Å; N66-S87 VanDerWaalsContact OD1-OG 3.08Å; N66-L88 PolarHBondContact OD1-N 3.47Å; N66-V89 CarbonylContact C-O 3.5Å; N66-V89 WeakPolarHBondContact CA-O 3.27Å; N66-V89 HydrophobicContact CB-CB 4.19Å; N66-V89 WeakPolarHBondContact CB-O 3.49Å; N66-V89 WeakPolarHBondContact OD1-CB 3.39Å; N66-V89 PolarHBondContact OD1-N 2.03Å
67	H	96.9	Very high	91	Very high	82 Å²	82	39.3 Å²	39.3	38%	0.38	23%	0.227	S	C	.	.	S	Bend	trans	59.1	52.5	179.5	-51.1	80	0	0	0	112.2	R46 V89 H90	R46-H67 WeakPolarHBondContact CA-O 3.37Å; R46-H67 HydrophobicContact CG-CB 3.66Å; H67-V89 PolarHBondContact N-O 2.75Å; H67-H90 WeakPolarHBondContact CA-O 3.4Å; H67-H90 HydrophobicContact CB-CB 4.46Å; H67-H90 AromaticContact CD2-CG 3.8Å; H67-H90 AromaticContact CD2-ND1 3.65Å; H67-H90 AromaticContact CE1-ND1 3.76Å; H67-H90 PolarHBondContact N-O 3.17Å; H67-H90 AromaticContact NE2-CE1 3.93Å; H67-H90 AromaticContact NE2-CG 3.82Å; H67-H90 AromaticContact NE2-ND1 3.16Å; H67-H90 PolarHBondContact NE2-ND1 3.18Å; H67-H90 VanDerWaalsContact NE2-ND1 3.16Å
68	N	95.6	Very high	91.2	Very high	7 Å²	7	45.1 Å²	45.1	4%	0.037	26%	0.256	C	S	.	.	S	Bend	trans	-124.8	-172.5	178.6	-74.3	-56.6	0	0	0	110	C44 K47 R48 L49 M65 N66 L70 H90 N91	C44-N68 PolarHBondContact O-ND2 3.42Å; K47-N68 WeakPolarHBondContact CA-OD1 3Å; K47-N68 PolarHBondContact N-OD1 3.22Å; R48-N68 PolarHBondContact N-OD1 2.85Å; L49-N68 HydrophobicContact CB-CB 4.15Å; L49-N68 PolarHBondContact N-OD1 2.88Å; M65-N68 PolarHBondContact O-ND2 2.82Å; N66-N68 PolarHBondContact O-ND2 3.47Å; N68-L70 HydrophobicContact CB-CG 4.35Å; N68-H90 PolarHBondContact N-O 2.77Å; N68-N91 WeakPolarHBondContact CA-OD1 3.36Å; N68-N91 WeakPolarHBondContact CB-OD1 3.33Å; N68-N91 PolarHBondContact O-OD1 2.96Å
69	D	95.8	Very high	91.9	Very high	52 Å²	52	38.8 Å²	38.8	28%	0.278	22%	0.222	S	C	.	.			trans	-112.1	23.7	-175.4	-67	-60.8	0	0	0	112.1	L49 A71 R92	L49-D69 CarbonylContact O-C 3.36Å; L49-D69 VanDerWaalsContact O-C 3.31Å; L49-D69 WeakPolarHBondContact O-CA 2.99Å; L49-D69 PolarHBondContact O-N 3Å; D69-A71 PolarHBondContact O-N 2.81Å; D69-R92 IonicContact OD1-CZ 2.69Å; D69-R92 IonicContact OD1-NE 3.1Å; D69-R92 PolarHBondContact OD1-NE 2.89Å; D69-R92 IonicContact OD1-NH2 2.67Å; D69-R92 PolarHBondContact OD1-NH2 3.18Å
70	L	95.1	Very high	92.4	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.01	21%	0.207	C	C	.	.			trans	-62.5	116.1	-179.8	-58.2	175.3	0	0	0	110.1	L49 M65 N68 P74 L88 N91 R92 I93	L49-L70 HydrophobicContact CB-CD2 4.3Å; L49-L70 PolarHBondContact O-N 2.03Å; M65-L70 HydrophobicContact CB-CD1 4.09Å; M65-L70 HydrophobicContact SD-CD1 4.11Å; N68-L70 HydrophobicContact CB-CG 4.35Å; L70-P74 HydrophobicContact CD1-CG 4.44Å; L70-L88 HydrophobicContact CD1-CD2 3.81Å; L70-N91 HydrophobicContact CB-CB 4.2Å; L70-N91 VanDerWaalsContact CB-OD1 3.3Å; L70-N91 WeakPolarHBondContact CB-OD1 3.28Å; L70-N91 WeakPolarHBondContact CG-OD1 3.35Å; L70-N91 PolarHBondContact N-OD1 3.28Å; L70-N91 VanDerWaalsContact N-OD1 3.14Å; L70-R92 CarbonylContact O-C 3.59Å; L70-R92 VanDerWaalsContact O-C 3.29Å; L70-R92 VanDerWaalsContact O-CA 3.28Å; L70-R92 WeakPolarHBondContact O-CA 3.47Å; L70-R92 WeakPolarHBondContact O-CB 3.39Å; L70-R92 PolarHBondContact O-N 3.01Å; L70-I93 PolarHBondContact O-N 2.89Å; L70-I93 VanDerWaalsContact O-N 3.14Å
71	A	93.8	Very high	92.6	Very high	50 Å²	50	39.2 Å²	39.2	41%	0.413	22%	0.221	S	C	.	.			trans	-93.1	-16.7	177.5	0	0	0	0	0	113.5	D69	D69-A71 PolarHBondContact O-N 2.81Å
72	V	91.8	Very high	92.6	Very high	88 Å²	88	41 Å²	41	53%	0.533	23%	0.229	S	C	.	.	S	Bend	trans	-131.1	155	-175	-175.2	0	0	0	0	107.8	E100	V72-E100 WeakPolarHBondContact CG1-OE1 3.44Å
73	F	93.8	Very high	92.7	Very high	11 Å²	11	37.2 Å²	37.2	5%	0.048	21%	0.211	C	C	.	.			trans	-64.7	132.6	176.9	-159.7	-88	0	0	0	110.5	L86 L88 L96 E100 L101 Y104 L110 L112	F73-L86 HydrophobicContact CE1-CD2 3.82Å; F73-L86 HydrophobicContact CE2-CD2 4.46Å; F73-L86 HydrophobicContact CZ-CD2 3.56Å; F73-L88 HydrophobicContact CD2-CD1 4.02Å; F73-L88 HydrophobicContact CE2-CD1 3.77Å; F73-L88 HydrophobicContact CZ-CD1 4.21Å; F73-L96 HydrophobicContact CD2-CD2 3.86Å; F73-L96 HydrophobicContact CE2-CD2 4.27Å; F73-E100 HydrophobicContact CB-CB 3.89Å; F73-E100 HydrophobicContact CB-CG 4.44Å; F73-E100 HydrophobicContact CD1-CB 4.29Å; F73-E100 HydrophobicContact CG-CB 4.36Å; F73-L101 HydrophobicContact CD1-CG 4.34Å; F73-L101 HydrophobicContact CD2-CD1 4.31Å; F73-L101 HydrophobicContact CD2-CG 4.42Å; F73-L101 HydrophobicContact CE1-CG 3.94Å; F73-L101 HydrophobicContact CE2-CD1 4.3Å; F73-L101 HydrophobicContact CE2-CD2 4.03Å; F73-L101 HydrophobicContact CE2-CG 4.02Å; F73-L101 HydrophobicContact CG-CD1 4.49Å; F73-L101 HydrophobicContact CZ-CD1 4.48Å; F73-L101 HydrophobicContact CZ-CD2 3.85Å; F73-L101 HydrophobicContact CZ-CG 3.75Å; F73-Y104 HydrophobicContact CD1-CE2 4.14Å; F73-Y104 AromaticContact CE1-CD2 3.91Å; F73-Y104 HydrophobicContact CE1-CD2 3.91Å; F73-Y104 AromaticContact CE1-CE2 3.61Å; F73-Y104 HydrophobicContact CE1-CE2 3.61Å; F73-L110 HydrophobicContact CE2-CD1 4.05Å; F73-L110 HydrophobicContact CE2-CD2 4.32Å; F73-L110 HydrophobicContact CZ-CD1 4.1Å; F73-L112 HydrophobicContact CE2-CD2 4.37Å
74	P	93.1	Very high	92.8	Very high	6 Å²	6	39.4 Å²	39.4	4%	0.039	22%	0.224	C	C	.	.			trans	-74.2	147.7	-174	28.4	-33.8	0	0	0	112.6	A52 M65 L70 L88 Y104	A52-P74 HydrophobicContact CB-CB 3.8Å; M65-P74 HydrophobicContact CE-CB 3.85Å; M65-P74 HydrophobicContact CE-CG 3.59Å; M65-P74 HydrophobicContact SD-CB 4.23Å; M65-P74 HydrophobicContact SD-CG 4.34Å; L70-P74 HydrophobicContact CD1-CG 4.44Å; P74-L88 HydrophobicContact CG-CD1 4.11Å; P74-L88 HydrophobicContact CG-CD2 3.72Å; P74-Y104 WeakPolarHBondContact O-CE2 3.3Å; P74-Y104 PolarHBondContact O-OH 3.16Å
75	F	91.5	Very high	92.9	Very high	127 Å²	127	39.4 Å²	39.4	56%	0.557	23%	0.225	S	C	*	.			trans	-112.5	126.7	169.2	177	-115.1	0	0	0	109.6	A52 P103	A52-F75 WeakPolarHBondContact CB-O 3.34Å; F75-P103 HydrophobicContact CD2-CB 4.27Å; F75-P103 HydrophobicContact CD2-CG 3.96Å; F75-P103 HydrophobicContact CE2-CB 3.98Å; F75-P103 HydrophobicContact CE2-CG 3.84Å
76	L	90.1	Very high	93	Very high	8 Å²	8	39.5 Å²	39.5	4%	0.042	23%	0.226	C	C	.	.			trans	-107.5	23.8	-173.2	-61.6	166.5	0	0	0	112.4	A52 P53 V56 V63 M65 S80 I83 Y104	A52-L76 HydrophobicContact CB-CD2 4.05Å; P53-L76 HydrophobicContact CG-CD2 4.22Å; V56-L76 HydrophobicContact CG2-CB 4.42Å; V56-L76 HydrophobicContact CG2-CD2 3.91Å; V63-L76 HydrophobicContact CB-CD1 4.41Å; V63-L76 HydrophobicContact CG1-CD1 4.29Å; V63-L76 HydrophobicContact CG2-CD1 3.92Å; M65-L76 HydrophobicContact CE-CD1 4.23Å; M65-L76 HydrophobicContact CE-CD2 3.9Å; M65-L76 HydrophobicContact CE-CG 4.42Å; L76-S80 PolarHBondContact N-OG 3.47Å; L76-S80 VanDerWaalsContact N-OG 3.12Å; L76-I83 HydrophobicContact CD1-CG1 4.23Å; L76-Y104 HydrophobicContact CD1-CE1 4.16Å; L76-Y104 WeakPolarHBondContact CG-OH 3.33Å
77	G	87.3	Confident	93.1	Very high	27 Å²	27	39.3 Å²	39.3	28%	0.278	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	66.4	-145	-177.7	0	0	0	0	0	112.3	V79 S80	G77-V79 PolarHBondContact O-N 3.05Å; G77-S80 WeakPolarHBondContact O-CB 3.49Å; G77-S80 PolarHBondContact O-N 3.02Å
78	N	85.1	Confident	93.1	Very high	148 Å²	148	35.4 Å²	35.4	79%	0.791	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-63	-26.5	-178.9	-68.4	-5.7	0	0	0	112.9	S80 S81	N78-S80 PolarHBondContact O-N 3.44Å; N78-S81 PolarHBondContact O-OG 3.09Å
79	V	88.9	Confident	93.2	Very high	5 Å²	5	36.1 Å²	36.1	3%	0.03	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-69.2	-21.1	-177.8	-168.8	0	0	0	0	112	V56 I60 G77 S81 N82 I83	V56-V79 HydrophobicContact CB-CG2 4.19Å; V56-V79 HydrophobicContact CG1-CB 4.11Å; V56-V79 HydrophobicContact CG1-CG1 4.02Å; V56-V79 HydrophobicContact CG1-CG2 4.08Å; V56-V79 WeakPolarHBondContact O-CG2 3.31Å; I60-V79 HydrophobicContact CB-CG1 4.14Å; G77-V79 PolarHBondContact O-N 3.05Å; V79-S81 PolarHBondContact O-N 3.15Å; V79-N82 PolarHBondContact O-N 2.78Å; V79-I83 HydrophobicContact CG1-CD1 4.02Å
80	S	91.6	Very high	93.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-50.9	-34.1	177.3	-78.2	0	0	0	0	113.7	L76 G77 N78 N82 I83 P103 Y104	L76-S80 PolarHBondContact N-OG 3.47Å; L76-S80 VanDerWaalsContact N-OG 3.12Å; G77-S80 WeakPolarHBondContact O-CB 3.49Å; G77-S80 PolarHBondContact O-N 3.02Å; N78-S80 PolarHBondContact O-N 3.44Å; S80-N82 PolarHBondContact O-N 3.23Å; S80-I83 PolarHBondContact O-N 2.86Å; S80-P103 CarbonylContact C-O 3.41Å; S80-Y104 WeakPolarHBondContact O-CA 3.44Å; S80-Y104 WeakPolarHBondContact O-CD1 3.48Å; S80-Y104 VanDerWaalsContact OG-CZ 3.22Å; S80-Y104 PolarHBondContact OG-OH 3.19Å
81	S	92.2	Very high	93.4	Very high	40 Å²	40	38.1 Å²	38.1	28%	0.28	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-66.7	-23.8	179.9	61.2	0	0	0	0	114.1	N78 V79 P103 I105 S106	N78-S81 PolarHBondContact O-OG 3.09Å; V79-S81 PolarHBondContact O-N 3.15Å; S81-P103 VanDerWaalsContact CA-O 3.27Å; S81-P103 WeakPolarHBondContact CA-O 3.27Å; S81-P103 PolarHBondContact N-O 2.98Å; S81-I105 WeakPolarHBondContact O-CG1 3.35Å; S81-S106 VanDerWaalsContact O-CB 3.23Å; S81-S106 WeakPolarHBondContact O-CB 3.02Å; S81-S106 PolarHBondContact O-OG 2.82Å
82	N	91.3	Very high	93.5	Very high	76 Å²	76	42.8 Å²	42.8	41%	0.406	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-98.7	-7	-174.2	-61.5	1.9	0	0	0	112.4	V79 S80 T84	V79-N82 PolarHBondContact O-N 2.78Å; S80-N82 PolarHBondContact O-N 3.23Å; N82-T84 PolarHBondContact O-N 3.31Å
83	I	94	Very high	93.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.202	C	C	.	.			trans	-73	117.1	179.8	-55.6	-46.7	0	0	0	110	I60 T61 V63 L76 V79 S80 S85 L86 Y104 S106 L107	I60-I83 HydrophobicContact CB-CD1 4.49Å; I60-I83 HydrophobicContact CG2-CD1 3.95Å; I60-I83 WeakPolarHBondContact O-CD1 3.47Å; T61-I83 CarbonylContact O-C 3.57Å; T61-I83 WeakPolarHBondContact O-CA 3.4Å; V63-I83 HydrophobicContact CG2-CD1 3.63Å; V63-I83 HydrophobicContact CG2-CG1 4.18Å; V63-I83 HydrophobicContact CG2-CG2 4.33Å; L76-I83 HydrophobicContact CD1-CG1 4.23Å; V79-I83 HydrophobicContact CG1-CD1 4.02Å; S80-I83 PolarHBondContact O-N 2.86Å; I83-S85 VanDerWaalsContact CG2-O 3.27Å; I83-S85 WeakPolarHBondContact CG2-O 3.04Å; I83-L86 HydrophobicContact CG2-CB 4.24Å; I83-Y104 HydrophobicContact CB-CD1 4.04Å; I83-Y104 HydrophobicContact CB-CE1 4.24Å; I83-Y104 HydrophobicContact CG1-CD1 4.44Å; I83-Y104 HydrophobicContact CG1-CE1 4.2Å; I83-Y104 HydrophobicContact CG2-CD1 4.43Å; I83-S106 CarbonylContact O-C 3.59Å; I83-L107 HydrophobicContact CG2-CD1 4.19Å; I83-L107 VanDerWaalsContact O-CA 3.3Å; I83-L107 WeakPolarHBondContact O-CA 3.28Å; I83-L107 PolarHBondContact O-N 3.14Å
84	T	95.4	Very high	93.7	Very high	47 Å²	47	41 Å²	41	29%	0.288	22%	0.221	S	C	.	.	S	Bend	trans	-94.9	-24.7	173.7	60.7	0	0	0	0	112.6	T61 N82 S106 E108 T109	T61-T84 PolarHBondContact O-N 2.69Å; T61-T84 PolarHBondContact O-OG1 3.03Å; N82-T84 PolarHBondContact O-N 3.31Å; T84-S106 WeakPolarHBondContact CA-O 3.47Å; T84-E108 PolarHBondContact O-N 3.02Å; T84-T109 PolarHBondContact O-N 3.18Å
85	S	96.5	Very high	93.7	Very high	28 Å²	28	44.6 Å²	44.6	20%	0.196	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	125.4	-178.9	177.5	0	0	0	0	112.1	T61 Q62 V63 I83 T109	T61-S85 PolarHBondContact O-N 3.29Å; Q62-S85 CarbonylContact C-O 3.37Å; Q62-S85 WeakPolarHBondContact CA-O 3.21Å; V63-S85 PolarHBondContact N-O 3.28Å; I83-S85 VanDerWaalsContact CG2-O 3.27Å; I83-S85 WeakPolarHBondContact CG2-O 3.04Å; S85-T109 WeakPolarHBondContact CA-OG1 3.41Å; S85-T109 VanDerWaalsContact CB-OG1 3.27Å; S85-T109 WeakPolarHBondContact CB-OG1 3.34Å; S85-T109 PolarHBondContact OG-OG1 3.23Å; S85-T109 VanDerWaalsContact OG-OG1 3.09Å
86	L	96.9	Very high	93.7	Very high	2 Å²	2	39 Å²	39	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	120.8	179	-176.9	58.7	0	0	0	111.6	V63 M65 F73 I83 L88 Y104 L107 T109 L110 D111	V63-L86 HydrophobicContact CB-CD1 3.93Å; V63-L86 HydrophobicContact CG1-CD1 4.29Å; M65-L86 HydrophobicContact CE-CD1 4.05Å; F73-L86 HydrophobicContact CE1-CD2 3.82Å; F73-L86 HydrophobicContact CE2-CD2 4.46Å; F73-L86 HydrophobicContact CZ-CD2 3.56Å; I83-L86 HydrophobicContact CG2-CB 4.24Å; L86-L88 HydrophobicContact CD1-CD2 4.23Å; L86-L88 HydrophobicContact CD1-CG 4.25Å; L86-L88 HydrophobicContact CD2-CD1 4.01Å; L86-L88 HydrophobicContact CG-CD1 4.07Å; L86-L88 HydrophobicContact CG-CG 4.06Å; L86-Y104 HydrophobicContact CD2-CD1 4.4Å; L86-Y104 HydrophobicContact CD2-CE1 3.97Å; L86-L107 HydrophobicContact CB-CD1 3.74Å; L86-T109 PolarHBondContact N-O 3.14Å; L86-L110 HydrophobicContact CB-CD1 4.18Å; L86-L110 HydrophobicContact CD2-CD1 4.23Å; L86-L110 HydrophobicContact CG-CD1 4.23Å; L86-L110 WeakPolarHBondContact O-CA 3.07Å; L86-D111 PolarHBondContact O-N 3.06Å
87	S	97.5	Very high	93.8	Very high	20 Å²	20	40.9 Å²	40.9	14%	0.14	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	122.2	178.3	-160.7	0	0	0	0	110.3	V63 M65 N66	V63-S87 PolarHBondContact O-N 2.65Å; M65-S87 PolarHBondContact N-O 3.36Å; N66-S87 PolarHBondContact ND2-OG 3.32Å; N66-S87 PolarHBondContact OD1-O 3.39Å; N66-S87 VanDerWaalsContact OD1-O 3.06Å; N66-S87 PolarHBondContact OD1-OG 3.29Å; N66-S87 VanDerWaalsContact OD1-OG 3.08Å
88	L	97.3	Very high	93.8	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.23	C	C	.	.			trans	-129.2	31.1	-175.9	-63	171	0	0	0	111.4	M65 N66 L70 F73 P74 L86 N91 I93 D111 L112 N115	M65-L88 HydrophobicContact CB-CD2 3.74Å; M65-L88 HydrophobicContact CE-CD2 4.17Å; N66-L88 PolarHBondContact OD1-N 3.47Å; L70-L88 HydrophobicContact CD1-CD2 3.81Å; F73-L88 HydrophobicContact CD2-CD1 4.02Å; F73-L88 HydrophobicContact CE2-CD1 3.77Å; F73-L88 HydrophobicContact CZ-CD1 4.21Å; P74-L88 HydrophobicContact CG-CD1 4.11Å; P74-L88 HydrophobicContact CG-CD2 3.72Å; L86-L88 HydrophobicContact CD1-CD2 4.23Å; L86-L88 HydrophobicContact CD1-CG 4.25Å; L86-L88 HydrophobicContact CD2-CD1 4.01Å; L86-L88 HydrophobicContact CG-CD1 4.07Å; L86-L88 HydrophobicContact CG-CG 4.06Å; L88-N91 VanDerWaalsContact C-ND2 3.32Å; L88-N91 PolarHBondContact O-ND2 2.76Å; L88-I93 HydrophobicContact CB-CD1 4.23Å; L88-I93 HydrophobicContact CD1-CD1 3.95Å; L88-D111 PolarHBondContact N-O 2.95Å; L88-L112 HydrophobicContact CB-CD2 4.03Å; L88-L112 HydrophobicContact CD1-CD2 3.91Å; L88-N115 PolarHBondContact O-ND2 2.93Å
89	V	97.9	Very high	94	Very high	22 Å²	22	42.7 Å²	42.7	13%	0.133	22%	0.22	C	C	.	.			trans	-65.3	136.8	-174.9	179.2	0	0	0	0	111.8	N66 H67 D111 T113	N66-V89 CarbonylContact C-O 3.5Å; N66-V89 WeakPolarHBondContact CA-O 3.27Å; N66-V89 HydrophobicContact CB-CB 4.19Å; N66-V89 WeakPolarHBondContact CB-O 3.49Å; N66-V89 WeakPolarHBondContact OD1-CB 3.39Å; N66-V89 PolarHBondContact OD1-N 2.03Å; H67-V89 PolarHBondContact N-O 2.75Å; V89-D111 HydrophobicContact CG2-CB 4.01Å; V89-D111 WeakPolarHBondContact CG2-OD1 3.35Å; V89-T113 CarbonylContact C-O 3.29Å; V89-T113 VanDerWaalsContact CA-O 3.25Å; V89-T113 WeakPolarHBondContact CA-O 3.4Å; V89-T113 HydrophobicContact CG1-CG2 4.34Å
90	H	97.6	Very high	94.1	Very high	85 Å²	85	43.9 Å²	43.9	39%	0.394	23%	0.225	S	C	.	.	S	Bend	trans	55.4	65.6	-175	-66.9	107.3	0	0	0	112.2	H67 N68 T113 S114	H67-H90 WeakPolarHBondContact CA-O 3.4Å; H67-H90 HydrophobicContact CB-CB 4.46Å; H67-H90 AromaticContact CD2-CG 3.8Å; H67-H90 AromaticContact CD2-ND1 3.65Å; H67-H90 AromaticContact CE1-ND1 3.76Å; H67-H90 PolarHBondContact N-O 3.17Å; H67-H90 AromaticContact NE2-CE1 3.93Å; H67-H90 AromaticContact NE2-CG 3.82Å; H67-H90 AromaticContact NE2-ND1 3.16Å; H67-H90 PolarHBondContact NE2-ND1 3.18Å; H67-H90 VanDerWaalsContact NE2-ND1 3.16Å; N68-H90 PolarHBondContact N-O 2.77Å; H90-T113 PolarHBondContact N-O 2.9Å; H90-S114 WeakPolarHBondContact CA-O 3.45Å; H90-S114 WeakPolarHBondContact CD2-CB 3.44Å; H90-S114 PolarHBondContact CD2-OG 2.93Å; H90-S114 PolarHBondContact CE1-OG 3.06Å; H90-S114 VanDerWaalsContact NE2-CB 3.31Å; H90-S114 WeakPolarHBondContact NE2-CB 3.14Å; H90-S114 PolarHBondContact NE2-OG 2.89Å
91	N	97.3	Very high	94.2	Very high	10 Å²	10	43.9 Å²	43.9	5%	0.053	23%	0.225	C	C	.	.			trans	-125.9	-168	170.3	-84.3	-75.6	0	0	0	109.9	M65 N68 L70 L88 I93 N115	M65-N91 PolarHBondContact O-ND2 3.01Å; N68-N91 WeakPolarHBondContact CA-OD1 3.36Å; N68-N91 WeakPolarHBondContact CB-OD1 3.33Å; N68-N91 PolarHBondContact O-OD1 2.96Å; L70-N91 HydrophobicContact CB-CB 4.2Å; L70-N91 VanDerWaalsContact CB-OD1 3.3Å; L70-N91 WeakPolarHBondContact CB-OD1 3.28Å; L70-N91 WeakPolarHBondContact CG-OD1 3.35Å; L70-N91 PolarHBondContact N-OD1 3.28Å; L70-N91 VanDerWaalsContact N-OD1 3.14Å; L88-N91 VanDerWaalsContact C-ND2 3.32Å; L88-N91 PolarHBondContact O-ND2 2.76Å; N91-I93 HydrophobicContact CB-CG1 4.39Å; N91-N115 WeakPolarHBondContact CA-OD1 3.47Å; N91-N115 WeakPolarHBondContact CB-OD1 3.3Å; N91-N115 PolarHBondContact O-OD1 3.31Å
92	R	96.6	Very high	94.2	Very high	148 Å²	148	47.4 Å²	47.4	56%	0.558	24%	0.237	S	C	*	.			trans	-113.4	12.6	-176	-56.2	-177	-175.2	-147.7	4.5	113.4	D69 L70 S94 N115	D69-R92 IonicContact OD1-CZ 2.69Å; D69-R92 IonicContact OD1-NE 3.1Å; D69-R92 PolarHBondContact OD1-NE 2.89Å; D69-R92 IonicContact OD1-NH2 2.67Å; D69-R92 PolarHBondContact OD1-NH2 3.18Å; L70-R92 CarbonylContact O-C 3.59Å; L70-R92 VanDerWaalsContact O-C 3.29Å; L70-R92 VanDerWaalsContact O-CA 3.28Å; L70-R92 WeakPolarHBondContact O-CA 3.47Å; L70-R92 WeakPolarHBondContact O-CB 3.39Å; L70-R92 PolarHBondContact O-N 3.01Å; R92-S94 PolarHBondContact O-N 2.8Å; R92-N115 PolarHBondContact N-OD1 2.85Å
93	I	96.1	Very high	94.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.23	C	C	.	.			trans	-59.2	124.2	-175.3	-57.8	172.3	0	0	0	109.5	L70 L88 N91 E95 L96 L112 N115 S116 I117	L70-I93 PolarHBondContact O-N 2.89Å; L70-I93 VanDerWaalsContact O-N 3.14Å; L88-I93 HydrophobicContact CB-CD1 4.23Å; L88-I93 HydrophobicContact CD1-CD1 3.95Å; N91-I93 HydrophobicContact CB-CG1 4.39Å; I93-E95 WeakPolarHBondContact CG2-O 3.34Å; I93-L96 HydrophobicContact CG2-CD2 4.38Å; I93-L112 HydrophobicContact CD1-CD2 3.85Å; I93-N115 HydrophobicContact CB-CB 4.31Å; I93-N115 WeakPolarHBondContact CB-OD1 3.37Å; I93-N115 WeakPolarHBondContact CG1-OD1 3.22Å; I93-N115 PolarHBondContact N-OD1 2.89Å; I93-S116 CarbonylContact O-C 3.57Å; I93-S116 WeakPolarHBondContact O-CA 3.31Å; I93-S116 PolarHBondContact O-N 2.76Å; I93-I117 HydrophobicContact CG2-CG1 4.47Å; I93-I117 PolarHBondContact O-N 3.36Å
94	S	94.4	Very high	94.3	Very high	62 Å²	62	45.7 Å²	45.7	43%	0.434	23%	0.23	S	C	.	.			trans	-106.1	-19.9	-175.1	53.4	0	0	0	0	115.1	R92 I117	R92-S94 PolarHBondContact O-N 2.8Å; S94-I117 WeakPolarHBondContact O-CA 3.39Å
95	E	91.8	Very high	94.2	Very high	82 Å²	82	48.7 Å²	48.7	38%	0.383	24%	0.243	S	C	.	.			trans	-147	169	175	62.7	-175.8	159	0	0	110.9	I93 L97 K121	I93-E95 WeakPolarHBondContact CG2-O 3.34Å; E95-L97 HydrophobicContact CG-CD2 4.18Å; E95-L97 HydrophobicContact CG-CG 4.22Å; E95-K121 IonicContact OE2-NZ 2.76Å; E95-K121 PolarHBondContact OE2-NZ 2.85Å
96	L	92.6	Very high	94.1	Very high	8 Å²	8	49.8 Å²	49.8	4%	0.042	25%	0.251	C	S	.	.			trans	-125	123.8	173.4	-63	173.4	0	0	0	107.4	F73 I93 L101 L112 I117 L120 A124 F125 L135	F73-L96 HydrophobicContact CD2-CD2 3.86Å; F73-L96 HydrophobicContact CE2-CD2 4.27Å; I93-L96 HydrophobicContact CG2-CD2 4.38Å; L96-L101 HydrophobicContact CB-CD1 4.28Å; L96-L101 HydrophobicContact CD2-CD1 4.39Å; L96-L112 HydrophobicContact CD1-CD1 3.83Å; L96-L112 HydrophobicContact CD2-CD1 3.75Å; L96-L112 HydrophobicContact CD2-CD2 4.37Å; L96-L112 HydrophobicContact CG-CD1 4.39Å; L96-I117 HydrophobicContact CD1-CD1 4.18Å; L96-I117 HydrophobicContact CD2-CD1 4.29Å; L96-I117 HydrophobicContact CG-CD1 4.1Å; L96-L120 HydrophobicContact CD1-CD1 4.03Å; L96-A124 HydrophobicContact CB-CB 4.43Å; L96-F125 HydrophobicContact CD1-CE1 4.11Å; L96-F125 HydrophobicContact CD1-CZ 3.98Å; L96-L135 HydrophobicContact CD1-CD2 4.35Å
97	L	90.7	Very high	94.1	Very high	48 Å²	48	49.7 Å²	49.7	25%	0.251	25%	0.25	S	S	.	.			trans	-113.9	134.6	-179.2	-53.8	175.1	0	0	0	110.1	E95 H99 E100	E95-L97 HydrophobicContact CG-CD2 4.18Å; E95-L97 HydrophobicContact CG-CG 4.22Å; L97-H99 PolarHBondContact O-N 2.88Å; L97-E100 HydrophobicContact CB-CG 3.98Å; L97-E100 PolarHBondContact N-OE2 2.74Å; L97-E100 VanDerWaalsContact N-OE2 3.09Å; L97-E100 WeakPolarHBondContact O-CB 3.37Å; L97-E100 PolarHBondContact O-N 2.83Å
98	M	89	Confident	94.1	Very high	91 Å²	91	52.1 Å²	52.1	45%	0.448	26%	0.259	S	S	.	.	H	α-helix	trans	-48.9	-41.2	-174.1	-160.6	-179	69.9	0	0	113.6	E100 L101 Q102 G123 P126	M98-E100 VanDerWaalsContact C-N 3.31Å; M98-E100 PolarHBondContact O-N 3.17Å; M98-L101 PolarHBondContact O-N 2.69Å; M98-Q102 WeakPolarHBondContact O-CB 3.3Å; M98-Q102 PolarHBondContact O-N 2.67Å; M98-G123 WeakPolarHBondContact CB-O 3.15Å; M98-G123 WeakPolarHBondContact CG-O 3.21Å; M98-P126 HydrophobicContact CG-CB 4.36Å
99	H	89	Confident	94.2	Very high	123 Å²	123	54.3 Å²	54.3	57%	0.569	27%	0.273	S	S	*	.	H	α-helix	trans	-72.2	-20.9	-176.1	70.1	-92.9	0	0	0	113.7	L97	L97-H99 PolarHBondContact O-N 2.88Å
100	E	90.8	Very high	94.2	Very high	29 Å²	29	53.3 Å²	53.3	14%	0.136	27%	0.267	C	S	.	.	H	α-helix	trans	-79.8	-34.8	177.5	-57.1	170.7	145.7	0	0	111.5	V72 F73 L97 M98 P103	V72-E100 WeakPolarHBondContact CG1-OE1 3.44Å; F73-E100 HydrophobicContact CB-CB 3.89Å; F73-E100 HydrophobicContact CB-CG 4.44Å; F73-E100 HydrophobicContact CD1-CB 4.29Å; F73-E100 HydrophobicContact CG-CB 4.36Å; L97-E100 HydrophobicContact CB-CG 3.98Å; L97-E100 PolarHBondContact N-OE2 2.74Å; L97-E100 VanDerWaalsContact N-OE2 3.09Å; L97-E100 WeakPolarHBondContact O-CB 3.37Å; L97-E100 PolarHBondContact O-N 2.83Å; M98-E100 VanDerWaalsContact C-N 3.31Å; M98-E100 PolarHBondContact O-N 3.17Å; E100-P103 WeakPolarHBondContact O-CD 3.33Å
101	L	92.5	Very high	94.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-85.9	-19.6	175.2	-71.7	100.3	0	0	0	112.8	F73 L96 M98 P103 Y104 L110 F125 P126	F73-L101 HydrophobicContact CD1-CG 4.34Å; F73-L101 HydrophobicContact CD2-CD1 4.31Å; F73-L101 HydrophobicContact CD2-CG 4.42Å; F73-L101 HydrophobicContact CE1-CG 3.94Å; F73-L101 HydrophobicContact CE2-CD1 4.3Å; F73-L101 HydrophobicContact CE2-CD2 4.03Å; F73-L101 HydrophobicContact CE2-CG 4.02Å; F73-L101 HydrophobicContact CG-CD1 4.49Å; F73-L101 HydrophobicContact CZ-CD1 4.48Å; F73-L101 HydrophobicContact CZ-CD2 3.85Å; F73-L101 HydrophobicContact CZ-CG 3.75Å; L96-L101 HydrophobicContact CB-CD1 4.28Å; L96-L101 HydrophobicContact CD2-CD1 4.39Å; M98-L101 PolarHBondContact O-N 2.69Å; L101-P103 VanDerWaalsContact C-N 3.31Å; L101-Y104 WeakPolarHBondContact O-CB 3.3Å; L101-Y104 PolarHBondContact O-N 2.96Å; L101-L110 HydrophobicContact CD2-CD2 3.81Å; L101-F125 HydrophobicContact CD2-CD1 4.1Å; L101-F125 HydrophobicContact CD2-CE1 4.42Å; L101-P126 HydrophobicContact CB-CG 3.88Å
102	Q	92	Very high	94.2	Very high	115 Å²	115	50.2 Å²	50.2	54%	0.537	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-34.4	-178.6	-171.1	176	-5.6	0	0	115.3	M98 Y104	M98-Q102 WeakPolarHBondContact O-CB 3.3Å; M98-Q102 PolarHBondContact O-N 2.67Å; Q102-Y104 PolarHBondContact O-N 3.1Å
103	P	94.1	Very high	94.3	Very high	39 Å²	39	44.2 Å²	44.2	25%	0.253	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-19.8	173.9	-24.3	36.7	0	0	0	114.7	F75 S80 S81 E100 L101 I105	F75-P103 HydrophobicContact CD2-CB 4.27Å; F75-P103 HydrophobicContact CD2-CG 3.96Å; F75-P103 HydrophobicContact CE2-CB 3.98Å; F75-P103 HydrophobicContact CE2-CG 3.84Å; S80-P103 CarbonylContact C-O 3.41Å; S81-P103 VanDerWaalsContact CA-O 3.27Å; S81-P103 WeakPolarHBondContact CA-O 3.27Å; S81-P103 PolarHBondContact N-O 2.98Å; E100-P103 WeakPolarHBondContact O-CD 3.33Å; L101-P103 VanDerWaalsContact C-N 3.31Å; P103-I105 VanDerWaalsContact C-N 3.32Å; P103-I105 PolarHBondContact O-N 3.29Å; P103-I105 VanDerWaalsContact O-N 3.12Å
104	Y	94.9	Very high	94.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.238	C	C	.	.			trans	-90.4	55.1	-170.3	-68.3	-89.8	0	0	0	112.8	F73 P74 L76 S80 I83 L86 L101 Q102 S106 L107	F73-Y104 HydrophobicContact CD1-CE2 4.14Å; F73-Y104 AromaticContact CE1-CD2 3.91Å; F73-Y104 HydrophobicContact CE1-CD2 3.91Å; F73-Y104 AromaticContact CE1-CE2 3.61Å; F73-Y104 HydrophobicContact CE1-CE2 3.61Å; P74-Y104 WeakPolarHBondContact O-CE2 3.3Å; P74-Y104 PolarHBondContact O-OH 3.16Å; L76-Y104 HydrophobicContact CD1-CE1 4.16Å; L76-Y104 WeakPolarHBondContact CG-OH 3.33Å; S80-Y104 WeakPolarHBondContact O-CA 3.44Å; S80-Y104 WeakPolarHBondContact O-CD1 3.48Å; S80-Y104 VanDerWaalsContact OG-CZ 3.22Å; S80-Y104 PolarHBondContact OG-OH 3.19Å; I83-Y104 HydrophobicContact CB-CD1 4.04Å; I83-Y104 HydrophobicContact CB-CE1 4.24Å; I83-Y104 HydrophobicContact CG1-CD1 4.44Å; I83-Y104 HydrophobicContact CG1-CE1 4.2Å; I83-Y104 HydrophobicContact CG2-CD1 4.43Å; L86-Y104 HydrophobicContact CD2-CD1 4.4Å; L86-Y104 HydrophobicContact CD2-CE1 3.97Å; L101-Y104 WeakPolarHBondContact O-CB 3.3Å; L101-Y104 PolarHBondContact O-N 2.96Å; Q102-Y104 PolarHBondContact O-N 3.1Å; Y104-S106 VanDerWaalsContact C-N 3.28Å; Y104-S106 PolarHBondContact O-N 3.02Å; Y104-L107 VanDerWaalsContact O-CB 3.27Å; Y104-L107 WeakPolarHBondContact O-CB 3.21Å; Y104-L107 PolarHBondContact O-N 2.97Å
105	I	93	Very high	94.6	Very high	111 Å²	111	42.3 Å²	42.3	57%	0.569	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-27.5	-170.4	62.8	173.2	0	0	0	114.8	S81 P103	S81-I105 WeakPolarHBondContact O-CG1 3.35Å; P103-I105 VanDerWaalsContact C-N 3.32Å; P103-I105 PolarHBondContact O-N 3.29Å; P103-I105 VanDerWaalsContact O-N 3.12Å
106	S	94.9	Very high	94.9	Very high	50 Å²	50	40 Å²	40	35%	0.35	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	5.9	-178.8	-53.8	0	0	0	0	113.9	S81 I83 T84 Y104 E108	S81-S106 VanDerWaalsContact O-CB 3.23Å; S81-S106 WeakPolarHBondContact O-CB 3.02Å; S81-S106 PolarHBondContact O-OG 2.82Å; I83-S106 CarbonylContact O-C 3.59Å; T84-S106 WeakPolarHBondContact CA-O 3.47Å; Y104-S106 VanDerWaalsContact C-N 3.28Å; Y104-S106 PolarHBondContact O-N 3.02Å; S106-E108 PolarHBondContact O-N 3.19Å
107	L	96.7	Very high	95.1	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.21	C	C	.	.			trans	-71.8	114.6	-169.6	-173.1	70.6	0	0	0	112.2	I83 L86 Y104 T109 L110 I128 L130	I83-L107 HydrophobicContact CG2-CD1 4.19Å; I83-L107 VanDerWaalsContact O-CA 3.3Å; I83-L107 WeakPolarHBondContact O-CA 3.28Å; I83-L107 PolarHBondContact O-N 3.14Å; L86-L107 HydrophobicContact CB-CD1 3.74Å; Y104-L107 VanDerWaalsContact O-CB 3.27Å; Y104-L107 WeakPolarHBondContact O-CB 3.21Å; Y104-L107 PolarHBondContact O-N 2.97Å; L107-T109 WeakPolarHBondContact CD1-O 3.39Å; L107-L110 HydrophobicContact CD2-CB 4.24Å; L107-L110 HydrophobicContact CD2-CD1 4.45Å; L107-L110 HydrophobicContact CD2-CD2 4.34Å; L107-I128 HydrophobicContact CB-CD1 4.3Å; L107-I128 HydrophobicContact CD2-CD1 4.29Å; L107-L130 HydrophobicContact CD2-CD1 4.25Å; L107-L130 HydrophobicContact CG-CD1 4.01Å; L107-L130 WeakPolarHBondContact O-CA 3.23Å
108	E	97.2	Very high	95.3	Very high	71 Å²	71	40 Å²	40	33%	0.332	22%	0.216	S	C	.	.			trans	-100.6	-31	178.2	-56.3	-158.2	154.4	0	0	112.7	T84 S106 K131 Y132	T84-E108 PolarHBondContact O-N 3.02Å; S106-E108 PolarHBondContact O-N 3.19Å; E108-K131 HydrophobicContact CB-CD 4.39Å; E108-K131 VanDerWaalsContact CD-CE 3.47Å; E108-K131 PolarHBondContact O-N 2.83Å; E108-K131 WeakPolarHBondContact OE1-CE 3.27Å; E108-K131 IonicContact OE1-NZ 2.78Å; E108-K131 PolarHBondContact OE1-NZ 3.23Å; E108-K131 WeakPolarHBondContact OE2-CE 3.48Å; E108-K131 IonicContact OE2-NZ 3.02Å; E108-K131 PolarHBondContact OE2-NZ 2.97Å; E108-Y132 PolarHBondContact O-N 3.37Å
109	T	98.1	Very high	95.5	Very high	47 Å²	47	37.7 Å²	37.7	29%	0.288	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	128.2	-178.1	71.9	0	0	0	0	112.2	T84 S85 L86 L107	T84-T109 PolarHBondContact O-N 3.18Å; S85-T109 WeakPolarHBondContact CA-OG1 3.41Å; S85-T109 VanDerWaalsContact CB-OG1 3.27Å; S85-T109 WeakPolarHBondContact CB-OG1 3.34Å; S85-T109 PolarHBondContact OG-OG1 3.23Å; S85-T109 VanDerWaalsContact OG-OG1 3.09Å; L86-T109 PolarHBondContact N-O 3.14Å; L107-T109 WeakPolarHBondContact CD1-O 3.39Å
110	L	98.1	Very high	95.8	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	118.6	179.7	-179.7	57.5	0	0	0	110.9	F73 L86 L101 L107 L112 F125 L130 Y132 L133 N134	F73-L110 HydrophobicContact CE2-CD1 4.05Å; F73-L110 HydrophobicContact CE2-CD2 4.32Å; F73-L110 HydrophobicContact CZ-CD1 4.1Å; L86-L110 HydrophobicContact CB-CD1 4.18Å; L86-L110 HydrophobicContact CD2-CD1 4.23Å; L86-L110 HydrophobicContact CG-CD1 4.23Å; L86-L110 WeakPolarHBondContact O-CA 3.07Å; L101-L110 HydrophobicContact CD2-CD2 3.81Å; L107-L110 HydrophobicContact CD2-CB 4.24Å; L107-L110 HydrophobicContact CD2-CD1 4.45Å; L107-L110 HydrophobicContact CD2-CD2 4.34Å; L110-L112 HydrophobicContact CD1-CD1 4.32Å; L110-L112 HydrophobicContact CD1-CG 4.13Å; L110-L112 HydrophobicContact CD2-CD1 3.83Å; L110-L112 HydrophobicContact CG-CD1 3.93Å; L110-L112 HydrophobicContact CG-CG 4.11Å; L110-F125 HydrophobicContact CD2-CE1 4.37Å; L110-L130 HydrophobicContact CB-CD1 3.86Å; L110-L130 HydrophobicContact CB-CD2 4.45Å; L110-Y132 PolarHBondContact N-O 3.04Å; L110-L133 HydrophobicContact CB-CD1 4.28Å; L110-L133 HydrophobicContact CD2-CD1 4.13Å; L110-L133 HydrophobicContact CG-CD1 4.25Å; L110-N134 PolarHBondContact O-N 3.21Å
111	D	98.5	Very high	95.8	Very high	30 Å²	30	34.8 Å²	34.8	16%	0.16	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	114	173.6	-157.4	-34.8	0	0	0	111.9	L86 L88 V89 T113 N134	L86-D111 PolarHBondContact O-N 3.06Å; L88-D111 PolarHBondContact N-O 2.95Å; V89-D111 HydrophobicContact CG2-CB 4.01Å; V89-D111 WeakPolarHBondContact CG2-OD1 3.35Å; D111-T113 WeakPolarHBondContact OD1-CB 3.18Å; D111-T113 PolarHBondContact OD1-N 2.91Å; D111-T113 PolarHBondContact OD1-OG1 3.22Å; D111-N134 HydrophobicContact CB-CB 4.38Å; D111-N134 PolarHBondContact OD1-ND2 3.47Å; D111-N134 PolarHBondContact OD2-ND2 2.87Å
112	L	98.1	Very high	95.7	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.217	C	C	.	.			trans	-114.6	22.8	179.6	-73.7	161.3	0	0	0	111.4	F73 L88 I93 L96 L110 N115 I117 N134 L135 N138	F73-L112 HydrophobicContact CE2-CD2 4.37Å; L88-L112 HydrophobicContact CB-CD2 4.03Å; L88-L112 HydrophobicContact CD1-CD2 3.91Å; I93-L112 HydrophobicContact CD1-CD2 3.85Å; L96-L112 HydrophobicContact CD1-CD1 3.83Å; L96-L112 HydrophobicContact CD2-CD1 3.75Å; L96-L112 HydrophobicContact CD2-CD2 4.37Å; L96-L112 HydrophobicContact CG-CD1 4.39Å; L110-L112 HydrophobicContact CD1-CD1 4.32Å; L110-L112 HydrophobicContact CD1-CG 4.13Å; L110-L112 HydrophobicContact CD2-CD1 3.83Å; L110-L112 HydrophobicContact CG-CD1 3.93Å; L110-L112 HydrophobicContact CG-CG 4.11Å; L112-N115 PolarHBondContact O-ND2 3.44Å; L112-I117 HydrophobicContact CB-CD1 4.25Å; L112-I117 HydrophobicContact CD1-CD1 4.19Å; L112-N134 CarbonylContact C-O 3.57Å; L112-N134 WeakPolarHBondContact CA-O 3.31Å; L112-N134 PolarHBondContact N-O 3.04Å; L112-L135 HydrophobicContact CB-CD2 4.01Å; L112-L135 HydrophobicContact CD1-CD2 3.84Å; L112-N138 PolarHBondContact O-ND2 3.28Å
113	T	98.5	Very high	95.4	Very high	22 Å²	22	34.4 Å²	34.4	14%	0.135	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	142.2	-178	-63.2	0	0	0	0	112.6	V89 H90 D111 N115 N134 S136 N137	V89-T113 CarbonylContact C-O 3.29Å; V89-T113 VanDerWaalsContact CA-O 3.25Å; V89-T113 WeakPolarHBondContact CA-O 3.4Å; V89-T113 HydrophobicContact CG1-CG2 4.34Å; H90-T113 PolarHBondContact N-O 2.9Å; D111-T113 WeakPolarHBondContact OD1-CB 3.18Å; D111-T113 PolarHBondContact OD1-N 2.91Å; D111-T113 PolarHBondContact OD1-OG1 3.22Å; T113-N115 PolarHBondContact O-N 3.18Å; T113-N115 PolarHBondContact O-ND2 2.96Å; T113-N134 PolarHBondContact OG1-ND2 3.4Å; T113-N134 PolarHBondContact OG1-OD1 3.35Å; T113-S136 CarbonylContact C-O 3.55Å; T113-S136 VanDerWaalsContact CA-O 3.23Å; T113-S136 WeakPolarHBondContact CA-O 3.35Å; T113-N137 HydrophobicContact CG2-CB 4.32Å
114	S	98.2	Very high	95.2	Very high	15 Å²	15	32.8 Å²	32.8	11%	0.105	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	43.5	177.5	-59.3	0	0	0	0	114.1	H90 S136 N137	H90-S114 WeakPolarHBondContact CA-O 3.45Å; H90-S114 WeakPolarHBondContact CD2-CB 3.44Å; H90-S114 PolarHBondContact CD2-OG 2.93Å; H90-S114 PolarHBondContact CE1-OG 3.06Å; H90-S114 VanDerWaalsContact NE2-CB 3.31Å; H90-S114 WeakPolarHBondContact NE2-CB 3.14Å; H90-S114 PolarHBondContact NE2-OG 2.89Å; S114-S136 PolarHBondContact N-O 2.83Å; S114-N137 WeakPolarHBondContact CA-O 3.44Å; S114-N137 PolarHBondContact OG-ND2 3.05Å
115	N	97.8	Very high	95.1	Very high	7 Å²	7	32.8 Å²	32.8	4%	0.037	19%	0.192	C	C	.	.			trans	-102.2	-166.2	169.3	-84.6	-82.3	0	0	0	110.8	L88 N91 R92 I93 L112 T113 I117 N138	L88-N115 PolarHBondContact O-ND2 2.93Å; N91-N115 WeakPolarHBondContact CA-OD1 3.47Å; N91-N115 WeakPolarHBondContact CB-OD1 3.3Å; N91-N115 PolarHBondContact O-OD1 3.31Å; R92-N115 PolarHBondContact N-OD1 2.85Å; I93-N115 HydrophobicContact CB-CB 4.31Å; I93-N115 WeakPolarHBondContact CB-OD1 3.37Å; I93-N115 WeakPolarHBondContact CG1-OD1 3.22Å; I93-N115 PolarHBondContact N-OD1 2.89Å; L112-N115 PolarHBondContact O-ND2 3.44Å; T113-N115 PolarHBondContact O-N 3.18Å; T113-N115 PolarHBondContact O-ND2 2.96Å; N115-I117 HydrophobicContact CB-CG1 4.33Å; N115-N138 VanDerWaalsContact CA-OD1 3.25Å; N115-N138 WeakPolarHBondContact CA-OD1 3.39Å; N115-N138 WeakPolarHBondContact CB-OD1 3.09Å; N115-N138 PolarHBondContact N-OD1 2.66Å; N115-N138 PolarHBondContact O-OD1 2.81Å
116	S	97.2	Very high	95.1	Very high	33 Å²	33	28.2 Å²	28.2	23%	0.231	17%	0.17	C	C	.	.			trans	-111.2	17.2	-180	-75.5	0	0	0	0	114.2	I93 S118 N138 K139	I93-S116 CarbonylContact O-C 3.57Å; I93-S116 WeakPolarHBondContact O-CA 3.31Å; I93-S116 PolarHBondContact O-N 2.76Å; S116-S118 PolarHBondContact O-N 2.76Å; S116-N138 PolarHBondContact N-OD1 3.32Å; S116-K139 PolarHBondContact OG-NZ 3.14Å
117	I	96.9	Very high	95	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	19%	0.186	C	C	.	.			trans	-60.9	126.5	-177.8	-54.3	170	0	0	0	109.7	I93 S94 L96 L112 N115 L135 N138 K139 I140	I93-I117 HydrophobicContact CG2-CG1 4.47Å; I93-I117 PolarHBondContact O-N 3.36Å; S94-I117 WeakPolarHBondContact O-CA 3.39Å; L96-I117 HydrophobicContact CD1-CD1 4.18Å; L96-I117 HydrophobicContact CD2-CD1 4.29Å; L96-I117 HydrophobicContact CG-CD1 4.1Å; L112-I117 HydrophobicContact CB-CD1 4.25Å; L112-I117 HydrophobicContact CD1-CD1 4.19Å; N115-I117 HydrophobicContact CB-CG1 4.33Å; I117-L135 HydrophobicContact CD1-CD2 3.78Å; I117-N138 HydrophobicContact CB-CB 4.35Å; I117-N138 WeakPolarHBondContact CB-OD1 3.14Å; I117-N138 WeakPolarHBondContact CG1-OD1 3.48Å; I117-N138 PolarHBondContact N-OD1 2.91Å; I117-K139 CarbonylContact O-C 3.32Å; I117-K139 VanDerWaalsContact O-CA 3.26Å; I117-K139 WeakPolarHBondContact O-CA 3.37Å; I117-K139 WeakPolarHBondContact O-CB 3.25Å; I117-K139 PolarHBondContact O-N 2.8Å; I117-I140 HydrophobicContact CB-CG1 4.33Å; I117-I140 HydrophobicContact CG2-CD1 4.36Å; I117-I140 HydrophobicContact CG2-CG1 4.09Å; I117-I140 WeakPolarHBondContact O-CG1 3.25Å; I117-I140 PolarHBondContact O-N 2.97Å; I117-I140 VanDerWaalsContact O-N 3.07Å
118	S	95.3	Very high	94.8	Very high	56 Å²	56	31 Å²	31	39%	0.392	19%	0.188	S	C	.	.			trans	-114.3	-26.8	-172.3	60.5	0	0	0	0	114.9	S116 I140 S141	S116-S118 PolarHBondContact O-N 2.76Å; S118-I140 WeakPolarHBondContact O-CA 3.42Å; S118-S141 PolarHBondContact O-N 3.22Å; S118-S141 PolarHBondContact O-OG 3.06Å
119	V	94.2	Very high	94.6	Very high	43 Å²	43	33.3 Å²	33.3	26%	0.261	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	139	178	-179.8	0	0	0	0	108.1	K121 L142	V119-K121 HydrophobicContact CG1-CG 4.23Å; V119-L142 HydrophobicContact CG1-CB 4.28Å; V119-L142 HydrophobicContact CG1-CD2 4.27Å; V119-L142 HydrophobicContact CG1-CG 4.42Å; V119-L142 HydrophobicContact CG2-CB 4.44Å
120	L	94.3	Very high	94.5	Very high	2 Å²	2	31 Å²	31	1%	0.01	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	106.4	170.9	-163.4	68	0	0	0	109.2	L96 A124 F125 L135 L142 L143 E144 C147 F148	L96-L120 HydrophobicContact CD1-CD1 4.03Å; L120-A124 HydrophobicContact CD1-CB 3.97Å; L120-A124 HydrophobicContact CG-CB 4.45Å; L120-F125 HydrophobicContact CD1-CE2 3.97Å; L120-F125 HydrophobicContact CD1-CZ 4.12Å; L120-F125 HydrophobicContact CD2-CE2 4.16Å; L120-F125 HydrophobicContact CG-CE2 4.39Å; L120-L135 HydrophobicContact CD1-CD1 4.49Å; L120-L135 HydrophobicContact CD2-CD1 4.11Å; L120-L142 PolarHBondContact N-O 3.46Å; L120-L142 VanDerWaalsContact N-O 3.09Å; L120-L143 HydrophobicContact CB-CD2 3.8Å; L120-L143 HydrophobicContact CD2-CD2 3.91Å; L120-E144 PolarHBondContact O-N 2.84Å; L120-C147 HydrophobicContact CB-CB 4.45Å; L120-C147 HydrophobicContact CD2-CB 4.26Å; L120-C147 HydrophobicContact CG-CB 4.04Å; L120-C147 WeakPolarHBondContact O-CB 3.27Å; L120-F148 HydrophobicContact CD2-CD1 4.1Å; L120-F148 HydrophobicContact CD2-CE1 3.32Å; L120-F148 HydrophobicContact CD2-CE2 4.31Å; L120-F148 HydrophobicContact CD2-CZ 3.44Å; L120-F148 VanDerWaalsContact CD2-CZ 3.44Å
121	K	91.9	Very high	94.5	Very high	90 Å²	90	34.8 Å²	34.8	39%	0.391	20%	0.202	S	C	.	.			trans	-81.8	158.2	-172.5	-63.1	171.4	-176.2	160.3	0	112.5	E95 V119 G123 A124 E144 C147	E95-K121 IonicContact OE2-NZ 2.76Å; E95-K121 PolarHBondContact OE2-NZ 2.85Å; V119-K121 HydrophobicContact CG1-CG 4.23Å; K121-G123 PolarHBondContact O-N 3.45Å; K121-A124 VanDerWaalsContact O-CB 3.28Å; K121-A124 WeakPolarHBondContact O-CB 3.4Å; K121-A124 PolarHBondContact O-N 2.83Å; K121-E144 WeakPolarHBondContact CA-OE2 3.16Å; K121-C147 WeakPolarHBondContact O-CB 3.21Å
122	V	90.1	Very high	94.5	Very high	85 Å²	85	35.8 Å²	35.8	52%	0.515	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	133.4	166.4	-175.3	0	0	0	0	109.7	A124 E144 P145	V122-A124 VanDerWaalsContact C-N 3.32Å; V122-A124 PolarHBondContact O-N 3.08Å; V122-E144 HydrophobicContact CG2-CB 3.76Å; V122-E144 PolarHBondContact N-OE2 2.89Å; V122-P145 VanDerWaalsContact CG2-O 3.3Å; V122-P145 WeakPolarHBondContact CG2-O 3.38Å
123	G	85.1	Confident	94.5	Very high	22 Å²	22	35.8 Å²	35.8	23%	0.227	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	12.3	-176.9	0	0	0	0	0	115.1	M98 K121 F125	M98-G123 WeakPolarHBondContact CB-O 3.15Å; M98-G123 WeakPolarHBondContact CG-O 3.21Å; K121-G123 PolarHBondContact O-N 3.45Å; G123-F125 PolarHBondContact O-N 2.92Å; G123-F125 VanDerWaalsContact O-N 3.15Å
124	A	90.4	Very high	94.6	Very high	4 Å²	4	35.3 Å²	35.3	3%	0.033	20%	0.2	C	C	.	.	S	Bend	trans	-56.7	-27	174.5	0	0	0	0	0	113.5	L96 L120 K121 V122	L96-A124 HydrophobicContact CB-CB 4.43Å; L120-A124 HydrophobicContact CD1-CB 3.97Å; L120-A124 HydrophobicContact CG-CB 4.45Å; K121-A124 VanDerWaalsContact O-CB 3.28Å; K121-A124 WeakPolarHBondContact O-CB 3.4Å; K121-A124 PolarHBondContact O-N 2.83Å; V122-A124 VanDerWaalsContact C-N 3.32Å; V122-A124 PolarHBondContact O-N 3.08Å
125	F	93.4	Very high	94.6	Very high	1 Å²	1	34.6 Å²	34.6	0%	0.004	20%	0.195	C	C	.	.	S	Bend	trans	-113.3	138.1	175.7	-55.5	-80.4	0	0	0	111.4	L96 L101 L110 L120 G123 L133 F148 N150 I151	L96-F125 HydrophobicContact CD1-CE1 4.11Å; L96-F125 HydrophobicContact CD1-CZ 3.98Å; L101-F125 HydrophobicContact CD2-CD1 4.1Å; L101-F125 HydrophobicContact CD2-CE1 4.42Å; L110-F125 HydrophobicContact CD2-CE1 4.37Å; L120-F125 HydrophobicContact CD1-CE2 3.97Å; L120-F125 HydrophobicContact CD1-CZ 4.12Å; L120-F125 HydrophobicContact CD2-CE2 4.16Å; L120-F125 HydrophobicContact CG-CE2 4.39Å; G123-F125 PolarHBondContact O-N 2.92Å; G123-F125 VanDerWaalsContact O-N 3.15Å; F125-L133 HydrophobicContact CE1-CD1 4.17Å; F125-L133 HydrophobicContact CE1-CD2 4.02Å; F125-L133 HydrophobicContact CE2-CD2 4Å; F125-L133 HydrophobicContact CZ-CD1 4.19Å; F125-L133 HydrophobicContact CZ-CD2 3.47Å; F125-L133 VanDerWaalsContact CZ-CD2 3.47Å; F125-L133 HydrophobicContact CZ-CG 4.5Å; F125-F148 HydrophobicContact CE2-CD1 4.17Å; F125-F148 HydrophobicContact CE2-CE1 4.42Å; F125-N150 WeakPolarHBondContact O-CB 3.42Å; F125-N150 PolarHBondContact O-ND2 3.26Å; F125-I151 HydrophobicContact CB-CG2 3.8Å; F125-I151 HydrophobicContact CD1-CD1 4.44Å; F125-I151 HydrophobicContact CD2-CD1 3.93Å; F125-I151 HydrophobicContact CD2-CG1 4.49Å; F125-I151 HydrophobicContact CE2-CD1 4.26Å; F125-I151 HydrophobicContact CG-CD1 4.04Å; F125-I151 HydrophobicContact CG-CG2 4.35Å
126	P	92.3	Very high	94.6	Very high	14 Å²	14	34.9 Å²	34.9	9%	0.091	20%	0.198	C	C	.	.			trans	-69.2	172.3	163.4	32.6	-37.2	0	0	0	110.9	M98 L101 I128	M98-P126 HydrophobicContact CG-CB 4.36Å; L101-P126 HydrophobicContact CB-CG 3.88Å; P126-I128 HydrophobicContact CB-CG2 4.49Å; P126-I128 HydrophobicContact CG-CD1 4.48Å; P126-I128 HydrophobicContact CG-CG1 4.34Å; P126-I128 HydrophobicContact CG-CG2 3.93Å; P126-I128 PolarHBondContact O-N 2.87Å
127	S	92.1	Very high	94.7	Very high	100 Å²	100	36.5 Å²	36.5	70%	0.699	20%	0.204	S	C	*	.	S	Bend	trans	-74.2	88.7	173.5	-56	0	0	0	0	111.1
128	I	92.2	Very high	94.7	Very high	9 Å²	9	36.9 Å²	36.9	5%	0.046	21%	0.206	C	C	.	.			trans	-126.3	155	179.7	54.3	166.2	0	0	0	111	L107 P126 L130 I151 S154	L107-I128 HydrophobicContact CB-CD1 4.3Å; L107-I128 HydrophobicContact CD2-CD1 4.29Å; P126-I128 HydrophobicContact CB-CG2 4.49Å; P126-I128 HydrophobicContact CG-CD1 4.48Å; P126-I128 HydrophobicContact CG-CG1 4.34Å; P126-I128 HydrophobicContact CG-CG2 3.93Å; P126-I128 PolarHBondContact O-N 2.87Å; I128-L130 HydrophobicContact CD1-CB 4.13Å; I128-L130 HydrophobicContact CD1-CD1 4.4Å; I128-L130 HydrophobicContact CG1-CB 4.2Å; I128-L130 PolarHBondContact O-N 2.88Å; I128-I151 HydrophobicContact CG1-CG2 3.94Å; I128-S154 PolarHBondContact O-OG 3.39Å
129	Q	93.9	Very high	94.8	Very high	119 Å²	119	38.2 Å²	38.2	56%	0.556	20%	0.204	S	C	*	.			trans	-80.6	46.7	-178.4	-63.6	-66.4	-26.1	0	0	112.5	K131	Q129-K131 PolarHBondContact O-N 3.13Å
130	L	96.7	Very high	94.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.192	C	C	.	.			trans	-68.4	120.8	-178.1	-166	74.5	0	0	0	110.2	L107 L110 I128 L133 I151 S154 L155	L107-L130 HydrophobicContact CD2-CD1 4.25Å; L107-L130 HydrophobicContact CG-CD1 4.01Å; L107-L130 WeakPolarHBondContact O-CA 3.23Å; L110-L130 HydrophobicContact CB-CD1 3.86Å; L110-L130 HydrophobicContact CB-CD2 4.45Å; I128-L130 HydrophobicContact CD1-CB 4.13Å; I128-L130 HydrophobicContact CD1-CD1 4.4Å; I128-L130 HydrophobicContact CG1-CB 4.2Å; I128-L130 PolarHBondContact O-N 2.88Å; L130-L133 HydrophobicContact CD2-CB 3.94Å; L130-L133 HydrophobicContact CD2-CD1 4.21Å; L130-L133 HydrophobicContact CD2-CD2 4.34Å; L130-L133 HydrophobicContact CD2-CG 4.38Å; L130-I151 HydrophobicContact CB-CG2 4.23Å; L130-I151 HydrophobicContact CD2-CD1 3.99Å; L130-S154 PolarHBondContact N-OG 3.22Å; L130-S154 CarbonylContact O-C 3.38Å; L130-S154 WeakPolarHBondContact O-CB 3.19Å; L130-S154 PolarHBondContact O-OG 3.18Å; L130-L155 HydrophobicContact CD2-CD1 4.39Å; L130-L155 HydrophobicContact CG-CD1 4.38Å; L130-L155 WeakPolarHBondContact O-CA 3.23Å; L130-L155 PolarHBondContact O-N 3.28Å
131	K	98.1	Very high	95	Very high	79 Å²	79	39 Å²	39	34%	0.343	21%	0.212	S	C	.	.			trans	-99.2	-33.1	-179.6	-61.5	175.7	-168.8	162.2	0	112.7	E108 Q129 L156 V157	E108-K131 HydrophobicContact CB-CD 4.39Å; E108-K131 VanDerWaalsContact CD-CE 3.47Å; E108-K131 PolarHBondContact O-N 2.83Å; E108-K131 WeakPolarHBondContact OE1-CE 3.27Å; E108-K131 IonicContact OE1-NZ 2.78Å; E108-K131 PolarHBondContact OE1-NZ 3.23Å; E108-K131 WeakPolarHBondContact OE2-CE 3.48Å; E108-K131 IonicContact OE2-NZ 3.02Å; E108-K131 PolarHBondContact OE2-NZ 2.97Å; Q129-K131 PolarHBondContact O-N 3.13Å; K131-L156 HydrophobicContact CB-CD1 4.42Å; K131-L156 HydrophobicContact CB-CG 4.4Å; K131-L156 PolarHBondContact O-N 3.02Å; K131-V157 PolarHBondContact O-N 2.85Å
132	Y	98.6	Very high	95.1	Very high	51 Å²	51	38.6 Å²	38.6	20%	0.2	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	124.4	-178.6	178.7	-85.8	0	0	0	111.1	E108 L110 N134 V157 R159	E108-Y132 PolarHBondContact O-N 3.37Å; L110-Y132 PolarHBondContact N-O 3.04Å; Y132-N134 HydrophobicContact CE1-CB 3.58Å; Y132-N134 PolarHBondContact OH-ND2 2.95Å; Y132-V157 HydrophobicContact CD2-CB 3.69Å; Y132-V157 HydrophobicContact CD2-CG1 3.65Å; Y132-V157 HydrophobicContact CD2-CG2 4.3Å; Y132-V157 HydrophobicContact CE2-CB 4.3Å; Y132-V157 HydrophobicContact CE2-CG1 3.73Å; Y132-R159 PolarHBondContact OH-NH1 2.94Å
133	L	98.3	Very high	95.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	119.3	175.4	178.5	57	0	0	0	110.8	L110 F125 L130 L135 F148 I151 L155 V157 L158 R159	L110-L133 HydrophobicContact CB-CD1 4.28Å; L110-L133 HydrophobicContact CD2-CD1 4.13Å; L110-L133 HydrophobicContact CG-CD1 4.25Å; F125-L133 HydrophobicContact CE1-CD1 4.17Å; F125-L133 HydrophobicContact CE1-CD2 4.02Å; F125-L133 HydrophobicContact CE2-CD2 4Å; F125-L133 HydrophobicContact CZ-CD1 4.19Å; F125-L133 HydrophobicContact CZ-CD2 3.47Å; F125-L133 VanDerWaalsContact CZ-CD2 3.47Å; F125-L133 HydrophobicContact CZ-CG 4.5Å; L130-L133 HydrophobicContact CD2-CB 3.94Å; L130-L133 HydrophobicContact CD2-CD1 4.21Å; L130-L133 HydrophobicContact CD2-CD2 4.34Å; L130-L133 HydrophobicContact CD2-CG 4.38Å; L133-L135 HydrophobicContact CD1-CD1 4.32Å; L133-L135 HydrophobicContact CD1-CD2 4.46Å; L133-L135 HydrophobicContact CD1-CG 4.03Å; L133-L135 HydrophobicContact CD2-CD1 3.97Å; L133-L135 HydrophobicContact CG-CD1 4.08Å; L133-L135 HydrophobicContact CG-CG 4.13Å; L133-F148 HydrophobicContact CD2-CD1 4.39Å; L133-F148 HydrophobicContact CD2-CE1 4.1Å; L133-I151 HydrophobicContact CD2-CD1 4.08Å; L133-L155 HydrophobicContact CB-CD1 3.77Å; L133-V157 PolarHBondContact N-O 3.09Å; L133-L158 HydrophobicContact CB-CD1 4.18Å; L133-L158 HydrophobicContact CD2-CD1 3.95Å; L133-L158 HydrophobicContact CG-CD1 4.04Å; L133-L158 WeakPolarHBondContact O-CA 3.3Å; L133-R159 PolarHBondContact O-N 3.15Å
134	N	98.7	Very high	95.6	Very high	11 Å²	11	36.6 Å²	36.6	6%	0.059	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	111.2	176.3	-173.1	11.6	0	0	0	111.7	L110 D111 L112 T113 Y132 S136 R159	L110-N134 PolarHBondContact O-N 3.21Å; D111-N134 HydrophobicContact CB-CB 4.38Å; D111-N134 PolarHBondContact OD1-ND2 3.47Å; D111-N134 PolarHBondContact OD2-ND2 2.87Å; L112-N134 CarbonylContact C-O 3.57Å; L112-N134 WeakPolarHBondContact CA-O 3.31Å; L112-N134 PolarHBondContact N-O 3.04Å; T113-N134 PolarHBondContact OG1-ND2 3.4Å; T113-N134 PolarHBondContact OG1-OD1 3.35Å; Y132-N134 HydrophobicContact CE1-CB 3.58Å; Y132-N134 PolarHBondContact OH-ND2 2.95Å; N134-S136 WeakPolarHBondContact OD1-CB 3.35Å; N134-S136 PolarHBondContact OD1-N 3.31Å; N134-S136 VanDerWaalsContact OD1-N 3.15Å; N134-S136 PolarHBondContact OD1-OG 3.09Å; N134-R159 HydrophobicContact CB-CB 4.26Å; N134-R159 VanDerWaalsContact OD1-CB 3.27Å; N134-R159 WeakPolarHBondContact OD1-CB 3.31Å
135	L	98.3	Very high	95.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.218	C	C	.	.			trans	-113.1	21.2	179.1	-70.9	166	0	0	0	111.2	L96 L112 I117 L120 L133 N138 I140 R159 L160 N163	L96-L135 HydrophobicContact CD1-CD2 4.35Å; L112-L135 HydrophobicContact CB-CD2 4.01Å; L112-L135 HydrophobicContact CD1-CD2 3.84Å; I117-L135 HydrophobicContact CD1-CD2 3.78Å; L120-L135 HydrophobicContact CD1-CD1 4.49Å; L120-L135 HydrophobicContact CD2-CD1 4.11Å; L133-L135 HydrophobicContact CD1-CD1 4.32Å; L133-L135 HydrophobicContact CD1-CD2 4.46Å; L133-L135 HydrophobicContact CD1-CG 4.03Å; L133-L135 HydrophobicContact CD2-CD1 3.97Å; L133-L135 HydrophobicContact CG-CD1 4.08Å; L133-L135 HydrophobicContact CG-CG 4.13Å; L135-N138 PolarHBondContact O-ND2 3.4Å; L135-N138 VanDerWaalsContact O-ND2 3.1Å; L135-I140 HydrophobicContact CB-CD1 3.91Å; L135-I140 HydrophobicContact CD1-CD1 4.24Å; L135-I140 HydrophobicContact CD2-CD1 4.45Å; L135-I140 HydrophobicContact CG-CD1 4.44Å; L135-R159 CarbonylContact C-O 3.47Å; L135-R159 WeakPolarHBondContact CA-O 3.41Å; L135-R159 PolarHBondContact N-O 3.07Å; L135-L160 HydrophobicContact CB-CD2 4.02Å; L135-L160 HydrophobicContact CD1-CD2 4Å; L135-N163 PolarHBondContact O-ND2 3.07Å
136	S	98.6	Very high	95.4	Very high	13 Å²	13	41.2 Å²	41.2	9%	0.091	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	154	-175.7	-62.2	0	0	0	0	113.2	T113 S114 N134 N138 R159 N161	T113-S136 CarbonylContact C-O 3.55Å; T113-S136 VanDerWaalsContact CA-O 3.23Å; T113-S136 WeakPolarHBondContact CA-O 3.35Å; S114-S136 PolarHBondContact N-O 2.83Å; N134-S136 WeakPolarHBondContact OD1-CB 3.35Å; N134-S136 PolarHBondContact OD1-N 3.31Å; N134-S136 VanDerWaalsContact OD1-N 3.15Å; N134-S136 PolarHBondContact OD1-OG 3.09Å; S136-N138 PolarHBondContact O-N 3.4Å; S136-N138 PolarHBondContact O-ND2 3.34Å; S136-N138 VanDerWaalsContact O-ND2 3.14Å; S136-R159 PolarHBondContact N-O 3Å; S136-N161 CarbonylContact C-O 3.42Å; S136-N161 VanDerWaalsContact CA-O 3.23Å; S136-N161 WeakPolarHBondContact CA-O 3.29Å
137	N	98.3	Very high	95.4	Very high	67 Å²	67	40.7 Å²	40.7	36%	0.358	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	31.8	174.2	-158	56.6	0	0	0	114.2	T113 S114 N161 R162	T113-N137 HydrophobicContact CG2-CB 4.32Å; S114-N137 WeakPolarHBondContact CA-O 3.44Å; S114-N137 PolarHBondContact OG-ND2 3.05Å; N137-N161 PolarHBondContact N-O 3.27Å; N137-R162 WeakPolarHBondContact CA-O 3.11Å; N137-R162 HydrophobicContact CB-CB 4.28Å
138	N	98.1	Very high	95.4	Very high	8 Å²	8	36.1 Å²	36.1	4%	0.043	19%	0.19	C	C	.	.	S	Bend	trans	-95.6	-163.5	173.5	-86.9	-87.3	0	0	0	110.4	L112 N115 S116 I117 L135 S136 I140 N163	L112-N138 PolarHBondContact O-ND2 3.28Å; N115-N138 VanDerWaalsContact CA-OD1 3.25Å; N115-N138 WeakPolarHBondContact CA-OD1 3.39Å; N115-N138 WeakPolarHBondContact CB-OD1 3.09Å; N115-N138 PolarHBondContact N-OD1 2.66Å; N115-N138 PolarHBondContact O-OD1 2.81Å; S116-N138 PolarHBondContact N-OD1 3.32Å; I117-N138 HydrophobicContact CB-CB 4.35Å; I117-N138 WeakPolarHBondContact CB-OD1 3.14Å; I117-N138 WeakPolarHBondContact CG1-OD1 3.48Å; I117-N138 PolarHBondContact N-OD1 2.91Å; L135-N138 PolarHBondContact O-ND2 3.4Å; L135-N138 VanDerWaalsContact O-ND2 3.1Å; S136-N138 PolarHBondContact O-N 3.4Å; S136-N138 PolarHBondContact O-ND2 3.34Å; S136-N138 VanDerWaalsContact O-ND2 3.14Å; N138-I140 HydrophobicContact CB-CD1 4.26Å; N138-I140 HydrophobicContact CB-CG1 3.99Å; N138-N163 VanDerWaalsContact CA-OD1 3.28Å; N138-N163 WeakPolarHBondContact CA-OD1 3.36Å; N138-N163 WeakPolarHBondContact CB-OD1 3.26Å; N138-N163 PolarHBondContact N-OD1 3.2Å; N138-N163 PolarHBondContact O-OD1 2.82Å
139	K	97.3	Very high	95.4	Very high	84 Å²	84	40.1 Å²	40.1	37%	0.365	21%	0.209	S	C	.	.			trans	-110.4	16.4	179.2	-63.9	168.3	-176.6	160.4	0	111.8	S116 I117 S141 N163	S116-K139 PolarHBondContact OG-NZ 3.14Å; I117-K139 CarbonylContact O-C 3.32Å; I117-K139 VanDerWaalsContact O-CA 3.26Å; I117-K139 WeakPolarHBondContact O-CA 3.37Å; I117-K139 WeakPolarHBondContact O-CB 3.25Å; I117-K139 PolarHBondContact O-N 2.8Å; K139-S141 PolarHBondContact O-N 2.94Å; K139-S141 VanDerWaalsContact O-N 3.14Å; K139-N163 PolarHBondContact N-OD1 2.96Å
140	I	97.3	Very high	95.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.199	C	C	.	.			trans	-63.1	115	-167.5	-55.5	172.1	0	0	0	109.9	I117 S118 L135 N138 L143 L160 N163 R164 L165	I117-I140 HydrophobicContact CB-CG1 4.33Å; I117-I140 HydrophobicContact CG2-CD1 4.36Å; I117-I140 HydrophobicContact CG2-CG1 4.09Å; I117-I140 WeakPolarHBondContact O-CG1 3.25Å; I117-I140 PolarHBondContact O-N 2.97Å; I117-I140 VanDerWaalsContact O-N 3.07Å; S118-I140 WeakPolarHBondContact O-CA 3.42Å; L135-I140 HydrophobicContact CB-CD1 3.91Å; L135-I140 HydrophobicContact CD1-CD1 4.24Å; L135-I140 HydrophobicContact CD2-CD1 4.45Å; L135-I140 HydrophobicContact CG-CD1 4.44Å; N138-I140 HydrophobicContact CB-CD1 4.26Å; N138-I140 HydrophobicContact CB-CG1 3.99Å; I140-L143 HydrophobicContact CG2-CD2 3.84Å; I140-L160 HydrophobicContact CD1-CD2 4.19Å; I140-N163 HydrophobicContact CB-CB 4.18Å; I140-N163 WeakPolarHBondContact CB-OD1 3.49Å; I140-N163 WeakPolarHBondContact CG1-OD1 3.4Å; I140-N163 PolarHBondContact N-OD1 3.43Å; I140-R164 CarbonylContact O-C 3.44Å; I140-R164 VanDerWaalsContact O-C 3.24Å; I140-R164 VanDerWaalsContact O-CA 3.29Å; I140-R164 WeakPolarHBondContact O-CA 3.44Å; I140-R164 PolarHBondContact O-N 3.1Å; I140-L165 HydrophobicContact CG2-CD2 3.92Å; I140-L165 PolarHBondContact O-N 3.45Å
141	S	95.6	Very high	95.1	Very high	62 Å²	62	37.5 Å²	37.5	43%	0.434	20%	0.199	S	C	.	.			trans	-109.3	-19.9	177.3	53.4	0	0	0	0	113.5	S118 K139	S118-S141 PolarHBondContact O-N 3.22Å; S118-S141 PolarHBondContact O-OG 3.06Å; K139-S141 PolarHBondContact O-N 2.94Å; K139-S141 VanDerWaalsContact O-N 3.14Å
142	L	93.5	Very high	94.9	Very high	81 Å²	81	35.2 Å²	35.2	42%	0.424	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	132.8	-179.8	179.8	64	0	0	0	110.2	V119 L120 E144	V119-L142 HydrophobicContact CG1-CB 4.28Å; V119-L142 HydrophobicContact CG1-CD2 4.27Å; V119-L142 HydrophobicContact CG1-CG 4.42Å; V119-L142 HydrophobicContact CG2-CB 4.44Å; L120-L142 PolarHBondContact N-O 3.46Å; L120-L142 VanDerWaalsContact N-O 3.09Å; L142-E144 HydrophobicContact CD2-CG 4.45Å
143	L	94.7	Very high	94.7	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.016	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	120	163.5	-59	174.9	0	0	0	106.5	L120 I140 F148 L160 L165 V172 F173	L120-L143 HydrophobicContact CB-CD2 3.8Å; L120-L143 HydrophobicContact CD2-CD2 3.91Å; I140-L143 HydrophobicContact CG2-CD2 3.84Å; L143-F148 HydrophobicContact CD1-CE2 4.38Å; L143-F148 HydrophobicContact CD2-CZ 4.29Å; L143-L160 HydrophobicContact CD1-CD1 4.11Å; L143-L160 HydrophobicContact CD2-CD2 4.44Å; L143-L165 HydrophobicContact CD1-CD1 4.27Å; L143-L165 HydrophobicContact CD1-CD2 4.21Å; L143-L165 HydrophobicContact CD2-CD2 4.43Å; L143-L165 HydrophobicContact CG-CD2 3.85Å; L143-V172 HydrophobicContact CB-CG2 3.82Å; L143-V172 HydrophobicContact CD1-CG2 4.4Å; L143-F173 HydrophobicContact CD1-CE1 4.4Å; L143-F173 HydrophobicContact CD1-CZ 4.27Å
144	E	91.8	Very high	94.5	Very high	63 Å²	63	37 Å²	37	29%	0.294	21%	0.212	S	C	.	.			trans	-73.1	139.5	174.8	-67.6	-179	177.1	0	0	110.1	L120 K121 V122 L142 G146 C147	L120-E144 PolarHBondContact O-N 2.84Å; K121-E144 WeakPolarHBondContact CA-OE2 3.16Å; V122-E144 HydrophobicContact CG2-CB 3.76Å; V122-E144 PolarHBondContact N-OE2 2.89Å; L142-E144 HydrophobicContact CD2-CG 4.45Å; E144-G146 PolarHBondContact O-N 3.27Å; E144-G146 VanDerWaalsContact O-N 3.17Å; E144-C147 VanDerWaalsContact O-CB 3.27Å; E144-C147 WeakPolarHBondContact O-CB 3.46Å; E144-C147 PolarHBondContact O-N 3.26Å; E144-C147 PolarHBondContact O-SG 2.96Å
145	P	90.1	Very high	94.5	Very high	85 Å²	85	36.4 Å²	36.4	55%	0.552	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	121.5	176.9	-24.8	34.4	0	0	0	111.3	V122 P169	V122-P145 VanDerWaalsContact CG2-O 3.3Å; V122-P145 WeakPolarHBondContact CG2-O 3.38Å; P145-P169 HydrophobicContact CG-CB 4.16Å
146	G	88.4	Confident	94.5	Very high	17 Å²	17	39 Å²	39	18%	0.175	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.6	3.2	-175.6	0	0	0	0	0	115.5	E144 F148 E149	E144-G146 PolarHBondContact O-N 3.27Å; E144-G146 VanDerWaalsContact O-N 3.17Å; G146-F148 PolarHBondContact O-N 3.22Å; G146-E149 VanDerWaalsContact O-CB 3.3Å; G146-E149 WeakPolarHBondContact O-CB 3.48Å; G146-E149 PolarHBondContact O-N 2.98Å
147	C	92.3	Very high	94.5	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.02	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-19.7	177.5	60.1	0	0	0	0	115.4	L120 K121 E144	L120-C147 HydrophobicContact CB-CB 4.45Å; L120-C147 HydrophobicContact CD2-CB 4.26Å; L120-C147 HydrophobicContact CG-CB 4.04Å; L120-C147 WeakPolarHBondContact O-CB 3.27Å; K121-C147 WeakPolarHBondContact O-CB 3.21Å; E144-C147 VanDerWaalsContact O-CB 3.27Å; E144-C147 WeakPolarHBondContact O-CB 3.46Å; E144-C147 PolarHBondContact O-N 3.26Å; E144-C147 PolarHBondContact O-SG 2.96Å
148	F	93.6	Very high	94.5	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.018	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	4.7	174.8	-50.7	-74.2	0	0	0	114.6	L120 F125 L133 L143 G146 N150 I151 S152 L158 L160 F173 L175	L120-F148 HydrophobicContact CD2-CD1 4.1Å; L120-F148 HydrophobicContact CD2-CE1 3.32Å; L120-F148 HydrophobicContact CD2-CE2 4.31Å; L120-F148 HydrophobicContact CD2-CZ 3.44Å; L120-F148 VanDerWaalsContact CD2-CZ 3.44Å; F125-F148 HydrophobicContact CE2-CD1 4.17Å; F125-F148 HydrophobicContact CE2-CE1 4.42Å; L133-F148 HydrophobicContact CD2-CD1 4.39Å; L133-F148 HydrophobicContact CD2-CE1 4.1Å; L143-F148 HydrophobicContact CD1-CE2 4.38Å; L143-F148 HydrophobicContact CD2-CZ 4.29Å; G146-F148 PolarHBondContact O-N 3.22Å; F148-N150 VanDerWaalsContact C-N 3.3Å; F148-N150 PolarHBondContact O-N 2.83Å; F148-I151 HydrophobicContact CB-CG1 4.27Å; F148-I151 HydrophobicContact CD1-CD1 4.29Å; F148-I151 WeakPolarHBondContact O-CG1 3.16Å; F148-I151 PolarHBondContact O-N 2.8Å; F148-S152 PolarHBondContact O-N 2.67Å; F148-L158 HydrophobicContact CE1-CD1 4.03Å; F148-L158 HydrophobicContact CE1-CD2 3.99Å; F148-L158 HydrophobicContact CE2-CD2 4.07Å; F148-L158 HydrophobicContact CZ-CD1 4.3Å; F148-L158 HydrophobicContact CZ-CD2 3.72Å; F148-L160 HydrophobicContact CZ-CD1 4.5Å; F148-F173 HydrophobicContact CE2-CD1 4.3Å; F148-F173 HydrophobicContact CE2-CE1 4.06Å; F148-L175 HydrophobicContact CB-CD1 4.49Å; F148-L175 HydrophobicContact CB-CD2 3.76Å; F148-L175 HydrophobicContact CD2-CD1 4.45Å; F148-L175 HydrophobicContact CG-CD1 4.5Å
149	E	90.8	Very high	94.5	Very high	93 Å²	93	39.9 Å²	39.9	44%	0.435	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-59.2	-38.6	-168.9	-168.6	155.1	-127.4	0	0	112.8	G146 I151 S152 K174	G146-E149 VanDerWaalsContact O-CB 3.3Å; G146-E149 WeakPolarHBondContact O-CB 3.48Å; G146-E149 PolarHBondContact O-N 2.98Å; E149-I151 VanDerWaalsContact C-N 3.28Å; E149-I151 PolarHBondContact O-N 3.15Å; E149-S152 VanDerWaalsContact O-CB 3.31Å; E149-S152 WeakPolarHBondContact O-CB 3.39Å; E149-S152 PolarHBondContact O-N 3.29Å; E149-S152 PolarHBondContact O-OG 2.8Å; E149-K174 IonicContact OE1-NZ 3.35Å; E149-K174 PolarHBondContact OE1-NZ 2.81Å
150	N	91.6	Very high	94.6	Very high	64 Å²	64	35.9 Å²	35.9	34%	0.342	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-68.9	-17.4	178.9	-72.8	-12.4	0	0	0	115.2	F125 F148	F125-N150 WeakPolarHBondContact O-CB 3.42Å; F125-N150 PolarHBondContact O-ND2 3.26Å; F148-N150 VanDerWaalsContact C-N 3.3Å; F148-N150 PolarHBondContact O-N 2.83Å
151	I	94.1	Very high	94.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-115.3	12.4	178.4	61.3	171.1	0	0	0	112.3	F125 I128 L130 L133 F148 E149 S153 S154 L155	F125-I151 HydrophobicContact CB-CG2 3.8Å; F125-I151 HydrophobicContact CD1-CD1 4.44Å; F125-I151 HydrophobicContact CD2-CD1 3.93Å; F125-I151 HydrophobicContact CD2-CG1 4.49Å; F125-I151 HydrophobicContact CE2-CD1 4.26Å; F125-I151 HydrophobicContact CG-CD1 4.04Å; F125-I151 HydrophobicContact CG-CG2 4.35Å; I128-I151 HydrophobicContact CG1-CG2 3.94Å; L130-I151 HydrophobicContact CB-CG2 4.23Å; L130-I151 HydrophobicContact CD2-CD1 3.99Å; L133-I151 HydrophobicContact CD2-CD1 4.08Å; F148-I151 HydrophobicContact CB-CG1 4.27Å; F148-I151 HydrophobicContact CD1-CD1 4.29Å; F148-I151 WeakPolarHBondContact O-CG1 3.16Å; F148-I151 PolarHBondContact O-N 2.8Å; E149-I151 VanDerWaalsContact C-N 3.28Å; E149-I151 PolarHBondContact O-N 3.15Å; I151-S153 VanDerWaalsContact C-N 3.32Å; I151-S153 PolarHBondContact O-N 2.82Å; I151-S154 PolarHBondContact O-N 3.44Å; I151-S154 PolarHBondContact O-OG 2.6Å; I151-L155 HydrophobicContact CD1-CD1 4.47Å; I151-L155 HydrophobicContact CD1-CD2 4.06Å; I151-L155 WeakPolarHBondContact O-CB 3.22Å; I151-L155 PolarHBondContact O-N 2.88Å
152	S	93.2	Very high	94.7	Very high	31 Å²	31	39.6 Å²	39.6	22%	0.217	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-28.8	-171.5	55.9	0	0	0	0	115	F148 E149 K174	F148-S152 PolarHBondContact O-N 2.67Å; E149-S152 VanDerWaalsContact O-CB 3.31Å; E149-S152 WeakPolarHBondContact O-CB 3.39Å; E149-S152 PolarHBondContact O-N 3.29Å; E149-S152 PolarHBondContact O-OG 2.8Å; S152-K174 WeakPolarHBondContact CB-O 3.41Å
153	S	93.4	Very high	95	Very high	78 Å²	78	36.1 Å²	36.1	55%	0.545	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-13.1	-177.4	56.5	0	0	0	0	114.6	I151 Q177	I151-S153 VanDerWaalsContact C-N 3.32Å; I151-S153 PolarHBondContact O-N 2.82Å; S153-Q177 WeakPolarHBondContact O-CG 3.11Å
154	S	95.5	Very high	95.1	Very high	9 Å²	9	42.2 Å²	42.2	6%	0.063	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.6	-24	-171.2	59.9	0	0	0	0	114.6	I128 L130 I151 L156	I128-S154 PolarHBondContact O-OG 3.39Å; L130-S154 PolarHBondContact N-OG 3.22Å; L130-S154 CarbonylContact O-C 3.38Å; L130-S154 WeakPolarHBondContact O-CB 3.19Å; L130-S154 PolarHBondContact O-OG 3.18Å; I151-S154 PolarHBondContact O-N 3.44Å; I151-S154 PolarHBondContact O-OG 2.6Å; S154-L156 PolarHBondContact O-N 2.67Å
155	L	97.7	Very high	95.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.2	C	C	.	.			trans	-72.2	117.9	-169.8	-166.4	69.1	0	0	0	111.8	L130 L133 I151 L158 L175 Q177 L178	L130-L155 HydrophobicContact CD2-CD1 4.39Å; L130-L155 HydrophobicContact CG-CD1 4.38Å; L130-L155 WeakPolarHBondContact O-CA 3.23Å; L130-L155 PolarHBondContact O-N 3.28Å; L133-L155 HydrophobicContact CB-CD1 3.77Å; I151-L155 HydrophobicContact CD1-CD1 4.47Å; I151-L155 HydrophobicContact CD1-CD2 4.06Å; I151-L155 WeakPolarHBondContact O-CB 3.22Å; I151-L155 PolarHBondContact O-N 2.88Å; L155-L158 HydrophobicContact CD2-CB 4.13Å; L155-L158 HydrophobicContact CD2-CD1 4.45Å; L155-L158 HydrophobicContact CD2-CD2 4.43Å; L155-L175 HydrophobicContact CD2-CD1 4.2Å; L155-L175 HydrophobicContact CD2-CD2 4.44Å; L155-Q177 CarbonylContact O-C 3.59Å; L155-L178 HydrophobicContact CD2-CD1 4.19Å; L155-L178 HydrophobicContact CG-CD1 3.98Å; L155-L178 VanDerWaalsContact O-CA 3.23Å; L155-L178 WeakPolarHBondContact O-CA 3.29Å; L155-L178 PolarHBondContact O-N 3.05Å
156	L	98.3	Very high	95.5	Very high	53 Å²	53	38.9 Å²	38.9	28%	0.277	20%	0.196	S	C	.	.			trans	-100.6	-33.2	-179.8	-55.2	-178	0	0	0	112.3	K131 S154 Q177 Q179 L180	K131-L156 HydrophobicContact CB-CD1 4.42Å; K131-L156 HydrophobicContact CB-CG 4.4Å; K131-L156 PolarHBondContact O-N 3.02Å; S154-L156 PolarHBondContact O-N 2.67Å; L156-Q177 HydrophobicContact CD2-CB 4.11Å; L156-Q177 VanDerWaalsContact CD2-O 3.31Å; L156-Q177 WeakPolarHBondContact CD2-O 3.46Å; L156-Q179 PolarHBondContact O-N 2.77Å; L156-L180 PolarHBondContact O-N 2.81Å; L156-L180 VanDerWaalsContact O-N 3.15Å
157	V	98.7	Very high	95.6	Very high	31 Å²	31	42.5 Å²	42.5	19%	0.188	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	125.9	-177.2	-179.4	0	0	0	0	111	K131 Y132 L133 R159 L180	K131-V157 PolarHBondContact O-N 2.85Å; Y132-V157 HydrophobicContact CD2-CB 3.69Å; Y132-V157 HydrophobicContact CD2-CG1 3.65Å; Y132-V157 HydrophobicContact CD2-CG2 4.3Å; Y132-V157 HydrophobicContact CE2-CB 4.3Å; Y132-V157 HydrophobicContact CE2-CG1 3.73Å; L133-V157 PolarHBondContact N-O 3.09Å; V157-R159 HydrophobicContact CG1-CG 4.37Å; V157-L180 HydrophobicContact CG1-CB 4.37Å; V157-L180 HydrophobicContact CG1-CD2 3.96Å; V157-L180 HydrophobicContact CG1-CG 4.3Å; V157-L180 HydrophobicContact CG2-CB 4.31Å
158	L	98.5	Very high	95.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	121.5	175.8	178.5	56.1	0	0	0	110.6	L133 F148 L155 L160 F173 L175 L178 L180 L181 E182	L133-L158 HydrophobicContact CB-CD1 4.18Å; L133-L158 HydrophobicContact CD2-CD1 3.95Å; L133-L158 HydrophobicContact CG-CD1 4.04Å; L133-L158 WeakPolarHBondContact O-CA 3.3Å; F148-L158 HydrophobicContact CE1-CD1 4.03Å; F148-L158 HydrophobicContact CE1-CD2 3.99Å; F148-L158 HydrophobicContact CE2-CD2 4.07Å; F148-L158 HydrophobicContact CZ-CD1 4.3Å; F148-L158 HydrophobicContact CZ-CD2 3.72Å; L155-L158 HydrophobicContact CD2-CB 4.13Å; L155-L158 HydrophobicContact CD2-CD1 4.45Å; L155-L158 HydrophobicContact CD2-CD2 4.43Å; L158-L160 HydrophobicContact CD1-CD1 4.5Å; L158-L160 HydrophobicContact CD1-CG 4.19Å; L158-L160 HydrophobicContact CD2-CD1 4.06Å; L158-L160 HydrophobicContact CG-CD1 4.15Å; L158-L160 HydrophobicContact CG-CG 4.2Å; L158-F173 HydrophobicContact CD2-CE1 4.18Å; L158-L175 HydrophobicContact CD2-CD1 3.99Å; L158-L178 HydrophobicContact CB-CD1 3.8Å; L158-L178 HydrophobicContact CB-CD2 4.3Å; L158-L180 PolarHBondContact N-O 3.35Å; L158-L181 HydrophobicContact CB-CD1 4.08Å; L158-L181 HydrophobicContact CD2-CD1 3.93Å; L158-L181 HydrophobicContact CG-CD1 3.95Å; L158-E182 PolarHBondContact O-N 2.93Å
159	R	98.8	Very high	95	Very high	76 Å²	76	43.9 Å²	43.9	29%	0.287	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	117.3	177.1	-68.6	177.1	159.1	162.6	-3.8	111.4	Y132 L133 N134 L135 S136 V157 E182	Y132-R159 PolarHBondContact OH-NH1 2.94Å; L133-R159 PolarHBondContact O-N 3.15Å; N134-R159 HydrophobicContact CB-CB 4.26Å; N134-R159 VanDerWaalsContact OD1-CB 3.27Å; N134-R159 WeakPolarHBondContact OD1-CB 3.31Å; L135-R159 CarbonylContact C-O 3.47Å; L135-R159 WeakPolarHBondContact CA-O 3.41Å; L135-R159 PolarHBondContact N-O 3.07Å; S136-R159 PolarHBondContact N-O 3Å; V157-R159 HydrophobicContact CG1-CG 4.37Å; R159-E182 HydrophobicContact CG-CB 4.18Å; R159-E182 HydrophobicContact CG-CG 4.07Å; R159-E182 IonicContact CZ-OE1 3.1Å; R159-E182 VanDerWaalsContact CZ-OE1 3.23Å; R159-E182 IonicContact NE-OE1 2.7Å; R159-E182 PolarHBondContact NE-OE1 3.34Å; R159-E182 IonicContact NE-OE2 2.66Å; R159-E182 IonicContact NH2-OE1 2.67Å; R159-E182 PolarHBondContact NH2-OE1 3.48Å
160	L	98.1	Very high	94.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.234	C	C	.	.			trans	-120.9	20.2	179.8	-69.3	164.6	0	0	0	111.8	L135 I140 L143 F148 L158 N163 L165 F173 L181 E182 M183 N186	L135-L160 HydrophobicContact CB-CD2 4.02Å; L135-L160 HydrophobicContact CD1-CD2 4Å; I140-L160 HydrophobicContact CD1-CD2 4.19Å; L143-L160 HydrophobicContact CD1-CD1 4.11Å; L143-L160 HydrophobicContact CD2-CD2 4.44Å; F148-L160 HydrophobicContact CZ-CD1 4.5Å; L158-L160 HydrophobicContact CD1-CD1 4.5Å; L158-L160 HydrophobicContact CD1-CG 4.19Å; L158-L160 HydrophobicContact CD2-CD1 4.06Å; L158-L160 HydrophobicContact CG-CD1 4.15Å; L158-L160 HydrophobicContact CG-CG 4.2Å; L160-N163 WeakPolarHBondContact O-CB 3.49Å; L160-N163 PolarHBondContact O-ND2 2.92Å; L160-L165 HydrophobicContact CB-CD1 4.38Å; L160-L165 HydrophobicContact CD1-CD1 4.45Å; L160-F173 HydrophobicContact CD1-CE1 4.34Å; L160-F173 HydrophobicContact CD1-CZ 4.5Å; L160-L181 HydrophobicContact CD1-CD1 4.48Å; L160-E182 WeakPolarHBondContact CA-O 3.43Å; L160-E182 PolarHBondContact N-O 2.92Å; L160-M183 HydrophobicContact CB-CG 4.21Å; L160-M183 HydrophobicContact CD1-CG 4.35Å; L160-M183 HydrophobicContact CD1-SD 4.44Å; L160-N186 PolarHBondContact O-ND2 2.8Å
161	N	98.4	Very high	93.4	Very high	10 Å²	10	47.6 Å²	47.6	5%	0.053	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	152.3	-175.7	-59.8	-47.3	0	0	0	113.5	S136 N137 N163 E182 M183 K184	S136-N161 CarbonylContact C-O 3.42Å; S136-N161 VanDerWaalsContact CA-O 3.23Å; S136-N161 WeakPolarHBondContact CA-O 3.29Å; N137-N161 PolarHBondContact N-O 3.27Å; N161-N163 PolarHBondContact O-N 3.14Å; N161-N163 PolarHBondContact O-ND2 3.28Å; N161-E182 PolarHBondContact ND2-OE2 2.82Å; N161-E182 WeakPolarHBondContact OD1-CB 3.17Å; N161-M183 PolarHBondContact OD1-N 3.41Å; N161-K184 CarbonylContact C-O 3.54Å; N161-K184 VanDerWaalsContact CA-O 3.27Å; N161-K184 WeakPolarHBondContact CA-O 3.39Å; N161-K184 HydrophobicContact CB-CG 4.13Å; N161-K184 WeakPolarHBondContact OD1-CD 3.28Å; N161-K184 WeakPolarHBondContact OD1-CG 3.34Å; N161-K184 PolarHBondContact OD1-N 2.95Å
162	R	98.2	Very high	92.9	Very high	130 Å²	130	47.7 Å²	47.7	49%	0.491	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	38.1	174.1	-59	-178.1	-172	-176.8	4.7	113.6	N137 K184 R185	N137-R162 WeakPolarHBondContact CA-O 3.11Å; N137-R162 HydrophobicContact CB-CB 4.28Å; R162-K184 PolarHBondContact N-O 2.77Å; R162-R185 VanDerWaalsContact CA-O 3.31Å; R162-R185 WeakPolarHBondContact CA-O 3.5Å; R162-R185 HydrophobicContact CG-CB 3.97Å
163	N	98.2	Very high	92.6	Very high	8 Å²	8	46.2 Å²	46.2	4%	0.043	24%	0.238	C	C	.	.	S	Bend	trans	-101.1	-158.4	173.9	-86.1	-70.5	0	0	0	110.2	L135 N138 K139 I140 L160 N161 N186	L135-N163 PolarHBondContact O-ND2 3.07Å; N138-N163 VanDerWaalsContact CA-OD1 3.28Å; N138-N163 WeakPolarHBondContact CA-OD1 3.36Å; N138-N163 WeakPolarHBondContact CB-OD1 3.26Å; N138-N163 PolarHBondContact N-OD1 3.2Å; N138-N163 PolarHBondContact O-OD1 2.82Å; K139-N163 PolarHBondContact N-OD1 2.96Å; I140-N163 HydrophobicContact CB-CB 4.18Å; I140-N163 WeakPolarHBondContact CB-OD1 3.49Å; I140-N163 WeakPolarHBondContact CG1-OD1 3.4Å; I140-N163 PolarHBondContact N-OD1 3.43Å; L160-N163 WeakPolarHBondContact O-CB 3.49Å; L160-N163 PolarHBondContact O-ND2 2.92Å; N161-N163 PolarHBondContact O-N 3.14Å; N161-N163 PolarHBondContact O-ND2 3.28Å; N163-N186 VanDerWaalsContact CA-OD1 3.23Å; N163-N186 WeakPolarHBondContact CA-OD1 3.06Å; N163-N186 WeakPolarHBondContact CB-OD1 3.23Å; N163-N186 PolarHBondContact N-OD1 3.12Å; N163-N186 PolarHBondContact O-OD1 3.04Å
164	R	97.3	Very high	92.4	Very high	132 Å²	132	47.8 Å²	47.8	50%	0.498	23%	0.234	S	C	.	.			trans	-124.5	21.6	-175.5	-58	-179.3	177.7	-169	-4.9	112.2	I140 V166 N186	I140-R164 CarbonylContact O-C 3.44Å; I140-R164 VanDerWaalsContact O-C 3.24Å; I140-R164 VanDerWaalsContact O-CA 3.29Å; I140-R164 WeakPolarHBondContact O-CA 3.44Å; I140-R164 PolarHBondContact O-N 3.1Å; R164-V166 PolarHBondContact O-N 3.37Å; R164-N186 PolarHBondContact N-OD1 2.94Å
165	L	96.4	Very high	92.4	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	23%	0.231	C	C	.	.			trans	-62.5	126.3	-178.8	-59.7	174.1	0	0	0	110	I140 L143 L160 N186 K187 I188	I140-L165 HydrophobicContact CG2-CD2 3.92Å; I140-L165 PolarHBondContact O-N 3.45Å; L143-L165 HydrophobicContact CD1-CD1 4.27Å; L143-L165 HydrophobicContact CD1-CD2 4.21Å; L143-L165 HydrophobicContact CD2-CD2 4.43Å; L143-L165 HydrophobicContact CG-CD2 3.85Å; L160-L165 HydrophobicContact CB-CD1 4.38Å; L160-L165 HydrophobicContact CD1-CD1 4.45Å; L165-N186 HydrophobicContact CB-CB 4.14Å; L165-N186 WeakPolarHBondContact CB-OD1 3.27Å; L165-N186 WeakPolarHBondContact CG-OD1 3.45Å; L165-N186 PolarHBondContact N-OD1 2.85Å; L165-K187 CarbonylContact O-C 3.18Å; L165-K187 VanDerWaalsContact O-C 3.22Å; L165-K187 VanDerWaalsContact O-CA 3.27Å; L165-K187 WeakPolarHBondContact O-CA 3.23Å; L165-K187 WeakPolarHBondContact O-CB 3.39Å; L165-K187 PolarHBondContact O-N 3.32Å; L165-I188 HydrophobicContact CB-CG1 4.3Å; L165-I188 PolarHBondContact O-N 3.13Å
166	V	94.1	Very high	92.3	Very high	77 Å²	77	49.6 Å²	49.6	47%	0.467	25%	0.246	S	C	.	.			trans	-105.8	-34	-179.9	-176.1	0	0	0	0	111.7	R164 K187 I188	R164-V166 PolarHBondContact O-N 3.37Å; V166-K187 HydrophobicContact CG2-CB 4.28Å; V166-I188 WeakPolarHBondContact O-CA 3.23Å
167	T	89.6	Confident	92.1	Very high	92 Å²	92	51.2 Å²	51.2	56%	0.564	25%	0.252	S	S	*	.			trans	-134.7	157.3	178.5	55	0	0	0	0	109.8
168	L	90.9	Very high	92.1	Very high	6 Å²	6	49.8 Å²	49.8	3%	0.031	24%	0.243	C	C	.	.			trans	-111.2	112.5	171.9	-64	177.2	0	0	0	107.7	F173 M183 I188 T195 F196 M207	L168-F173 HydrophobicContact CD1-CE2 4.48Å; L168-F173 HydrophobicContact CD2-CE2 4.12Å; L168-F173 HydrophobicContact CD2-CZ 4.28Å; L168-M183 HydrophobicContact CD1-CE 3.85Å; L168-M183 HydrophobicContact CD1-SD 4.42Å; L168-M183 HydrophobicContact CD2-CE 4.4Å; L168-M183 HydrophobicContact CD2-SD 3.88Å; L168-I188 HydrophobicContact CD1-CD1 4.1Å; L168-I188 HydrophobicContact CD2-CD1 3.92Å; L168-I188 HydrophobicContact CG-CD1 4Å; L168-T195 HydrophobicContact CB-CG2 3.67Å; L168-T195 HydrophobicContact CD1-CG2 3.74Å; L168-T195 HydrophobicContact CG-CG2 4.38Å; L168-F196 HydrophobicContact CD1-CE1 4.11Å; L168-F196 HydrophobicContact CD1-CZ 3.88Å; L168-M207 HydrophobicContact CD1-CE 4.17Å
169	P	82.6	Confident	92.1	Very high	31 Å²	31	53.9 Å²	53.9	20%	0.201	26%	0.263	C	S	.	.			trans	-63.1	141.2	179.3	-19.6	30	0	0	0	111.4	P145 K171 V172	P145-P169 HydrophobicContact CG-CB 4.16Å; P169-K171 PolarHBondContact O-N 3.17Å; P169-V172 HydrophobicContact CB-CB 4.2Å; P169-V172 HydrophobicContact CG-CB 4.4Å; P169-V172 HydrophobicContact CG-CG2 4.48Å; P169-V172 VanDerWaalsContact O-CB 3.31Å; P169-V172 WeakPolarHBondContact O-CB 3.12Å; P169-V172 VanDerWaalsContact O-CG1 3.3Å; P169-V172 WeakPolarHBondContact O-CG1 3.31Å; P169-V172 PolarHBondContact O-N 3.28Å; P169-V172 VanDerWaalsContact O-N 3.07Å
170	S	76.9	Confident	92.1	Very high	91 Å²	91	51.9 Å²	51.9	64%	0.636	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	130.1	176.4	66.2	0	0	0	0	110.9	V172	S170-V172 PolarHBondContact O-N 3.1Å
171	K	72.1	Confident	92.1	Very high	143 Å²	143	51.9 Å²	51.9	62%	0.622	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	20.5	179.4	-46.1	170.3	-175	169.8	0	114.9	P169 F173	P169-K171 PolarHBondContact O-N 3.17Å; K171-F173 PolarHBondContact O-N 2.91Å
172	V	84	Confident	92.1	Very high	3 Å²	3	51.7 Å²	51.7	2%	0.018	26%	0.256	C	S	.	.			trans	-61.7	-29.2	173.9	71	0	0	0	0	112.2	L143 P169 S170	L143-V172 HydrophobicContact CB-CG2 3.82Å; L143-V172 HydrophobicContact CD1-CG2 4.4Å; P169-V172 HydrophobicContact CB-CB 4.2Å; P169-V172 HydrophobicContact CG-CB 4.4Å; P169-V172 HydrophobicContact CG-CG2 4.48Å; P169-V172 VanDerWaalsContact O-CB 3.31Å; P169-V172 WeakPolarHBondContact O-CB 3.12Å; P169-V172 VanDerWaalsContact O-CG1 3.3Å; P169-V172 WeakPolarHBondContact O-CG1 3.31Å; P169-V172 PolarHBondContact O-N 3.28Å; P169-V172 VanDerWaalsContact O-N 3.07Å; S170-V172 PolarHBondContact O-N 3.1Å
173	F	87.1	Confident	92.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.233	C	C	.	.			trans	-103.7	83	179.8	-57.2	-61.4	0	0	0	112.2	L143 F148 L158 L160 L168 K171 L175 L181 M183 F196 L199	L143-F173 HydrophobicContact CD1-CE1 4.4Å; L143-F173 HydrophobicContact CD1-CZ 4.27Å; F148-F173 HydrophobicContact CE2-CD1 4.3Å; F148-F173 HydrophobicContact CE2-CE1 4.06Å; L158-F173 HydrophobicContact CD2-CE1 4.18Å; L160-F173 HydrophobicContact CD1-CE1 4.34Å; L160-F173 HydrophobicContact CD1-CZ 4.5Å; L168-F173 HydrophobicContact CD1-CE2 4.48Å; L168-F173 HydrophobicContact CD2-CE2 4.12Å; L168-F173 HydrophobicContact CD2-CZ 4.28Å; K171-F173 PolarHBondContact O-N 2.91Å; F173-L175 HydrophobicContact CD1-CD1 4.2Å; F173-L181 HydrophobicContact CD1-CD2 4.47Å; F173-L181 HydrophobicContact CD2-CD2 4.32Å; F173-L181 HydrophobicContact CE1-CD1 4.37Å; F173-L181 HydrophobicContact CE1-CD2 4.3Å; F173-L181 HydrophobicContact CE2-CD2 4.15Å; F173-L181 HydrophobicContact CG-CD2 4.49Å; F173-L181 HydrophobicContact CZ-CD2 4.14Å; F173-M183 HydrophobicContact CE2-CE 4.33Å; F173-M183 HydrophobicContact CE2-SD 4.15Å; F173-M183 HydrophobicContact CZ-CE 4.44Å; F173-M183 HydrophobicContact CZ-SD 3.72Å; F173-F196 HydrophobicContact CD2-CD1 4.18Å; F173-F196 HydrophobicContact CD2-CE1 4.33Å; F173-F196 HydrophobicContact CE2-CE1 4.22Å; F173-L199 HydrophobicContact CB-CD1 3.91Å; F173-L199 HydrophobicContact CB-CD2 3.79Å; F173-L199 HydrophobicContact CB-CG 3.84Å; F173-L199 HydrophobicContact CD2-CD1 4.45Å; F173-L199 HydrophobicContact CG-CD1 4.28Å
174	K	89.8	Confident	92	Very high	110 Å²	110	48 Å²	48	48%	0.478	24%	0.244	S	C	.	.			trans	-94.5	73.9	162.6	-63.1	-175.4	-163.7	165.5	0	109.3	E149 S152	E149-K174 IonicContact OE1-NZ 3.35Å; E149-K174 PolarHBondContact OE1-NZ 2.81Å; S152-K174 WeakPolarHBondContact CB-O 3.41Å
175	L	94.4	Very high	92.1	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.239	C	C	.	.			trans	-129.4	74	-173.8	-55.8	170.2	0	0	0	109.4	F148 L155 L158 F173 Q177 L178 G198 L199	F148-L175 HydrophobicContact CB-CD1 4.49Å; F148-L175 HydrophobicContact CB-CD2 3.76Å; F148-L175 HydrophobicContact CD2-CD1 4.45Å; F148-L175 HydrophobicContact CG-CD1 4.5Å; L155-L175 HydrophobicContact CD2-CD1 4.2Å; L155-L175 HydrophobicContact CD2-CD2 4.44Å; L158-L175 HydrophobicContact CD2-CD1 3.99Å; F173-L175 HydrophobicContact CD1-CD1 4.2Å; L175-Q177 PolarHBondContact O-N 3.27Å; L175-Q177 VanDerWaalsContact O-N 3.13Å; L175-L178 HydrophobicContact CB-CB 3.78Å; L175-L178 HydrophobicContact CB-CD2 4.35Å; L175-L178 HydrophobicContact CD1-CD1 4.45Å; L175-L178 HydrophobicContact CD1-CD2 3.94Å; L175-L178 VanDerWaalsContact O-CB 3.29Å; L175-L178 WeakPolarHBondContact O-CB 3.21Å; L175-L178 PolarHBondContact O-N 2.91Å; L175-G198 CarbonylContact C-O 3.31Å; L175-G198 VanDerWaalsContact C-O 3.24Å; L175-G198 PolarHBondContact N-O 3.23Å; L175-L199 HydrophobicContact CB-CD2 3.66Å; L175-L199 HydrophobicContact CD1-CD2 4.49Å; L175-L199 HydrophobicContact CG-CD2 4.41Å
176	P	95	Very high	92.1	Very high	47 Å²	47	47.4 Å²	47.4	31%	0.305	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-20	-168.1	25.9	-36.4	0	0	0	114	S201	P176-S201 WeakPolarHBondContact O-CB 3.29Å; P176-S201 PolarHBondContact O-N 3.44Å; P176-S201 PolarHBondContact O-OG 2.95Å
177	Q	96.2	Very high	92.3	Very high	88 Å²	88	49.7 Å²	49.7	41%	0.411	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-4.8	176.3	-62.7	-58.5	-61.9	0	0	113.9	S153 L155 L156 L175 Q179	S153-Q177 WeakPolarHBondContact O-CG 3.11Å; L155-Q177 CarbonylContact O-C 3.59Å; L156-Q177 HydrophobicContact CD2-CB 4.11Å; L156-Q177 VanDerWaalsContact CD2-O 3.31Å; L156-Q177 WeakPolarHBondContact CD2-O 3.46Å; L175-Q177 PolarHBondContact O-N 3.27Å; L175-Q177 VanDerWaalsContact O-N 3.13Å; Q177-Q179 PolarHBondContact O-N 3.19Å
178	L	97.9	Very high	92.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.219	C	C	.	.			trans	-66.6	127.7	-176.7	-165.3	76.1	0	0	0	110.3	L155 L158 L175 L181 L199 S201 L202	L155-L178 HydrophobicContact CD2-CD1 4.19Å; L155-L178 HydrophobicContact CG-CD1 3.98Å; L155-L178 VanDerWaalsContact O-CA 3.23Å; L155-L178 WeakPolarHBondContact O-CA 3.29Å; L155-L178 PolarHBondContact O-N 3.05Å; L158-L178 HydrophobicContact CB-CD1 3.8Å; L158-L178 HydrophobicContact CB-CD2 4.3Å; L175-L178 HydrophobicContact CB-CB 3.78Å; L175-L178 HydrophobicContact CB-CD2 4.35Å; L175-L178 HydrophobicContact CD1-CD1 4.45Å; L175-L178 HydrophobicContact CD1-CD2 3.94Å; L175-L178 VanDerWaalsContact O-CB 3.29Å; L175-L178 WeakPolarHBondContact O-CB 3.21Å; L175-L178 PolarHBondContact O-N 2.91Å; L178-L181 HydrophobicContact CD2-CB 3.91Å; L178-L181 HydrophobicContact CD2-CD1 4.39Å; L178-L181 HydrophobicContact CD2-CD2 4.48Å; L178-L181 HydrophobicContact CD2-CG 4.49Å; L178-L199 HydrophobicContact CB-CD2 4.08Å; L178-L199 HydrophobicContact CD2-CD2 3.76Å; L178-S201 CarbonylContact O-C 3.55Å; L178-L202 HydrophobicContact CB-CD1 4.44Å; L178-L202 HydrophobicContact CD2-CD1 4Å; L178-L202 HydrophobicContact CG-CD1 4.08Å; L178-L202 WeakPolarHBondContact O-CA 3.32Å; L178-L202 PolarHBondContact O-N 3.23Å
179	Q	98.3	Very high	92.8	Very high	86 Å²	86	51.3 Å²	51.3	40%	0.402	25%	0.245	S	C	.	.			trans	-104.8	-32.8	-179.4	-60.2	-177.5	8.8	0	0	112.1	L156 Q177 K203 S204	L156-Q179 PolarHBondContact O-N 2.77Å; Q177-Q179 PolarHBondContact O-N 3.19Å; Q179-K203 PolarHBondContact O-N 3.39Å; Q179-S204 PolarHBondContact O-N 2.79Å
180	L	98.6	Very high	93.4	Very high	34 Å²	34	53.3 Å²	53.3	18%	0.178	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	124.6	-179.6	173.5	62.4	0	0	0	111.4	L156 V157 L158 E182 S204 K206	L156-L180 PolarHBondContact O-N 2.81Å; L156-L180 VanDerWaalsContact O-N 3.15Å; V157-L180 HydrophobicContact CG1-CB 4.37Å; V157-L180 HydrophobicContact CG1-CD2 3.96Å; V157-L180 HydrophobicContact CG1-CG 4.3Å; V157-L180 HydrophobicContact CG2-CB 4.31Å; L158-L180 PolarHBondContact N-O 3.35Å; L180-E182 HydrophobicContact CD1-CG 3.86Å; L180-E182 HydrophobicContact CD2-CG 4.34Å; L180-E182 HydrophobicContact CG-CG 4.06Å; L180-S204 WeakPolarHBondContact CD1-OG 3.21Å; L180-K206 HydrophobicContact CD1-CD 4.24Å; L180-K206 HydrophobicContact CD1-CG 4.35Å
181	L	98.4	Very high	94.2	Very high	0 Å²	0	49 Å²	49	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	112.7	172.4	179.2	53.9	0	0	0	110.2	L158 L160 F173 L178 M183 F196 L199 L202 S204 L205 K206	L158-L181 HydrophobicContact CB-CD1 4.08Å; L158-L181 HydrophobicContact CD2-CD1 3.93Å; L158-L181 HydrophobicContact CG-CD1 3.95Å; L160-L181 HydrophobicContact CD1-CD1 4.48Å; F173-L181 HydrophobicContact CD1-CD2 4.47Å; F173-L181 HydrophobicContact CD2-CD2 4.32Å; F173-L181 HydrophobicContact CE1-CD1 4.37Å; F173-L181 HydrophobicContact CE1-CD2 4.3Å; F173-L181 HydrophobicContact CE2-CD2 4.15Å; F173-L181 HydrophobicContact CG-CD2 4.49Å; F173-L181 HydrophobicContact CZ-CD2 4.14Å; L178-L181 HydrophobicContact CD2-CB 3.91Å; L178-L181 HydrophobicContact CD2-CD1 4.39Å; L178-L181 HydrophobicContact CD2-CD2 4.48Å; L178-L181 HydrophobicContact CD2-CG 4.49Å; L181-M183 HydrophobicContact CD1-CG 3.99Å; L181-M183 HydrophobicContact CD1-SD 4.32Å; L181-M183 HydrophobicContact CD2-CE 3.91Å; L181-M183 HydrophobicContact CD2-SD 4.35Å; L181-M183 HydrophobicContact CG-CE 4.18Å; L181-M183 HydrophobicContact CG-CG 4.15Å; L181-M183 HydrophobicContact CG-SD 4.39Å; L181-F196 HydrophobicContact CD2-CD1 4.47Å; L181-F196 HydrophobicContact CD2-CE1 4.29Å; L181-L199 HydrophobicContact CD2-CD1 3.81Å; L181-L202 HydrophobicContact CB-CD1 3.86Å; L181-S204 PolarHBondContact N-O 3.01Å; L181-L205 HydrophobicContact CB-CD1 4.05Å; L181-L205 HydrophobicContact CD2-CD1 3.97Å; L181-L205 HydrophobicContact CG-CD1 3.98Å; L181-K206 PolarHBondContact O-N 2.87Å
182	E	98.4	Very high	95.2	Very high	7 Å²	7	46 Å²	46	3%	0.033	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	122.6	174.9	-50	-172.2	-150.9	0	0	111.9	L158 R159 L160 N161 L180 K184 K206	L158-E182 PolarHBondContact O-N 2.93Å; R159-E182 HydrophobicContact CG-CB 4.18Å; R159-E182 HydrophobicContact CG-CG 4.07Å; R159-E182 IonicContact CZ-OE1 3.1Å; R159-E182 VanDerWaalsContact CZ-OE1 3.23Å; R159-E182 IonicContact NE-OE1 2.7Å; R159-E182 PolarHBondContact NE-OE1 3.34Å; R159-E182 IonicContact NE-OE2 2.66Å; R159-E182 IonicContact NH2-OE1 2.67Å; R159-E182 PolarHBondContact NH2-OE1 3.48Å; L160-E182 WeakPolarHBondContact CA-O 3.43Å; L160-E182 PolarHBondContact N-O 2.92Å; N161-E182 PolarHBondContact ND2-OE2 2.82Å; N161-E182 WeakPolarHBondContact OD1-CB 3.17Å; L180-E182 HydrophobicContact CD1-CG 3.86Å; L180-E182 HydrophobicContact CD2-CG 4.34Å; L180-E182 HydrophobicContact CG-CG 4.06Å; E182-K184 WeakPolarHBondContact OE2-CE 3.4Å; E182-K184 IonicContact OE2-NZ 2.81Å; E182-K184 PolarHBondContact OE2-NZ 3.48Å; E182-K206 HydrophobicContact CB-CB 4.32Å; E182-K206 HydrophobicContact CG-CB 4.24Å; E182-K206 HydrophobicContact CG-CD 4.1Å; E182-K206 HydrophobicContact CG-CG 4.42Å
183	M	97.1	Very high	95.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.233	C	C	.	.			trans	-131.1	23.7	178.5	-60.7	-169	-71.7	0	0	112.5	L160 N161 L168 F173 L181 N186 F196 L205 K206 M207 N210	L160-M183 HydrophobicContact CB-CG 4.21Å; L160-M183 HydrophobicContact CD1-CG 4.35Å; L160-M183 HydrophobicContact CD1-SD 4.44Å; N161-M183 PolarHBondContact OD1-N 3.41Å; L168-M183 HydrophobicContact CD1-CE 3.85Å; L168-M183 HydrophobicContact CD1-SD 4.42Å; L168-M183 HydrophobicContact CD2-CE 4.4Å; L168-M183 HydrophobicContact CD2-SD 3.88Å; F173-M183 HydrophobicContact CE2-CE 4.33Å; F173-M183 HydrophobicContact CE2-SD 4.15Å; F173-M183 HydrophobicContact CZ-CE 4.44Å; F173-M183 HydrophobicContact CZ-SD 3.72Å; L181-M183 HydrophobicContact CD1-CG 3.99Å; L181-M183 HydrophobicContact CD1-SD 4.32Å; L181-M183 HydrophobicContact CD2-CE 3.91Å; L181-M183 HydrophobicContact CD2-SD 4.35Å; L181-M183 HydrophobicContact CG-CE 4.18Å; L181-M183 HydrophobicContact CG-CG 4.15Å; L181-M183 HydrophobicContact CG-SD 4.39Å; M183-N186 PolarHBondContact O-ND2 2.92Å; M183-F196 HydrophobicContact CE-CE1 3.75Å; M183-F196 HydrophobicContact CE-CZ 4.07Å; M183-L205 HydrophobicContact CE-CD1 4.17Å; M183-K206 PolarHBondContact N-O 2.84Å; M183-M207 HydrophobicContact CE-CE 4Å; M183-M207 HydrophobicContact CE-CG 4.15Å; M183-M207 HydrophobicContact CE-SD 3.99Å; M183-N210 PolarHBondContact O-ND2 2.76Å
184	K	97.4	Very high	95.6	Very high	61 Å²	61	52.5 Å²	52.5	27%	0.265	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	149	-174.8	76.9	-132.5	-178.3	-178	0	113.1	N161 R162 E182 K206 Q208	N161-K184 CarbonylContact C-O 3.54Å; N161-K184 VanDerWaalsContact CA-O 3.27Å; N161-K184 WeakPolarHBondContact CA-O 3.39Å; N161-K184 HydrophobicContact CB-CG 4.13Å; N161-K184 WeakPolarHBondContact OD1-CD 3.28Å; N161-K184 WeakPolarHBondContact OD1-CG 3.34Å; N161-K184 PolarHBondContact OD1-N 2.95Å; R162-K184 PolarHBondContact N-O 2.77Å; E182-K184 WeakPolarHBondContact OE2-CE 3.4Å; E182-K184 IonicContact OE2-NZ 2.81Å; E182-K184 PolarHBondContact OE2-NZ 3.48Å; K184-K206 PolarHBondContact N-O 3.29Å; K184-Q208 CarbonylContact C-O 3.5Å; K184-Q208 VanDerWaalsContact CA-O 3.26Å; K184-Q208 WeakPolarHBondContact CA-O 3.44Å; K184-Q208 HydrophobicContact CB-CB 4.32Å; K184-Q208 VanDerWaalsContact CD-OE1 3.31Å
185	R	97.9	Very high	95.6	Very high	109 Å²	109	47.3 Å²	47.3	41%	0.411	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	42.6	-177.6	-56	-179.9	-173.3	-166.3	1.7	113.5	R162 Q208 R209	R162-R185 VanDerWaalsContact CA-O 3.31Å; R162-R185 WeakPolarHBondContact CA-O 3.5Å; R162-R185 HydrophobicContact CG-CB 3.97Å; R185-Q208 PolarHBondContact N-O 3.16Å; R185-R209 WeakPolarHBondContact CA-O 3.32Å; R185-R209 HydrophobicContact CB-CB 4.5Å; R185-R209 HydrophobicContact CG-CB 3.75Å; R185-R209 HydrophobicContact CG-CG 4.41Å
186	N	97.9	Very high	95.5	Very high	10 Å²	10	47.3 Å²	47.3	5%	0.053	23%	0.23	C	C	.	.	S	Bend	trans	-97.8	-153.3	165.2	-85.3	-79.8	0	0	0	109.4	L160 N163 R164 L165 M183 I188 N210	L160-N186 PolarHBondContact O-ND2 2.8Å; N163-N186 VanDerWaalsContact CA-OD1 3.23Å; N163-N186 WeakPolarHBondContact CA-OD1 3.06Å; N163-N186 WeakPolarHBondContact CB-OD1 3.23Å; N163-N186 PolarHBondContact N-OD1 3.12Å; N163-N186 PolarHBondContact O-OD1 3.04Å; R164-N186 PolarHBondContact N-OD1 2.94Å; L165-N186 HydrophobicContact CB-CB 4.14Å; L165-N186 WeakPolarHBondContact CB-OD1 3.27Å; L165-N186 WeakPolarHBondContact CG-OD1 3.45Å; L165-N186 PolarHBondContact N-OD1 2.85Å; M183-N186 PolarHBondContact O-ND2 2.92Å; N186-I188 HydrophobicContact CB-CD1 4.34Å; N186-I188 HydrophobicContact CB-CG1 4.3Å; N186-N210 VanDerWaalsContact CA-OD1 3.31Å; N186-N210 WeakPolarHBondContact CA-OD1 3.43Å; N186-N210 WeakPolarHBondContact CB-OD1 3.43Å; N186-N210 PolarHBondContact N-OD1 3.38Å
187	K	96.9	Very high	95.3	Very high	126 Å²	126	50.6 Å²	50.6	55%	0.548	24%	0.239	S	C	.	.			trans	-130.5	28.1	-178.6	-59	-173.6	175.8	-170.2	0	112.1	L165 V166 K189 N210	L165-K187 CarbonylContact O-C 3.18Å; L165-K187 VanDerWaalsContact O-C 3.22Å; L165-K187 VanDerWaalsContact O-CA 3.27Å; L165-K187 WeakPolarHBondContact O-CA 3.23Å; L165-K187 WeakPolarHBondContact O-CB 3.39Å; L165-K187 PolarHBondContact O-N 3.32Å; V166-K187 HydrophobicContact CG2-CB 4.28Å; K187-K189 PolarHBondContact O-N 3.02Å; K187-N210 CarbonylContact C-O 3.54Å; K187-N210 WeakPolarHBondContact CA-O 3.4Å; K187-N210 PolarHBondContact N-OD1 2.72Å
188	I	96.5	Very high	95	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.227	C	C	.	.			trans	-73.7	112.2	-174.6	-57.7	165.7	0	0	0	108.7	L165 V166 L168 N186 I190 V191 M207 N210 G211 I212	L165-I188 HydrophobicContact CB-CG1 4.3Å; L165-I188 PolarHBondContact O-N 3.13Å; V166-I188 WeakPolarHBondContact O-CA 3.23Å; L168-I188 HydrophobicContact CD1-CD1 4.1Å; L168-I188 HydrophobicContact CD2-CD1 3.92Å; L168-I188 HydrophobicContact CG-CD1 4Å; N186-I188 HydrophobicContact CB-CD1 4.34Å; N186-I188 HydrophobicContact CB-CG1 4.3Å; I188-I190 WeakPolarHBondContact CG2-O 3.01Å; I188-V191 HydrophobicContact CG2-CG2 4.3Å; I188-M207 HydrophobicContact CD1-CE 4.15Å; I188-M207 HydrophobicContact CG2-CE 4.47Å; I188-N210 HydrophobicContact CB-CB 4.21Å; I188-N210 WeakPolarHBondContact CB-OD1 3.31Å; I188-N210 WeakPolarHBondContact CG1-OD1 3.36Å; I188-N210 PolarHBondContact N-O 3.43Å; I188-N210 PolarHBondContact N-OD1 2.89Å; I188-N210 VanDerWaalsContact N-OD1 3.13Å; I188-G211 CarbonylContact O-C 3.52Å; I188-I212 WeakPolarHBondContact O-CA 3.14Å; I188-I212 WeakPolarHBondContact O-CG1 3.46Å; I188-I212 PolarHBondContact O-N 3.12Å
189	K	95.3	Very high	94.8	Very high	132 Å²	132	47.1 Å²	47.1	57%	0.574	23%	0.227	S	C	*	.			trans	-92.7	-29.8	-179.2	-69	-166.9	173.2	-166.9	0	114.3	K187 I212 T213 K214	K187-K189 PolarHBondContact O-N 3.02Å; K189-I212 WeakPolarHBondContact O-CA 3.31Å; K189-T213 PolarHBondContact O-N 2.59Å; K189-T213 PolarHBondContact O-OG1 3.37Å; K189-K214 PolarHBondContact O-N 3.35Å
190	I	94.9	Very high	94.5	Very high	72 Å²	72	46.5 Å²	46.5	37%	0.369	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	139	-175	-59.1	177.9	0	0	0	107.7	I188 K214 M216	I188-I190 WeakPolarHBondContact CG2-O 3.01Å; I190-K214 WeakPolarHBondContact CA-O 3.46Å; I190-M216 HydrophobicContact CG2-CE 3.82Å; I190-M216 HydrophobicContact CG2-CG 4.24Å
191	V	94.4	Very high	94.4	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.006	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	115.6	166.8	-174.3	0	0	0	0	107.8	I188 T195 F196 M207 I212 K214 L215 M216 A219	I188-V191 HydrophobicContact CG2-CG2 4.3Å; V191-T195 HydrophobicContact CG1-CG2 4.23Å; V191-F196 HydrophobicContact CG1-CE2 3.7Å; V191-F196 HydrophobicContact CG1-CZ 4.3Å; V191-M207 HydrophobicContact CG2-CE 3.95Å; V191-I212 HydrophobicContact CG2-CD1 4.42Å; V191-K214 PolarHBondContact N-O 2.64Å; V191-L215 HydrophobicContact CB-CD2 3.79Å; V191-L215 HydrophobicContact CG2-CD2 3.72Å; V191-M216 WeakPolarHBondContact O-CB 3.46Å; V191-M216 WeakPolarHBondContact O-CG 3.39Å; V191-M216 PolarHBondContact O-N 2.62Å; V191-A219 HydrophobicContact CB-CB 4.23Å; V191-A219 HydrophobicContact CG1-CB 3.86Å
192	D	92.1	Very high	94.4	Very high	79 Å²	79	46.5 Å²	46.5	42%	0.422	23%	0.229	S	C	.	.			trans	-78.2	159.4	-178.7	-66.7	-52.7	0	0	0	112	T195	D192-T195 PolarHBondContact N-OG1 3.07Å; D192-T195 WeakPolarHBondContact O-CB 3.38Å; D192-T195 PolarHBondContact O-N 3.45Å; D192-T195 PolarHBondContact O-OG1 3.35Å
193	S	90.4	Very high	94.4	Very high	61 Å²	61	50.4 Å²	50.4	43%	0.427	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	138.9	175.9	-54	0	0	0	0	111.9	T195 D217	S193-T195 PolarHBondContact O-N 2.84Å; S193-T195 VanDerWaalsContact O-N 3.17Å; S193-D217 WeakPolarHBondContact CB-O 3.31Å; S193-D217 PolarHBondContact OG-O 3.4Å
194	L	89.1	Confident	94.5	Very high	79 Å²	79	51 Å²	51	41%	0.414	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	14.9	177.6	-44	174.8	0	0	0	115.2	F196 K197 G218 F221	L194-F196 PolarHBondContact O-N 3.05Å; L194-F196 VanDerWaalsContact O-N 3.13Å; L194-K197 HydrophobicContact CB-CB 4.31Å; L194-K197 WeakPolarHBondContact O-CB 3.27Å; L194-K197 PolarHBondContact O-N 3.23Å; L194-K197 VanDerWaalsContact O-N 3.1Å; L194-G218 PolarHBondContact N-O 3.37Å; L194-F221 HydrophobicContact CD2-CB 4.1Å; L194-F221 HydrophobicContact CD2-CD1 3.43Å; L194-F221 VanDerWaalsContact CD2-CD1 3.43Å; L194-F221 HydrophobicContact CD2-CE1 4.23Å; L194-F221 HydrophobicContact CD2-CG 4.1Å
195	T	91.1	Very high	94.5	Very high	2 Å²	2	48 Å²	48	1%	0.012	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-38.4	-177.9	-71.4	0	0	0	0	112.6	L168 V191 D192 S193	L168-T195 HydrophobicContact CB-CG2 3.67Å; L168-T195 HydrophobicContact CD1-CG2 3.74Å; L168-T195 HydrophobicContact CG-CG2 4.38Å; V191-T195 HydrophobicContact CG1-CG2 4.23Å; D192-T195 PolarHBondContact N-OG1 3.07Å; D192-T195 WeakPolarHBondContact O-CB 3.38Å; D192-T195 PolarHBondContact O-N 3.45Å; D192-T195 PolarHBondContact O-OG1 3.35Å; S193-T195 PolarHBondContact O-N 2.84Å; S193-T195 VanDerWaalsContact O-N 3.17Å
196	F	92.6	Very high	94.5	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	10.4	-175.4	-58.8	-66.9	0	0	0	114.9	L168 F173 L181 M183 V191 L194 G198 L199 L205 M207 A219 F220 L223	L168-F196 HydrophobicContact CD1-CE1 4.11Å; L168-F196 HydrophobicContact CD1-CZ 3.88Å; F173-F196 HydrophobicContact CD2-CD1 4.18Å; F173-F196 HydrophobicContact CD2-CE1 4.33Å; F173-F196 HydrophobicContact CE2-CE1 4.22Å; L181-F196 HydrophobicContact CD2-CD1 4.47Å; L181-F196 HydrophobicContact CD2-CE1 4.29Å; M183-F196 HydrophobicContact CE-CE1 3.75Å; M183-F196 HydrophobicContact CE-CZ 4.07Å; V191-F196 HydrophobicContact CG1-CE2 3.7Å; V191-F196 HydrophobicContact CG1-CZ 4.3Å; L194-F196 PolarHBondContact O-N 3.05Å; L194-F196 VanDerWaalsContact O-N 3.13Å; F196-G198 PolarHBondContact O-N 3.03Å; F196-L199 HydrophobicContact CB-CD1 4.18Å; F196-L199 HydrophobicContact CD1-CD1 3.84Å; F196-L199 HydrophobicContact CG-CD1 4.48Å; F196-L199 WeakPolarHBondContact O-CB 3.35Å; F196-L199 PolarHBondContact O-N 2.66Å; F196-L205 HydrophobicContact CD1-CD2 4.43Å; F196-L205 HydrophobicContact CD2-CD2 4.21Å; F196-L205 HydrophobicContact CE1-CD1 4.25Å; F196-L205 HydrophobicContact CE1-CD2 4.18Å; F196-L205 HydrophobicContact CE2-CD2 3.94Å; F196-L205 HydrophobicContact CG-CD2 4.44Å; F196-L205 HydrophobicContact CZ-CD1 4.48Å; F196-L205 HydrophobicContact CZ-CD2 3.94Å; F196-M207 HydrophobicContact CE2-SD 4.24Å; F196-M207 HydrophobicContact CZ-CE 4.12Å; F196-M207 HydrophobicContact CZ-SD 3.62Å; F196-A219 WeakPolarHBondContact CD2-O 3.5Å; F196-F220 AromaticContact CD2-CD1 3.68Å; F196-F220 HydrophobicContact CD2-CD1 3.68Å; F196-F220 HydrophobicContact CD2-CE1 4.19Å; F196-F220 AromaticContact CE2-CD1 3.64Å; F196-F220 HydrophobicContact CE2-CD1 3.64Å; F196-F220 AromaticContact CE2-CE1 3.65Å; F196-F220 HydrophobicContact CE2-CE1 3.65Å; F196-L223 HydrophobicContact CB-CD1 4.03Å; F196-L223 HydrophobicContact CB-CD2 3.8Å; F196-L223 HydrophobicContact CB-CG 3.88Å; F196-L223 HydrophobicContact CD2-CD1 4.31Å; F196-L223 HydrophobicContact CG-CD1 4.25Å
197	K	90.1	Very high	94.5	Very high	115 Å²	115	43.6 Å²	43.6	50%	0.5	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	121.1	179	-177.7	172	-179.1	169.7	0	111.2	L194	L194-K197 HydrophobicContact CB-CB 4.31Å; L194-K197 WeakPolarHBondContact O-CB 3.27Å; L194-K197 PolarHBondContact O-N 3.23Å; L194-K197 VanDerWaalsContact O-N 3.1Å
198	G	89.8	Confident	94.5	Very high	15 Å²	15	38.6 Å²	38.6	16%	0.155	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	107.8	8.4	-172.8	0	0	0	0	0	114.3	L175 F196	L175-G198 CarbonylContact C-O 3.31Å; L175-G198 VanDerWaalsContact C-O 3.24Å; L175-G198 PolarHBondContact N-O 3.23Å; F196-G198 PolarHBondContact O-N 3.03Å
199	L	94.4	Very high	94.6	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.22	C	C	.	.			trans	-103.1	53.4	170.8	-67.6	-174.5	0	0	0	111.2	F173 L175 L178 L181 F196 S201 L202 L223	F173-L199 HydrophobicContact CB-CD1 3.91Å; F173-L199 HydrophobicContact CB-CD2 3.79Å; F173-L199 HydrophobicContact CB-CG 3.84Å; F173-L199 HydrophobicContact CD2-CD1 4.45Å; F173-L199 HydrophobicContact CG-CD1 4.28Å; L175-L199 HydrophobicContact CB-CD2 3.66Å; L175-L199 HydrophobicContact CD1-CD2 4.49Å; L175-L199 HydrophobicContact CG-CD2 4.41Å; L178-L199 HydrophobicContact CB-CD2 4.08Å; L178-L199 HydrophobicContact CD2-CD2 3.76Å; L181-L199 HydrophobicContact CD2-CD1 3.81Å; F196-L199 HydrophobicContact CB-CD1 4.18Å; F196-L199 HydrophobicContact CD1-CD1 3.84Å; F196-L199 HydrophobicContact CG-CD1 4.48Å; F196-L199 WeakPolarHBondContact O-CB 3.35Å; F196-L199 PolarHBondContact O-N 2.66Å; L199-S201 VanDerWaalsContact C-N 3.3Å; L199-S201 PolarHBondContact O-N 3.02Å; L199-L202 HydrophobicContact CB-CB 4.02Å; L199-L202 HydrophobicContact CB-CD2 4.33Å; L199-L202 HydrophobicContact CD1-CD2 3.96Å; L199-L202 VanDerWaalsContact O-CB 3.29Å; L199-L202 WeakPolarHBondContact O-CB 3.26Å; L199-L202 PolarHBondContact O-N 2.63Å; L199-L202 VanDerWaalsContact O-N 3.12Å; L199-L223 HydrophobicContact CB-CD2 3.75Å
200	D	91.7	Very high	94.7	Very high	73 Å²	73	38.1 Å²	38.1	39%	0.39	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-26.3	-163.8	-50.7	-51.1	0	0	0	114.4	N225	D200-N225 PolarHBondContact O-ND2 2.93Å
201	S	96.3	Very high	94.8	Very high	34 Å²	34	36.2 Å²	36.2	24%	0.238	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	8.2	176.8	-53.2	0	0	0	0	114.6	P176 L178 L199 K203	P176-S201 WeakPolarHBondContact O-CB 3.29Å; P176-S201 PolarHBondContact O-N 3.44Å; P176-S201 PolarHBondContact O-OG 2.95Å; L178-S201 CarbonylContact O-C 3.55Å; L199-S201 VanDerWaalsContact C-N 3.3Å; L199-S201 PolarHBondContact O-N 3.02Å; S201-K203 PolarHBondContact O-N 2.84Å
202	L	97.8	Very high	94.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.192	C	C	.	.			trans	-69.7	121.3	-172.1	-166.9	78.2	0	0	0	111.3	L178 L181 L199 L205 L223 N225 I226	L178-L202 HydrophobicContact CB-CD1 4.44Å; L178-L202 HydrophobicContact CD2-CD1 4Å; L178-L202 HydrophobicContact CG-CD1 4.08Å; L178-L202 WeakPolarHBondContact O-CA 3.32Å; L178-L202 PolarHBondContact O-N 3.23Å; L181-L202 HydrophobicContact CB-CD1 3.86Å; L199-L202 HydrophobicContact CB-CB 4.02Å; L199-L202 HydrophobicContact CB-CD2 4.33Å; L199-L202 HydrophobicContact CD1-CD2 3.96Å; L199-L202 VanDerWaalsContact O-CB 3.29Å; L199-L202 WeakPolarHBondContact O-CB 3.26Å; L199-L202 PolarHBondContact O-N 2.63Å; L199-L202 VanDerWaalsContact O-N 3.12Å; L202-L205 HydrophobicContact CD2-CB 4.05Å; L202-L223 HydrophobicContact CB-CD2 4.06Å; L202-L223 HydrophobicContact CD2-CD1 4.32Å; L202-L223 HydrophobicContact CD2-CD2 3.64Å; L202-L223 HydrophobicContact CG-CD2 4.49Å; L202-N225 CarbonylContact O-C 3.54Å; L202-I226 HydrophobicContact CD2-CD1 4.03Å; L202-I226 HydrophobicContact CG-CD1 4.14Å; L202-I226 WeakPolarHBondContact O-CA 3.19Å; L202-I226 PolarHBondContact O-N 3.23Å; L202-I226 VanDerWaalsContact O-N 3.12Å
203	K	98.2	Very high	95.1	Very high	90 Å²	90	35.7 Å²	35.7	39%	0.391	19%	0.192	S	C	.	.			trans	-97.4	-35.1	178.2	-71.2	172.9	165.1	-81.9	0	112.4	Q179 S201 I226 E227 E228	Q179-K203 PolarHBondContact O-N 3.39Å; S201-K203 PolarHBondContact O-N 2.84Å; K203-I226 WeakPolarHBondContact O-CD1 3.27Å; K203-E227 IonicContact NZ-OE1 3.24Å; K203-E227 PolarHBondContact NZ-OE1 3.42Å; K203-E227 PolarHBondContact O-N 2.9Å; K203-E228 PolarHBondContact O-N 2.88Å
204	S	98.6	Very high	95.3	Very high	11 Å²	11	38.1 Å²	38.1	8%	0.077	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	126.6	-173.5	177.2	0	0	0	0	112.3	Q179 L180 L181 K206 E228	Q179-S204 PolarHBondContact O-N 2.79Å; L180-S204 WeakPolarHBondContact CD1-OG 3.21Å; L181-S204 PolarHBondContact N-O 3.01Å; S204-K206 WeakPolarHBondContact OG-CE 3.18Å; S204-E228 WeakPolarHBondContact CA-O 3.28Å; S204-E228 WeakPolarHBondContact CB-OE2 3.21Å; S204-E228 PolarHBondContact OG-OE2 3.01Å
205	L	98.4	Very high	95.6	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	112.2	177.5	178.8	55.8	0	0	0	110.4	L181 M183 F196 L202 M207 F220 L223 I226 E228 L229 E230	L181-L205 HydrophobicContact CB-CD1 4.05Å; L181-L205 HydrophobicContact CD2-CD1 3.97Å; L181-L205 HydrophobicContact CG-CD1 3.98Å; M183-L205 HydrophobicContact CE-CD1 4.17Å; F196-L205 HydrophobicContact CD1-CD2 4.43Å; F196-L205 HydrophobicContact CD2-CD2 4.21Å; F196-L205 HydrophobicContact CE1-CD1 4.25Å; F196-L205 HydrophobicContact CE1-CD2 4.18Å; F196-L205 HydrophobicContact CE2-CD2 3.94Å; F196-L205 HydrophobicContact CG-CD2 4.44Å; F196-L205 HydrophobicContact CZ-CD1 4.48Å; F196-L205 HydrophobicContact CZ-CD2 3.94Å; L202-L205 HydrophobicContact CD2-CB 4.05Å; L205-M207 HydrophobicContact CD1-CG 3.9Å; L205-M207 HydrophobicContact CD1-SD 4.01Å; L205-M207 HydrophobicContact CD2-SD 4.03Å; L205-M207 HydrophobicContact CG-CG 4.04Å; L205-M207 HydrophobicContact CG-SD 4.04Å; L205-F220 HydrophobicContact CD2-CD1 3.95Å; L205-F220 HydrophobicContact CD2-CE1 3.86Å; L205-L223 HydrophobicContact CD2-CD1 3.86Å; L205-I226 HydrophobicContact CB-CD1 3.85Å; L205-E228 PolarHBondContact N-O 3.28Å; L205-L229 HydrophobicContact CB-CD1 4.08Å; L205-L229 HydrophobicContact CD2-CD1 3.99Å; L205-L229 HydrophobicContact CG-CD1 4.05Å; L205-E230 PolarHBondContact O-N 3.48Å
206	K	98.4	Very high	95.6	Very high	25 Å²	25	37 Å²	37	11%	0.109	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	104.3	-172.8	-56.5	-167.9	175.4	-71.9	0	111.7	L180 L181 E182 M183 K184 S204 E228 E230	L180-K206 HydrophobicContact CD1-CD 4.24Å; L180-K206 HydrophobicContact CD1-CG 4.35Å; L181-K206 PolarHBondContact O-N 2.87Å; E182-K206 HydrophobicContact CB-CB 4.32Å; E182-K206 HydrophobicContact CG-CB 4.24Å; E182-K206 HydrophobicContact CG-CD 4.1Å; E182-K206 HydrophobicContact CG-CG 4.42Å; M183-K206 PolarHBondContact N-O 2.84Å; K184-K206 PolarHBondContact N-O 3.29Å; S204-K206 WeakPolarHBondContact OG-CE 3.18Å; K206-E228 IonicContact NZ-OE1 2.85Å; K206-E228 PolarHBondContact NZ-OE1 3.02Å; K206-E228 IonicContact NZ-OE2 3.79Å; K206-E228 PolarHBondContact NZ-OE2 2.87Å; K206-E228 VanDerWaalsContact NZ-OE2 3.08Å; K206-E230 WeakPolarHBondContact CB-OE2 3.44Å; K206-E230 WeakPolarHBondContact CD-OE2 3.49Å; K206-E230 HydrophobicContact CG-CB 4.47Å; K206-E230 HydrophobicContact CG-CG 4.47Å; K206-E230 WeakPolarHBondContact CG-OE2 3.2Å; K206-E230 IonicContact NZ-OE1 3.23Å; K206-E230 PolarHBondContact NZ-OE1 3.02Å; K206-E230 IonicContact NZ-OE2 3.52Å; K206-E230 PolarHBondContact NZ-OE2 3.5Å; K206-E230 VanDerWaalsContact NZ-OE2 3.13Å
207	M	97.6	Very high	95.5	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.215	C	C	.	.			trans	-124.8	19.9	-171.1	-68	-171.5	72.5	0	0	114.8	L168 M183 I188 V191 F196 L205 N210 I212 F220 E230 L231 N234	L168-M207 HydrophobicContact CD1-CE 4.17Å; M183-M207 HydrophobicContact CE-CE 4Å; M183-M207 HydrophobicContact CE-CG 4.15Å; M183-M207 HydrophobicContact CE-SD 3.99Å; I188-M207 HydrophobicContact CD1-CE 4.15Å; I188-M207 HydrophobicContact CG2-CE 4.47Å; V191-M207 HydrophobicContact CG2-CE 3.95Å; F196-M207 HydrophobicContact CE2-SD 4.24Å; F196-M207 HydrophobicContact CZ-CE 4.12Å; F196-M207 HydrophobicContact CZ-SD 3.62Å; L205-M207 HydrophobicContact CD1-CG 3.9Å; L205-M207 HydrophobicContact CD1-SD 4.01Å; L205-M207 HydrophobicContact CD2-SD 4.03Å; L205-M207 HydrophobicContact CG-CG 4.04Å; L205-M207 HydrophobicContact CG-SD 4.04Å; M207-N210 PolarHBondContact O-ND2 2.94Å; M207-I212 HydrophobicContact CB-CD1 4.39Å; M207-I212 HydrophobicContact CE-CD1 4.06Å; M207-F220 HydrophobicContact SD-CE1 4.46Å; M207-E230 CarbonylContact C-O 3.6Å; M207-E230 WeakPolarHBondContact CA-O 3.36Å; M207-E230 PolarHBondContact N-O 3.49Å; M207-L231 HydrophobicContact CB-CD2 4Å; M207-N234 PolarHBondContact O-ND2 2.69Å
208	Q	97.3	Very high	95.4	Very high	21 Å²	21	37 Å²	37	10%	0.098	20%	0.196	C	C	.	.			trans	-57.4	156.6	-179	-41.7	82.8	53.7	0	0	114	K184 R185 N210 E230 E232	K184-Q208 CarbonylContact C-O 3.5Å; K184-Q208 VanDerWaalsContact CA-O 3.26Å; K184-Q208 WeakPolarHBondContact CA-O 3.44Å; K184-Q208 HydrophobicContact CB-CB 4.32Å; K184-Q208 VanDerWaalsContact CD-OE1 3.31Å; R185-Q208 PolarHBondContact N-O 3.16Å; Q208-N210 VanDerWaalsContact C-N 3.27Å; Q208-N210 PolarHBondContact O-N 3.12Å; Q208-N210 PolarHBondContact O-ND2 2.83Å; Q208-E230 HydrophobicContact CG-CB 4.35Å; Q208-E230 PolarHBondContact N-O 2.82Å; Q208-E230 PolarHBondContact NE2-O 3.45Å; Q208-E230 PolarHBondContact NE2-OE2 3.32Å; Q208-E232 CarbonylContact C-O 3.58Å; Q208-E232 WeakPolarHBondContact CA-O 3.45Å; Q208-E232 VanDerWaalsContact CB-O 3.29Å; Q208-E232 WeakPolarHBondContact CB-O 3.1Å; Q208-E232 HydrophobicContact CG-CB 4.2Å; Q208-E232 VanDerWaalsContact CG-CD 3.45Å; Q208-E232 HydrophobicContact CG-CG 4.48Å; Q208-E232 WeakPolarHBondContact CG-OE1 3.07Å; Q208-E232 VanDerWaalsContact CG-OE2 3.28Å; Q208-E232 WeakPolarHBondContact CG-OE2 3.37Å
209	R	97.9	Very high	95.5	Very high	115 Å²	115	36.2 Å²	36.2	43%	0.434	19%	0.188	S	C	.	.	S	Bend	trans	57.3	37.9	168.5	-62.3	179.5	-176.8	-146.6	0.6	113.1	R185 E232 H233	R185-R209 WeakPolarHBondContact CA-O 3.32Å; R185-R209 HydrophobicContact CB-CB 4.5Å; R185-R209 HydrophobicContact CG-CB 3.75Å; R185-R209 HydrophobicContact CG-CG 4.41Å; R209-E232 PolarHBondContact N-O 3.46Å; R209-H233 VanDerWaalsContact CA-O 3.27Å; R209-H233 WeakPolarHBondContact CA-O 3.46Å; R209-H233 HydrophobicContact CB-CB 4.34Å; R209-H233 HydrophobicContact CG-CB 3.4Å; R209-H233 VanDerWaalsContact CG-CB 3.4Å; R209-H233 PolarHBondContact N-O 2.8Å; R209-H233 PolarHBondContact NE-CD2 3Å; R209-H233 PolarHBondContact NE-NE2 2.69Å; R209-H233 PolarHBondContact NH2-NE2 3.13Å
210	N	97.4	Very high	95.4	Very high	8 Å²	8	36.3 Å²	36.3	4%	0.043	19%	0.189	C	C	.	.	S	Bend	trans	-96.8	-24.3	177.8	-96.5	-75.1	0	0	0	113.3	M183 N186 K187 I188 M207 Q208 I212 N234	M183-N210 PolarHBondContact O-ND2 2.76Å; N186-N210 VanDerWaalsContact CA-OD1 3.31Å; N186-N210 WeakPolarHBondContact CA-OD1 3.43Å; N186-N210 WeakPolarHBondContact CB-OD1 3.43Å; N186-N210 PolarHBondContact N-OD1 3.38Å; K187-N210 CarbonylContact C-O 3.54Å; K187-N210 WeakPolarHBondContact CA-O 3.4Å; K187-N210 PolarHBondContact N-OD1 2.72Å; I188-N210 HydrophobicContact CB-CB 4.21Å; I188-N210 WeakPolarHBondContact CB-OD1 3.31Å; I188-N210 WeakPolarHBondContact CG1-OD1 3.36Å; I188-N210 PolarHBondContact N-O 3.43Å; I188-N210 PolarHBondContact N-OD1 2.89Å; I188-N210 VanDerWaalsContact N-OD1 3.13Å; M207-N210 PolarHBondContact O-ND2 2.94Å; Q208-N210 VanDerWaalsContact C-N 3.27Å; Q208-N210 PolarHBondContact O-N 3.12Å; Q208-N210 PolarHBondContact O-ND2 2.83Å; N210-I212 HydrophobicContact CB-CD1 4.19Å; N210-I212 HydrophobicContact CB-CG1 3.78Å; N210-N234 WeakPolarHBondContact CA-OD1 3.17Å; N210-N234 WeakPolarHBondContact CB-OD1 3.5Å; N210-N234 PolarHBondContact N-OD1 3.1Å
211	G	96.4	Very high	95.4	Very high	31 Å²	31	36.1 Å²	36.1	32%	0.32	18%	0.184	S	C	.	.			trans	76.8	34	-169.8	0	0	0	0	0	112.2	I188 T213 N234	I188-G211 CarbonylContact O-C 3.52Å; G211-T213 PolarHBondContact O-N 3.08Å; G211-N234 PolarHBondContact N-OD1 2.92Å
212	I	97.7	Very high	95	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.177	C	C	.	.			trans	-63.7	119.3	175.8	-56.6	166.8	0	0	0	108.3	I188 K189 V191 M207 N210 L215 L231 N234 N235 L236	I188-I212 WeakPolarHBondContact O-CA 3.14Å; I188-I212 WeakPolarHBondContact O-CG1 3.46Å; I188-I212 PolarHBondContact O-N 3.12Å; K189-I212 WeakPolarHBondContact O-CA 3.31Å; V191-I212 HydrophobicContact CG2-CD1 4.42Å; M207-I212 HydrophobicContact CB-CD1 4.39Å; M207-I212 HydrophobicContact CE-CD1 4.06Å; N210-I212 HydrophobicContact CB-CD1 4.19Å; N210-I212 HydrophobicContact CB-CG1 3.78Å; I212-L215 HydrophobicContact CG2-CD2 3.85Å; I212-L215 HydrophobicContact CG2-CG 4.23Å; I212-L231 HydrophobicContact CD1-CD2 3.83Å; I212-N234 HydrophobicContact CB-CB 4.08Å; I212-N234 WeakPolarHBondContact CG1-OD1 3.46Å; I212-N234 PolarHBondContact N-OD1 2.78Å; I212-N235 CarbonylContact O-C 3.14Å; I212-N235 VanDerWaalsContact O-C 3.23Å; I212-N235 WeakPolarHBondContact O-CA 3.48Å; I212-N235 PolarHBondContact O-N 2.64Å; I212-L236 HydrophobicContact CG2-CD2 3.93Å; I212-L236 PolarHBondContact O-N 2.5Å
213	T	95.8	Very high	94.8	Very high	70 Å²	70	35 Å²	35	43%	0.429	18%	0.177	S	C	.	.			trans	-102.8	-23.8	177.4	51.4	0	0	0	0	112.5	K189 G211 N235	K189-T213 PolarHBondContact O-N 2.59Å; K189-T213 PolarHBondContact O-OG1 3.37Å; G211-T213 PolarHBondContact O-N 3.08Å; T213-N235 HydrophobicContact CG2-CB 4.03Å
214	K	94.1	Very high	94.4	Very high	111 Å²	111	34.9 Å²	34.9	48%	0.483	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	133.2	-179.6	-167	175.7	-175.9	-169.3	0	111.7	K189 I190 V191 M216	K189-K214 PolarHBondContact O-N 3.35Å; I190-K214 WeakPolarHBondContact CA-O 3.46Å; V191-K214 PolarHBondContact N-O 2.64Å; K214-M216 HydrophobicContact CD-CE 3.97Å; K214-M216 HydrophobicContact CD-SD 3.73Å; K214-M216 WeakPolarHBondContact CE-SD 3.47Å; K214-M216 HydrophobicContact CG-SD 4.27Å; K214-M216 PolarHBondContact NZ-SD 3.27Å
215	L	95.5	Very high	94.2	Very high	14 Å²	14	38 Å²	38	7%	0.073	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.9	164.6	-60.8	168.4	0	0	0	106.5	V191 I212 A219 F220 L231 L236 W243	V191-L215 HydrophobicContact CB-CD2 3.79Å; V191-L215 HydrophobicContact CG2-CD2 3.72Å; I212-L215 HydrophobicContact CG2-CD2 3.85Å; I212-L215 HydrophobicContact CG2-CG 4.23Å; L215-A219 HydrophobicContact CB-CB 4.38Å; L215-F220 HydrophobicContact CD1-CE2 3.94Å; L215-F220 HydrophobicContact CD1-CZ 4.36Å; L215-F220 HydrophobicContact CD2-CE2 4.11Å; L215-F220 HydrophobicContact CD2-CZ 3.89Å; L215-L231 HydrophobicContact CD1-CD1 4.4Å; L215-L236 HydrophobicContact CD1-CD1 3.97Å; L215-L236 HydrophobicContact CD1-CD2 3.89Å; L215-L236 HydrophobicContact CG-CD2 3.88Å; L215-W243 HydrophobicContact CB-CB 3.64Å; L215-W243 HydrophobicContact CB-CD2 4.41Å; L215-W243 HydrophobicContact CB-CG 3.91Å; L215-W243 HydrophobicContact CD1-CB 4.36Å; L215-W243 HydrophobicContact CD1-CD2 3.52Å; L215-W243 HydrophobicContact CD1-CE3 3.53Å; L215-W243 HydrophobicContact CD1-CG 3.93Å; L215-W243 HydrophobicContact CD1-CH2 4.31Å; L215-W243 HydrophobicContact CD1-CZ2 4.32Å; L215-W243 HydrophobicContact CD1-CZ3 3.93Å
216	M	91.7	Very high	94.2	Very high	45 Å²	45	38 Å²	38	22%	0.222	20%	0.197	C	C	.	.			trans	-79.6	164.2	176.7	-61.1	-64.6	-168.7	0	0	111	I190 V191 K214 G218 A219	I190-M216 HydrophobicContact CG2-CE 3.82Å; I190-M216 HydrophobicContact CG2-CG 4.24Å; V191-M216 WeakPolarHBondContact O-CB 3.46Å; V191-M216 WeakPolarHBondContact O-CG 3.39Å; V191-M216 PolarHBondContact O-N 2.62Å; K214-M216 HydrophobicContact CD-CE 3.97Å; K214-M216 HydrophobicContact CD-SD 3.73Å; K214-M216 WeakPolarHBondContact CE-SD 3.47Å; K214-M216 HydrophobicContact CG-SD 4.27Å; K214-M216 PolarHBondContact NZ-SD 3.27Å; M216-G218 PolarHBondContact O-N 3.47Å; M216-A219 WeakPolarHBondContact O-CB 3.49Å; M216-A219 PolarHBondContact O-N 3.27Å
217	D	90	Very high	94.2	Very high	104 Å²	104	39.7 Å²	39.7	56%	0.556	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.4	123.7	179.3	-57	21.1	0	0	0	111	S193 A219 V242	S193-D217 WeakPolarHBondContact CB-O 3.31Å; S193-D217 PolarHBondContact OG-O 3.4Å; D217-A219 VanDerWaalsContact C-N 3.27Å; D217-A219 PolarHBondContact O-N 3.38Å; D217-V242 HydrophobicContact CB-CG1 3.64Å; D217-V242 WeakPolarHBondContact OD2-CG1 3.44Å
218	G	87.6	Confident	94.2	Very high	9 Å²	9	42 Å²	42	9%	0.093	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	30.5	-175.2	0	0	0	0	0	114.6	L194 M216 F220 F221 V242	L194-G218 PolarHBondContact N-O 3.37Å; M216-G218 PolarHBondContact O-N 3.47Å; G218-F220 PolarHBondContact O-N 3.15Å; G218-F221 VanDerWaalsContact O-CB 3.31Å; G218-F221 WeakPolarHBondContact O-CB 3.19Å; G218-F221 PolarHBondContact O-N 2.84Å; G218-V242 PolarHBondContact N-O 3.21Å
219	A	92.2	Very high	94.3	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-41.9	173.8	0	0	0	0	0	112.7	V191 F196 L215 M216 D217	V191-A219 HydrophobicContact CB-CB 4.23Å; V191-A219 HydrophobicContact CG1-CB 3.86Å; F196-A219 WeakPolarHBondContact CD2-O 3.5Å; L215-A219 HydrophobicContact CB-CB 4.38Å; M216-A219 WeakPolarHBondContact O-CB 3.49Å; M216-A219 PolarHBondContact O-N 3.27Å; D217-A219 VanDerWaalsContact C-N 3.27Å; D217-A219 PolarHBondContact O-N 3.38Å
220	F	93.2	Very high	94.3	Very high	1 Å²	1	37.1 Å²	37.1	0%	0.004	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	7.5	179.3	-56.8	-64.6	0	0	0	114.4	F196 L205 M207 L215 G218 G222 L223 L229 L231 W243 L247	F196-F220 AromaticContact CD2-CD1 3.68Å; F196-F220 HydrophobicContact CD2-CD1 3.68Å; F196-F220 HydrophobicContact CD2-CE1 4.19Å; F196-F220 AromaticContact CE2-CD1 3.64Å; F196-F220 HydrophobicContact CE2-CD1 3.64Å; F196-F220 AromaticContact CE2-CE1 3.65Å; F196-F220 HydrophobicContact CE2-CE1 3.65Å; L205-F220 HydrophobicContact CD2-CD1 3.95Å; L205-F220 HydrophobicContact CD2-CE1 3.86Å; M207-F220 HydrophobicContact SD-CE1 4.46Å; L215-F220 HydrophobicContact CD1-CE2 3.94Å; L215-F220 HydrophobicContact CD1-CZ 4.36Å; L215-F220 HydrophobicContact CD2-CE2 4.11Å; L215-F220 HydrophobicContact CD2-CZ 3.89Å; G218-F220 PolarHBondContact O-N 3.15Å; F220-G222 PolarHBondContact O-N 3.13Å; F220-L223 HydrophobicContact CB-CD1 4.13Å; F220-L223 HydrophobicContact CD1-CD1 4.13Å; F220-L223 WeakPolarHBondContact O-CB 3.18Å; F220-L223 WeakPolarHBondContact O-CG 3.5Å; F220-L223 PolarHBondContact O-N 3.32Å; F220-L229 HydrophobicContact CD2-CD2 4.19Å; F220-L229 HydrophobicContact CE1-CD1 4.07Å; F220-L229 HydrophobicContact CE1-CD2 4.5Å; F220-L229 HydrophobicContact CE2-CD2 3.97Å; F220-L229 HydrophobicContact CZ-CD1 4.21Å; F220-L229 HydrophobicContact CZ-CD2 4.15Å; F220-L231 HydrophobicContact CE2-CD1 4.21Å; F220-L231 HydrophobicContact CZ-CD1 4Å; F220-L231 HydrophobicContact CZ-CD2 4.25Å; F220-W243 HydrophobicContact CD2-CE3 4.09Å; F220-W243 WeakPolarHBondContact CD2-O 3.45Å; F220-W243 AromaticContact CE2-CE3 3.76Å; F220-W243 HydrophobicContact CE2-CE3 3.76Å; F220-W243 HydrophobicContact CE2-CZ3 4.08Å; F220-L247 HydrophobicContact CB-CD1 4.48Å; F220-L247 HydrophobicContact CB-CD2 3.81Å; F220-L247 HydrophobicContact CB-CG 4.41Å; F220-L247 HydrophobicContact CD2-CD1 4.34Å
221	F	90.5	Very high	94.4	Very high	69 Å²	69	36.8 Å²	36.8	30%	0.303	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	134.2	-177.9	178.6	-90.1	0	0	0	112.1	L194 G218 Y245	L194-F221 HydrophobicContact CD2-CB 4.1Å; L194-F221 HydrophobicContact CD2-CD1 3.43Å; L194-F221 VanDerWaalsContact CD2-CD1 3.43Å; L194-F221 HydrophobicContact CD2-CE1 4.23Å; L194-F221 HydrophobicContact CD2-CG 4.1Å; G218-F221 VanDerWaalsContact O-CB 3.31Å; G218-F221 WeakPolarHBondContact O-CB 3.19Å; G218-F221 PolarHBondContact O-N 2.84Å; F221-Y245 AromaticContact CD2-CD1 3.56Å; F221-Y245 HydrophobicContact CD2-CD1 3.56Å; F221-Y245 AromaticContact CD2-CE1 3.4Å; F221-Y245 HydrophobicContact CD2-CE1 3.4Å; F221-Y245 HydrophobicContact CE2-CD1 4.21Å; F221-Y245 AromaticContact CE2-CE1 3.56Å; F221-Y245 HydrophobicContact CE2-CE1 3.56Å; F221-Y245 HydrophobicContact CG-CD1 4.42Å; F221-Y245 HydrophobicContact CG-CE1 4.48Å
222	G	88.4	Confident	94.4	Very high	8 Å²	8	36.7 Å²	36.7	8%	0.082	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	103.1	-13.9	-173.7	0	0	0	0	0	113.7	F220 N224	F220-G222 PolarHBondContact O-N 3.13Å; G222-N224 PolarHBondContact O-N 3.35Å; G222-N224 PolarHBondContact O-ND2 2.94Å
223	L	93.7	Very high	94.5	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.01	20%	0.201	C	C	.	.			trans	-77.5	65.2	173.5	-64.6	-174.2	0	0	0	111.7	F196 L199 L202 L205 F220 N225 I226 L247	F196-L223 HydrophobicContact CB-CD1 4.03Å; F196-L223 HydrophobicContact CB-CD2 3.8Å; F196-L223 HydrophobicContact CB-CG 3.88Å; F196-L223 HydrophobicContact CD2-CD1 4.31Å; F196-L223 HydrophobicContact CG-CD1 4.25Å; L199-L223 HydrophobicContact CB-CD2 3.75Å; L202-L223 HydrophobicContact CB-CD2 4.06Å; L202-L223 HydrophobicContact CD2-CD1 4.32Å; L202-L223 HydrophobicContact CD2-CD2 3.64Å; L202-L223 HydrophobicContact CG-CD2 4.49Å; L205-L223 HydrophobicContact CD2-CD1 3.86Å; F220-L223 HydrophobicContact CB-CD1 4.13Å; F220-L223 HydrophobicContact CD1-CD1 4.13Å; F220-L223 WeakPolarHBondContact O-CB 3.18Å; F220-L223 WeakPolarHBondContact O-CG 3.5Å; F220-L223 PolarHBondContact O-N 3.32Å; L223-N225 VanDerWaalsContact C-N 3.28Å; L223-N225 PolarHBondContact O-N 3.44Å; L223-I226 HydrophobicContact CB-CB 4.06Å; L223-I226 HydrophobicContact CB-CG2 3.98Å; L223-I226 HydrophobicContact CD1-CD1 4.47Å; L223-I226 WeakPolarHBondContact O-CG2 3.33Å; L223-L247 HydrophobicContact CB-CD2 4.5Å
224	N	89.9	Confident	94.6	Very high	89 Å²	89	36.9 Å²	36.9	48%	0.476	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-22.5	-170.8	-60.1	-49.5	0	0	0	114.5	G222 M249	G222-N224 PolarHBondContact O-N 3.35Å; G222-N224 PolarHBondContact O-ND2 2.94Å; N224-M249 WeakPolarHBondContact O-CG 3.37Å
225	N	95.3	Very high	94.8	Very high	76 Å²	76	35.4 Å²	35.4	41%	0.406	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.8	13.8	-174.3	-68.8	-48.2	0	0	0	113.4	D200 L202 L223 E227	D200-N225 PolarHBondContact O-ND2 2.93Å; L202-N225 CarbonylContact O-C 3.54Å; L223-N225 VanDerWaalsContact C-N 3.28Å; L223-N225 PolarHBondContact O-N 3.44Å; N225-E227 PolarHBondContact O-N 3.27Å
226	I	97.4	Very high	94.9	Very high	1 Å²	1	35 Å²	35	1%	0.005	18%	0.18	C	C	.	.			trans	-69.1	127.6	-179.2	-167.3	79.8	0	0	0	110.6	L202 K203 L205 L223 L247 M249 L250	L202-I226 HydrophobicContact CD2-CD1 4.03Å; L202-I226 HydrophobicContact CG-CD1 4.14Å; L202-I226 WeakPolarHBondContact O-CA 3.19Å; L202-I226 PolarHBondContact O-N 3.23Å; L202-I226 VanDerWaalsContact O-N 3.12Å; K203-I226 WeakPolarHBondContact O-CD1 3.27Å; L205-I226 HydrophobicContact CB-CD1 3.85Å; L223-I226 HydrophobicContact CB-CB 4.06Å; L223-I226 HydrophobicContact CB-CG2 3.98Å; L223-I226 HydrophobicContact CD1-CD1 4.47Å; L223-I226 WeakPolarHBondContact O-CG2 3.33Å; I226-L247 HydrophobicContact CG2-CD2 3.51Å; I226-M249 CarbonylContact O-C 3.6Å; I226-M249 WeakPolarHBondContact O-CB 3.28Å; I226-M249 VanDerWaalsContact O-O 3.09Å; I226-L250 HydrophobicContact CG1-CD1 4.29Å; I226-L250 HydrophobicContact CG2-CD1 4.39Å; I226-L250 WeakPolarHBondContact O-CA 3.42Å; I226-L250 PolarHBondContact O-N 3.32Å; I226-L250 VanDerWaalsContact O-N 3.1Å
227	E	98.3	Very high	95.1	Very high	60 Å²	60	36.9 Å²	36.9	28%	0.28	19%	0.193	S	C	.	.			trans	-108	-30	179.3	-68.4	172.8	-136	0	0	110.9	K203 N225 R251 I252	K203-E227 IonicContact NZ-OE1 3.24Å; K203-E227 PolarHBondContact NZ-OE1 3.42Å; K203-E227 PolarHBondContact O-N 2.9Å; N225-E227 PolarHBondContact O-N 3.27Å; E227-R251 WeakPolarHBondContact O-CA 3.46Å; E227-R251 PolarHBondContact O-N 2.96Å; E227-I252 PolarHBondContact O-N 2.89Å
228	E	98.7	Very high	95.4	Very high	48 Å²	48	34.4 Å²	34.4	22%	0.224	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	123.6	-173.6	-177.7	-169.4	-154.7	0	0	111.4	K203 S204 L205 K206 E230 I252	K203-E228 PolarHBondContact O-N 2.88Å; S204-E228 WeakPolarHBondContact CA-O 3.28Å; S204-E228 WeakPolarHBondContact CB-OE2 3.21Å; S204-E228 PolarHBondContact OG-OE2 3.01Å; L205-E228 PolarHBondContact N-O 3.28Å; K206-E228 IonicContact NZ-OE1 2.85Å; K206-E228 PolarHBondContact NZ-OE1 3.02Å; K206-E228 IonicContact NZ-OE2 3.79Å; K206-E228 PolarHBondContact NZ-OE2 2.87Å; K206-E228 VanDerWaalsContact NZ-OE2 3.08Å; E228-E230 HydrophobicContact CG-CG 4.43Å; E228-I252 WeakPolarHBondContact CA-O 3.45Å; E228-I252 HydrophobicContact CB-CB 4.46Å; E228-I252 HydrophobicContact CG-CB 4.28Å; E228-I252 HydrophobicContact CG-CG2 4.45Å
229	L	98.5	Very high	95.7	Very high	1 Å²	1	34 Å²	34	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	115.1	175.2	179.3	57.8	0	0	0	110.3	L205 F220 L231 L247 L250 I252 L253 Q254	L205-L229 HydrophobicContact CB-CD1 4.08Å; L205-L229 HydrophobicContact CD2-CD1 3.99Å; L205-L229 HydrophobicContact CG-CD1 4.05Å; F220-L229 HydrophobicContact CD2-CD2 4.19Å; F220-L229 HydrophobicContact CE1-CD1 4.07Å; F220-L229 HydrophobicContact CE1-CD2 4.5Å; F220-L229 HydrophobicContact CE2-CD2 3.97Å; F220-L229 HydrophobicContact CZ-CD1 4.21Å; F220-L229 HydrophobicContact CZ-CD2 4.15Å; L229-L231 HydrophobicContact CD1-CD1 4.21Å; L229-L231 HydrophobicContact CD1-CG 4.09Å; L229-L231 HydrophobicContact CD2-CD1 3.9Å; L229-L231 HydrophobicContact CG-CD1 3.9Å; L229-L231 HydrophobicContact CG-CG 4.1Å; L229-L247 HydrophobicContact CD2-CD1 4.11Å; L229-L250 HydrophobicContact CB-CD1 3.67Å; L229-I252 PolarHBondContact N-O 3.07Å; L229-L253 HydrophobicContact CB-CD1 4.07Å; L229-L253 HydrophobicContact CD2-CD1 3.98Å; L229-L253 HydrophobicContact CG-CD1 4.02Å; L229-Q254 PolarHBondContact O-N 3.37Å
230	E	98.6	Very high	95.8	Very high	33 Å²	33	35.4 Å²	35.4	15%	0.154	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	110.4	-178	-74.8	-175.4	170.5	0	0	111.3	L205 K206 M207 Q208 E228 E232 Q254	L205-E230 PolarHBondContact O-N 3.48Å; K206-E230 WeakPolarHBondContact CB-OE2 3.44Å; K206-E230 WeakPolarHBondContact CD-OE2 3.49Å; K206-E230 HydrophobicContact CG-CB 4.47Å; K206-E230 HydrophobicContact CG-CG 4.47Å; K206-E230 WeakPolarHBondContact CG-OE2 3.2Å; K206-E230 IonicContact NZ-OE1 3.23Å; K206-E230 PolarHBondContact NZ-OE1 3.02Å; K206-E230 IonicContact NZ-OE2 3.52Å; K206-E230 PolarHBondContact NZ-OE2 3.5Å; K206-E230 VanDerWaalsContact NZ-OE2 3.13Å; M207-E230 CarbonylContact C-O 3.6Å; M207-E230 WeakPolarHBondContact CA-O 3.36Å; M207-E230 PolarHBondContact N-O 3.49Å; Q208-E230 HydrophobicContact CG-CB 4.35Å; Q208-E230 PolarHBondContact N-O 2.82Å; Q208-E230 PolarHBondContact NE2-O 3.45Å; Q208-E230 PolarHBondContact NE2-OE2 3.32Å; E228-E230 HydrophobicContact CG-CG 4.43Å; E230-E232 WeakPolarHBondContact CA-OE2 3.29Å; E230-E232 WeakPolarHBondContact CB-OE2 3.13Å; E230-Q254 HydrophobicContact CG-CB 4.3Å; E230-Q254 HydrophobicContact CG-CG 4.11Å
231	L	98.1	Very high	95.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.194	C	C	.	.			trans	-124.3	19.7	-174.5	-73.8	169.4	0	0	0	113.1	M207 I212 L215 F220 L229 N234 W243 Q254 I255 N258	M207-L231 HydrophobicContact CB-CD2 4Å; I212-L231 HydrophobicContact CD1-CD2 3.83Å; L215-L231 HydrophobicContact CD1-CD1 4.4Å; F220-L231 HydrophobicContact CE2-CD1 4.21Å; F220-L231 HydrophobicContact CZ-CD1 4Å; F220-L231 HydrophobicContact CZ-CD2 4.25Å; L229-L231 HydrophobicContact CD1-CD1 4.21Å; L229-L231 HydrophobicContact CD1-CG 4.09Å; L229-L231 HydrophobicContact CD2-CD1 3.9Å; L229-L231 HydrophobicContact CG-CD1 3.9Å; L229-L231 HydrophobicContact CG-CG 4.1Å; L231-N234 PolarHBondContact O-ND2 3.37Å; L231-W243 HydrophobicContact CD1-CH2 4.47Å; L231-W243 HydrophobicContact CD1-CZ3 4.16Å; L231-Q254 CarbonylContact C-O 3.54Å; L231-Q254 WeakPolarHBondContact CA-O 3.49Å; L231-Q254 PolarHBondContact N-O 2.95Å; L231-I255 HydrophobicContact CB-CG2 3.9Å; L231-I255 HydrophobicContact CD1-CG2 4.24Å; L231-N258 PolarHBondContact O-ND2 3.29Å; L231-N258 VanDerWaalsContact O-ND2 3.1Å
232	E	98.1	Very high	95.8	Very high	30 Å²	30	37.8 Å²	37.8	14%	0.14	20%	0.197	C	C	.	.			trans	-64.1	156.3	-176.3	-42.4	88.9	83.9	0	0	113.3	Q208 R209 E230 N234 Q254 S256	Q208-E232 CarbonylContact C-O 3.58Å; Q208-E232 WeakPolarHBondContact CA-O 3.45Å; Q208-E232 VanDerWaalsContact CB-O 3.29Å; Q208-E232 WeakPolarHBondContact CB-O 3.1Å; Q208-E232 HydrophobicContact CG-CB 4.2Å; Q208-E232 VanDerWaalsContact CG-CD 3.45Å; Q208-E232 HydrophobicContact CG-CG 4.48Å; Q208-E232 WeakPolarHBondContact CG-OE1 3.07Å; Q208-E232 VanDerWaalsContact CG-OE2 3.28Å; Q208-E232 WeakPolarHBondContact CG-OE2 3.37Å; R209-E232 PolarHBondContact N-O 3.46Å; E230-E232 WeakPolarHBondContact CA-OE2 3.29Å; E230-E232 WeakPolarHBondContact CB-OE2 3.13Å; E232-N234 VanDerWaalsContact C-N 3.3Å; E232-N234 PolarHBondContact O-N 3.13Å; E232-N234 PolarHBondContact O-ND2 3.2Å; E232-Q254 VanDerWaalsContact CD-CB 3.47Å; E232-Q254 HydrophobicContact CG-CB 3.69Å; E232-Q254 WeakPolarHBondContact OE2-CB 3.35Å; E232-S256 CarbonylContact C-O 3.53Å; E232-S256 WeakPolarHBondContact CA-O 3.13Å; E232-S256 WeakPolarHBondContact CB-O 3.45Å
233	H	98.3	Very high	96	Very high	61 Å²	61	37.8 Å²	37.8	28%	0.282	19%	0.194	S	C	.	.	S	Bend	trans	54.5	44.2	179.1	-57.5	-77.7	0	0	0	112.9	R209 S256 H257	R209-H233 VanDerWaalsContact CA-O 3.27Å; R209-H233 WeakPolarHBondContact CA-O 3.46Å; R209-H233 HydrophobicContact CB-CB 4.34Å; R209-H233 HydrophobicContact CG-CB 3.4Å; R209-H233 VanDerWaalsContact CG-CB 3.4Å; R209-H233 PolarHBondContact N-O 2.8Å; R209-H233 PolarHBondContact NE-CD2 3Å; R209-H233 PolarHBondContact NE-NE2 2.69Å; R209-H233 PolarHBondContact NH2-NE2 3.13Å; H233-S256 PolarHBondContact N-O 3.16Å; H233-H257 WeakPolarHBondContact CA-O 3.16Å; H233-H257 HydrophobicContact CB-CB 4.33Å; H233-H257 AromaticContact CE1-CD2 3.35Å; H233-H257 PolarHBondContact CE1-CD2 3.44Å; H233-H257 AromaticContact CE1-CE1 3.93Å; H233-H257 AromaticContact CE1-CG 3.46Å; H233-H257 VanDerWaalsContact CE1-CG 3.46Å; H233-H257 AromaticContact CE1-ND1 3.83Å; H233-H257 AromaticContact CE1-NE2 3.61Å; H233-H257 PolarHBondContact N-O 2.95Å; H233-H257 VanDerWaalsContact ND1-CB 3.3Å; H233-H257 WeakPolarHBondContact ND1-CB 3.3Å; H233-H257 AromaticContact ND1-CD2 3.54Å; H233-H257 AromaticContact ND1-CG 3.44Å
234	N	98.4	Very high	96.1	Very high	12 Å²	12	37.7 Å²	37.7	6%	0.064	19%	0.194	C	C	.	.	S	Bend	trans	-110.9	-158.4	170.4	-76.6	-61.5	0	0	0	109.2	M207 N210 G211 I212 L231 E232 H257 N258	M207-N234 PolarHBondContact O-ND2 2.69Å; N210-N234 WeakPolarHBondContact CA-OD1 3.17Å; N210-N234 WeakPolarHBondContact CB-OD1 3.5Å; N210-N234 PolarHBondContact N-OD1 3.1Å; G211-N234 PolarHBondContact N-OD1 2.92Å; I212-N234 HydrophobicContact CB-CB 4.08Å; I212-N234 WeakPolarHBondContact CG1-OD1 3.46Å; I212-N234 PolarHBondContact N-OD1 2.78Å; L231-N234 PolarHBondContact O-ND2 3.37Å; E232-N234 VanDerWaalsContact C-N 3.3Å; E232-N234 PolarHBondContact O-N 3.13Å; E232-N234 PolarHBondContact O-ND2 3.2Å; N234-H257 PolarHBondContact N-O 2.92Å; N234-N258 VanDerWaalsContact CA-OD1 3.3Å; N234-N258 WeakPolarHBondContact CA-OD1 3.32Å; N234-N258 WeakPolarHBondContact CB-OD1 3.28Å; N234-N258 PolarHBondContact O-OD1 2.82Å
235	N	97.7	Very high	96.1	Very high	81 Å²	81	38.6 Å²	38.6	43%	0.433	19%	0.191	S	C	.	.			trans	-135.7	40.6	-176.4	-160.5	106.5	0	0	0	110.1	I212 T213 N258	I212-N235 CarbonylContact O-C 3.14Å; I212-N235 VanDerWaalsContact O-C 3.23Å; I212-N235 WeakPolarHBondContact O-CA 3.48Å; I212-N235 PolarHBondContact O-N 2.64Å; T213-N235 HydrophobicContact CG2-CB 4.03Å; N235-N258 PolarHBondContact N-OD1 3.16Å; N235-N258 VanDerWaalsContact N-OD1 3.17Å
236	L	97.5	Very high	95.7	Very high	6 Å²	6	35.6 Å²	35.6	3%	0.031	18%	0.178	C	C	.	.			trans	-72.6	140	173.1	-57.3	176.6	0	0	0	109.6	I212 L215 N258 A259 I260	I212-L236 HydrophobicContact CG2-CD2 3.93Å; I212-L236 PolarHBondContact O-N 2.5Å; L215-L236 HydrophobicContact CD1-CD1 3.97Å; L215-L236 HydrophobicContact CD1-CD2 3.89Å; L215-L236 HydrophobicContact CG-CD2 3.88Å; L236-N258 HydrophobicContact CB-CB 4.35Å; L236-N258 WeakPolarHBondContact CB-OD1 3.5Å; L236-N258 WeakPolarHBondContact CG-OD1 3.5Å; L236-N258 PolarHBondContact N-OD1 2.75Å; L236-A259 CarbonylContact O-C 3.44Å; L236-A259 VanDerWaalsContact O-CA 3.3Å; L236-A259 WeakPolarHBondContact O-CA 3.47Å; L236-A259 PolarHBondContact O-N 2.76Å; L236-I260 HydrophobicContact CB-CG1 4.3Å; L236-I260 WeakPolarHBondContact O-CG1 3.41Å; L236-I260 PolarHBondContact O-N 3.26Å; L236-I260 VanDerWaalsContact O-N 3.16Å
237	T	96.7	Very high	95.5	Very high	83 Å²	83	35.5 Å²	35.5	51%	0.509	18%	0.178	S	C	.	.			trans	-110.5	-16.6	-174.5	55.6	0	0	0	0	114.6	A259 I260 G261	T237-A259 WeakPolarHBondContact CA-O 3.43Å; T237-A259 HydrophobicContact CG2-CB 4.34Å; T237-I260 WeakPolarHBondContact O-CA 3.16Å; T237-G261 PolarHBondContact O-N 2.86Å
238	E	95.8	Very high	95.2	Very high	53 Å²	53	40.7 Å²	40.7	25%	0.248	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	154.9	176.9	56.6	162.3	-146.3	0	0	111.8	N240 V262 R264	E238-N240 PolarHBondContact OE1-ND2 3.46Å; E238-V262 VanDerWaalsContact CA-O 3.31Å; E238-V262 WeakPolarHBondContact CA-O 3.3Å; E238-R264 IonicContact OE1-NH2 3.66Å; E238-R264 IonicContact OE2-CZ 2.86Å; E238-R264 VanDerWaalsContact OE2-CZ 3.27Å; E238-R264 IonicContact OE2-NE 2.8Å; E238-R264 PolarHBondContact OE2-NE 3.17Å; E238-R264 IonicContact OE2-NH2 2.67Å; E238-R264 PolarHBondContact OE2-NH2 3Å
239	V	95.6	Very high	95.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	124.9	166	-169.9	0	0	0	0	108.8	W243 L244 I255 I260 V262 I263 R264 A267 W268 L279	V239-W243 HydrophobicContact CB-CZ2 4.43Å; V239-W243 HydrophobicContact CG1-CZ2 3.91Å; V239-L244 HydrophobicContact CG1-CD1 3.71Å; V239-I255 HydrophobicContact CG2-CD1 3.88Å; V239-I260 HydrophobicContact CG2-CD1 3.94Å; V239-I260 HydrophobicContact CG2-CG2 3.98Å; V239-V262 PolarHBondContact N-O 2.87Å; V239-I263 HydrophobicContact CB-CG2 4.48Å; V239-R264 WeakPolarHBondContact O-CG 3.38Å; V239-R264 PolarHBondContact O-N 3.47Å; V239-A267 HydrophobicContact CG1-CB 4.04Å; V239-W268 HydrophobicContact CB-CH2 4.49Å; V239-W268 HydrophobicContact CG1-CH2 3.7Å; V239-W268 HydrophobicContact CG1-CZ2 4.2Å; V239-W268 HydrophobicContact CG1-CZ3 3.93Å; V239-L279 HydrophobicContact CG2-CD2 4.38Å
240	N	93.3	Very high	95.1	Very high	29 Å²	29	41.9 Å²	41.9	16%	0.155	20%	0.201	C	C	.	.			trans	-139.8	159.2	178.2	74	47.8	0	0	0	110.4	E238 V242 W243 R264	E238-N240 PolarHBondContact OE1-ND2 3.46Å; N240-V242 PolarHBondContact O-N 3.37Å; N240-V242 VanDerWaalsContact OD1-CB 3.31Å; N240-V242 WeakPolarHBondContact OD1-CB 3.47Å; N240-V242 WeakPolarHBondContact OD1-CG2 3.31Å; N240-V242 PolarHBondContact OD1-N 3.42Å; N240-W243 PolarHBondContact OD1-N 3.37Å; N240-R264 HydrophobicContact CB-CB 4.45Å; N240-R264 HydrophobicContact CB-CG 3.81Å
241	K	92.8	Very high	95.1	Very high	62 Å²	62	45 Å²	45	27%	0.27	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-16.2	-176.1	72.5	175	174.6	-161.4	0	115	L244 Y245 D266 E269 F270	K241-L244 PolarHBondContact O-N 2.95Å; K241-Y245 PolarHBondContact O-N 3.2Å; K241-Y245 VanDerWaalsContact O-N 3.07Å; K241-D266 WeakPolarHBondContact CB-O 3.37Å; K241-D266 HydrophobicContact CD-CB 4.13Å; K241-D266 VanDerWaalsContact CD-OD2 3.26Å; K241-D266 WeakPolarHBondContact CD-OD2 3.25Å; K241-D266 WeakPolarHBondContact CE-OD2 2.93Å; K241-D266 IonicContact NZ-OD2 2.84Å; K241-D266 PolarHBondContact NZ-OD2 2.71Å; K241-E269 VanDerWaalsContact CD-OE2 3.28Å; K241-E269 WeakPolarHBondContact CD-OE2 3.45Å; K241-E269 IonicContact NZ-OE2 3.39Å; K241-E269 PolarHBondContact NZ-OE2 3.42Å; K241-F270 HydrophobicContact CB-CD2 4.39Å; K241-F270 HydrophobicContact CB-CE2 4.19Å; K241-F270 HydrophobicContact CD-CE2 4.22Å; K241-F270 HydrophobicContact CG-CE2 4.5Å
242	V	91.3	Very high	95.1	Very high	59 Å²	59	47.2 Å²	47.2	36%	0.358	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-37.6	-165.5	-159.7	0	0	0	0	110.9	D217 G218 N240	D217-V242 HydrophobicContact CB-CG1 3.64Å; D217-V242 WeakPolarHBondContact OD2-CG1 3.44Å; G218-V242 PolarHBondContact N-O 3.21Å; N240-V242 PolarHBondContact O-N 3.37Å; N240-V242 VanDerWaalsContact OD1-CB 3.31Å; N240-V242 WeakPolarHBondContact OD1-CB 3.47Å; N240-V242 WeakPolarHBondContact OD1-CG2 3.31Å; N240-V242 PolarHBondContact OD1-N 3.42Å
243	W	93.1	Very high	95.1	Very high	8 Å²	8	45.8 Å²	45.8	3%	0.03	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-25.5	171.5	64.9	-102.1	0	0	0	113.2	L215 F220 L231 V239 N240 Y245	L215-W243 HydrophobicContact CB-CB 3.64Å; L215-W243 HydrophobicContact CB-CD2 4.41Å; L215-W243 HydrophobicContact CB-CG 3.91Å; L215-W243 HydrophobicContact CD1-CB 4.36Å; L215-W243 HydrophobicContact CD1-CD2 3.52Å; L215-W243 HydrophobicContact CD1-CE3 3.53Å; L215-W243 HydrophobicContact CD1-CG 3.93Å; L215-W243 HydrophobicContact CD1-CH2 4.31Å; L215-W243 HydrophobicContact CD1-CZ2 4.32Å; L215-W243 HydrophobicContact CD1-CZ3 3.93Å; F220-W243 HydrophobicContact CD2-CE3 4.09Å; F220-W243 WeakPolarHBondContact CD2-O 3.45Å; F220-W243 AromaticContact CE2-CE3 3.76Å; F220-W243 HydrophobicContact CE2-CE3 3.76Å; F220-W243 HydrophobicContact CE2-CZ3 4.08Å; L231-W243 HydrophobicContact CD1-CH2 4.47Å; L231-W243 HydrophobicContact CD1-CZ3 4.16Å; V239-W243 HydrophobicContact CB-CZ2 4.43Å; V239-W243 HydrophobicContact CG1-CZ2 3.91Å; N240-W243 PolarHBondContact OD1-N 3.37Å; W243-Y245 PolarHBondContact O-N 2.83Å
244	L	93.9	Very high	95.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	-75.1	-3.9	172.6	-70.9	171.9	0	0	0	113.8	V239 K241 G246 L247 L253 A267 W268	V239-L244 HydrophobicContact CG1-CD1 3.71Å; K241-L244 PolarHBondContact O-N 2.95Å; L244-G246 PolarHBondContact O-N 3.39Å; L244-G246 VanDerWaalsContact O-N 3.16Å; L244-L247 HydrophobicContact CB-CD1 4.37Å; L244-L247 HydrophobicContact CD2-CD1 3.65Å; L244-L247 WeakPolarHBondContact O-CB 3.12Å; L244-L247 WeakPolarHBondContact O-CG 3.15Å; L244-L247 PolarHBondContact O-N 3.35Å; L244-L253 HydrophobicContact CD2-CD2 4.24Å; L244-A267 WeakPolarHBondContact CD1-O 3.3Å; L244-W268 HydrophobicContact CD1-CE3 4.01Å; L244-W268 HydrophobicContact CD1-CZ3 4.03Å
245	Y	91.6	Very high	95.1	Very high	107 Å²	107	43.5 Å²	43.5	42%	0.42	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	117.1	-174.3	-178.4	-108	0	0	0	113.5	F221 K241 W243 F270	F221-Y245 AromaticContact CD2-CD1 3.56Å; F221-Y245 HydrophobicContact CD2-CD1 3.56Å; F221-Y245 AromaticContact CD2-CE1 3.4Å; F221-Y245 HydrophobicContact CD2-CE1 3.4Å; F221-Y245 HydrophobicContact CE2-CD1 4.21Å; F221-Y245 AromaticContact CE2-CE1 3.56Å; F221-Y245 HydrophobicContact CE2-CE1 3.56Å; F221-Y245 HydrophobicContact CG-CD1 4.42Å; F221-Y245 HydrophobicContact CG-CE1 4.48Å; K241-Y245 PolarHBondContact O-N 3.2Å; K241-Y245 VanDerWaalsContact O-N 3.07Å; W243-Y245 PolarHBondContact O-N 2.83Å; Y245-F270 HydrophobicContact CD2-CD1 4.34Å; Y245-F270 HydrophobicContact CD2-CD2 4.02Å; Y245-F270 AromaticContact CD2-CE1 3.98Å; Y245-F270 HydrophobicContact CD2-CE1 3.98Å; Y245-F270 AromaticContact CD2-CE2 3.63Å; Y245-F270 HydrophobicContact CD2-CE2 3.63Å; Y245-F270 HydrophobicContact CD2-CG 4.36Å; Y245-F270 AromaticContact CD2-CZ 3.63Å; Y245-F270 HydrophobicContact CD2-CZ 3.63Å; Y245-F270 AromaticContact CE2-CE1 3.99Å; Y245-F270 HydrophobicContact CE2-CE1 3.99Å; Y245-F270 HydrophobicContact CE2-CE2 4.36Å; Y245-F270 AromaticContact CE2-CZ 3.89Å; Y245-F270 HydrophobicContact CE2-CZ 3.89Å
246	G	85.9	Confident	95.1	Very high	13 Å²	13	40 Å²	40	13%	0.134	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.4	-3.7	174.5	0	0	0	0	0	116.1	L244 R248	L244-G246 PolarHBondContact O-N 3.39Å; L244-G246 VanDerWaalsContact O-N 3.16Å; G246-R248 PolarHBondContact O-N 3.1Å
247	L	93.8	Very high	95.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.201	C	C	.	.			trans	-75.7	45.9	-175.5	-62.2	176.4	0	0	0	114.7	F220 L223 I226 L229 L244 M249 L250 F270	F220-L247 HydrophobicContact CB-CD1 4.48Å; F220-L247 HydrophobicContact CB-CD2 3.81Å; F220-L247 HydrophobicContact CB-CG 4.41Å; F220-L247 HydrophobicContact CD2-CD1 4.34Å; L223-L247 HydrophobicContact CB-CD2 4.5Å; I226-L247 HydrophobicContact CG2-CD2 3.51Å; L229-L247 HydrophobicContact CD2-CD1 4.11Å; L244-L247 HydrophobicContact CB-CD1 4.37Å; L244-L247 HydrophobicContact CD2-CD1 3.65Å; L244-L247 WeakPolarHBondContact O-CB 3.12Å; L244-L247 WeakPolarHBondContact O-CG 3.15Å; L244-L247 PolarHBondContact O-N 3.35Å; L247-M249 VanDerWaalsContact C-N 3.25Å; L247-M249 PolarHBondContact O-N 2.88Å; L247-M249 VanDerWaalsContact O-N 3.12Å; L247-L250 HydrophobicContact CB-CB 4.2Å; L247-L250 HydrophobicContact CB-CD2 4.37Å; L247-L250 HydrophobicContact CD1-CD2 4.23Å; L247-L250 VanDerWaalsContact O-CB 3.28Å; L247-L250 WeakPolarHBondContact O-CB 3.2Å; L247-L250 PolarHBondContact O-N 3.21Å; L247-L250 VanDerWaalsContact O-N 3.13Å; L247-F270 CarbonylContact C-O 3.24Å
248	R	92.6	Very high	95.3	Very high	168 Å²	168	39.6 Å²	39.6	63%	0.634	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-14.7	-168.1	-64.1	-178.5	179	-172.4	-1.6	116.4	G246 F270	G246-R248 PolarHBondContact O-N 3.1Å; R248-F270 VanDerWaalsContact CA-O 3.32Å; R248-F270 WeakPolarHBondContact CA-O 3.18Å; R248-F270 PolarHBondContact N-O 3Å
249	M	95.8	Very high	95.4	Very high	74 Å²	74	38.1 Å²	38.1	37%	0.365	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.7	2.4	179.2	-62.8	-60	-171.2	0	0	112.8	N224 I226 L247 R251 K273	N224-M249 WeakPolarHBondContact O-CG 3.37Å; I226-M249 CarbonylContact O-C 3.6Å; I226-M249 WeakPolarHBondContact O-CB 3.28Å; I226-M249 VanDerWaalsContact O-O 3.09Å; L247-M249 VanDerWaalsContact C-N 3.25Å; L247-M249 PolarHBondContact O-N 2.88Å; L247-M249 VanDerWaalsContact O-N 3.12Å; M249-R251 WeakPolarHBondContact O-CG 3.42Å; M249-R251 PolarHBondContact O-N 3.41Å; M249-K273 HydrophobicContact SD-CD 4.12Å; M249-K273 PolarHBondContact SD-NZ 2.95Å
250	L	97.8	Very high	95.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.176	C	C	.	.			trans	-66.3	127.4	-174.9	-168.8	71.3	0	0	0	110.5	I226 L229 L247 I252 L253 K273 L274	I226-L250 HydrophobicContact CG1-CD1 4.29Å; I226-L250 HydrophobicContact CG2-CD1 4.39Å; I226-L250 WeakPolarHBondContact O-CA 3.42Å; I226-L250 PolarHBondContact O-N 3.32Å; I226-L250 VanDerWaalsContact O-N 3.1Å; L229-L250 HydrophobicContact CB-CD1 3.67Å; L247-L250 HydrophobicContact CB-CB 4.2Å; L247-L250 HydrophobicContact CB-CD2 4.37Å; L247-L250 HydrophobicContact CD1-CD2 4.23Å; L247-L250 VanDerWaalsContact O-CB 3.28Å; L247-L250 WeakPolarHBondContact O-CB 3.2Å; L247-L250 PolarHBondContact O-N 3.21Å; L247-L250 VanDerWaalsContact O-N 3.13Å; L250-I252 WeakPolarHBondContact CD1-O 3.37Å; L250-L253 HydrophobicContact CD2-CB 4.07Å; L250-L253 HydrophobicContact CD2-CD1 4.33Å; L250-L253 HydrophobicContact CD2-CD2 4.4Å; L250-K273 CarbonylContact O-C 3.6Å; L250-L274 HydrophobicContact CD2-CD1 4.1Å; L250-L274 HydrophobicContact CG-CD1 4.02Å; L250-L274 WeakPolarHBondContact O-CA 3.4Å; L250-L274 PolarHBondContact O-N 2.95Å
251	R	98.3	Very high	95.7	Very high	99 Å²	99	37.9 Å²	37.9	37%	0.374	18%	0.181	S	C	.	.			trans	-112.4	-36	-179.4	-58.4	175.9	72.9	-152.7	-3.6	111.3	E227 M249 E275 E276	E227-R251 WeakPolarHBondContact O-CA 3.46Å; E227-R251 PolarHBondContact O-N 2.96Å; M249-R251 WeakPolarHBondContact O-CG 3.42Å; M249-R251 PolarHBondContact O-N 3.41Å; R251-E275 IonicContact CZ-OE1 2.78Å; R251-E275 IonicContact CZ-OE2 2.79Å; R251-E275 IonicContact NE-OE1 2.72Å; R251-E275 PolarHBondContact NE-OE1 3.17Å; R251-E275 IonicContact NE-OE2 3.82Å; R251-E275 PolarHBondContact NE-OE2 3.22Å; R251-E275 VanDerWaalsContact NE-OE2 3.16Å; R251-E275 IonicContact NH2-OE1 2.77Å; R251-E275 PolarHBondContact NH2-OE1 2.93Å; R251-E275 IonicContact NH2-OE2 2.68Å; R251-E275 PolarHBondContact NH2-OE2 3.41Å; R251-E275 WeakPolarHBondContact O-CA 3.45Å; R251-E275 PolarHBondContact O-N 2.86Å; R251-E276 PolarHBondContact O-N 2.98Å
252	I	98.7	Very high	95.8	Very high	47 Å²	47	38.7 Å²	38.7	24%	0.241	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	123.4	-178.4	-54.7	176.9	0	0	0	109.4	E227 E228 L229 L250 Q254 E276	E227-I252 PolarHBondContact O-N 2.89Å; E228-I252 WeakPolarHBondContact CA-O 3.45Å; E228-I252 HydrophobicContact CB-CB 4.46Å; E228-I252 HydrophobicContact CG-CB 4.28Å; E228-I252 HydrophobicContact CG-CG2 4.45Å; L229-I252 PolarHBondContact N-O 3.07Å; L250-I252 WeakPolarHBondContact CD1-O 3.37Å; I252-Q254 HydrophobicContact CG2-CG 4.05Å; I252-Q254 VanDerWaalsContact CG2-NE2 3.35Å; I252-E276 HydrophobicContact CG1-CB 4.3Å; I252-E276 HydrophobicContact CG2-CB 4.33Å; I252-E276 HydrophobicContact CG2-CG 4.5Å
253	L	98.5	Very high	96	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	109.5	173.6	-179.8	58.2	0	0	0	110.4	L229 L244 L250 I255 W268 L274 E276 L277 D278	L229-L253 HydrophobicContact CB-CD1 4.07Å; L229-L253 HydrophobicContact CD2-CD1 3.98Å; L229-L253 HydrophobicContact CG-CD1 4.02Å; L244-L253 HydrophobicContact CD2-CD2 4.24Å; L250-L253 HydrophobicContact CD2-CB 4.07Å; L250-L253 HydrophobicContact CD2-CD1 4.33Å; L250-L253 HydrophobicContact CD2-CD2 4.4Å; L253-I255 HydrophobicContact CD1-CG2 3.82Å; L253-I255 HydrophobicContact CD2-CD1 4.17Å; L253-I255 HydrophobicContact CG-CD1 4.35Å; L253-I255 HydrophobicContact CG-CG1 4.35Å; L253-I255 HydrophobicContact CG-CG2 4.1Å; L253-W268 HydrophobicContact CD2-CZ3 3.89Å; L253-L274 HydrophobicContact CB-CD1 3.69Å; L253-L274 HydrophobicContact CB-CD2 4.33Å; L253-E276 PolarHBondContact N-O 3.34Å; L253-L277 HydrophobicContact CB-CD1 4.18Å; L253-L277 HydrophobicContact CD2-CD1 4.05Å; L253-L277 HydrophobicContact CG-CD1 4.15Å; L253-D278 PolarHBondContact O-N 2.95Å
254	Q	98.5	Very high	96.1	Very high	25 Å²	25	42 Å²	42	12%	0.117	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	109.7	177	-53.8	-71.5	-36.2	0	0	108.8	L229 E230 L231 E232 I252 E276 D278	L229-Q254 PolarHBondContact O-N 3.37Å; E230-Q254 HydrophobicContact CG-CB 4.3Å; E230-Q254 HydrophobicContact CG-CG 4.11Å; L231-Q254 CarbonylContact C-O 3.54Å; L231-Q254 WeakPolarHBondContact CA-O 3.49Å; L231-Q254 PolarHBondContact N-O 2.95Å; E232-Q254 VanDerWaalsContact CD-CB 3.47Å; E232-Q254 HydrophobicContact CG-CB 3.69Å; E232-Q254 WeakPolarHBondContact OE2-CB 3.35Å; I252-Q254 HydrophobicContact CG2-CG 4.05Å; I252-Q254 VanDerWaalsContact CG2-NE2 3.35Å; Q254-E276 PolarHBondContact NE2-OE1 3.06Å; Q254-D278 PolarHBondContact OE1-OD2 2.94Å
255	I	97.8	Very high	95.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.223	C	C	.	.			trans	-128.3	20	-179.2	48	177.4	0	0	0	112.3	L231 V239 L253 N258 I260 L277 D278 L279 N282	L231-I255 HydrophobicContact CB-CG2 3.9Å; L231-I255 HydrophobicContact CD1-CG2 4.24Å; V239-I255 HydrophobicContact CG2-CD1 3.88Å; L253-I255 HydrophobicContact CD1-CG2 3.82Å; L253-I255 HydrophobicContact CD2-CD1 4.17Å; L253-I255 HydrophobicContact CG-CD1 4.35Å; L253-I255 HydrophobicContact CG-CG1 4.35Å; L253-I255 HydrophobicContact CG-CG2 4.1Å; I255-N258 PolarHBondContact O-ND2 2.8Å; I255-I260 HydrophobicContact CB-CD1 4.21Å; I255-I260 HydrophobicContact CD1-CD1 4.11Å; I255-I260 HydrophobicContact CG1-CD1 4.41Å; I255-L277 HydrophobicContact CD1-CD1 4.03Å; I255-L277 HydrophobicContact CG1-CD1 4.18Å; I255-D278 CarbonylContact C-O 3.17Å; I255-D278 WeakPolarHBondContact CA-O 3.24Å; I255-D278 VanDerWaalsContact CG1-O 3.23Å; I255-D278 WeakPolarHBondContact CG1-O 3.22Å; I255-D278 PolarHBondContact N-O 2.99Å; I255-L279 HydrophobicContact CD1-CD2 3.46Å; I255-L279 VanDerWaalsContact CD1-CD2 3.46Å; I255-L279 HydrophobicContact CD1-CG 3.91Å; I255-L279 HydrophobicContact CG1-CD2 3.81Å; I255-L279 HydrophobicContact CG1-CG 4.04Å; I255-N282 PolarHBondContact O-ND2 2.62Å; I255-N282 VanDerWaalsContact O-ND2 3.14Å
256	S	98.5	Very high	95.8	Very high	6 Å²	6	43.9 Å²	43.9	4%	0.042	22%	0.22	C	C	.	.			trans	-68.3	163.9	177.5	56.6	0	0	0	0	114.2	E232 H233 N258 D278 S280	E232-S256 CarbonylContact C-O 3.53Å; E232-S256 WeakPolarHBondContact CA-O 3.13Å; E232-S256 WeakPolarHBondContact CB-O 3.45Å; H233-S256 PolarHBondContact N-O 3.16Å; S256-N258 VanDerWaalsContact C-N 3.28Å; S256-N258 PolarHBondContact O-N 3.15Å; S256-N258 PolarHBondContact O-ND2 3.34Å; S256-D278 VanDerWaalsContact CB-CG 3.48Å; S256-D278 WeakPolarHBondContact CB-OD2 3.46Å; S256-D278 PolarHBondContact N-O 2.97Å; S256-D278 VanDerWaalsContact N-O 3.15Å; S256-D278 PolarHBondContact OG-OD2 2.95Å; S256-S280 CarbonylContact C-O 3.54Å; S256-S280 WeakPolarHBondContact CA-O 3.41Å; S256-S280 WeakPolarHBondContact CB-O 3.28Å; S256-S280 VanDerWaalsContact CB-OG 3.23Å; S256-S280 WeakPolarHBondContact CB-OG 3.49Å
257	H	98.5	Very high	96.1	Very high	72 Å²	72	43.2 Å²	43.2	33%	0.333	21%	0.213	S	C	.	.	S	Bend	trans	55.2	42.3	-176.7	-59.7	80.4	0	0	0	112.6	H233 N234 S280 H281	H233-H257 WeakPolarHBondContact CA-O 3.16Å; H233-H257 HydrophobicContact CB-CB 4.33Å; H233-H257 AromaticContact CE1-CD2 3.35Å; H233-H257 PolarHBondContact CE1-CD2 3.44Å; H233-H257 AromaticContact CE1-CE1 3.93Å; H233-H257 AromaticContact CE1-CG 3.46Å; H233-H257 VanDerWaalsContact CE1-CG 3.46Å; H233-H257 AromaticContact CE1-ND1 3.83Å; H233-H257 AromaticContact CE1-NE2 3.61Å; H233-H257 PolarHBondContact N-O 2.95Å; H233-H257 VanDerWaalsContact ND1-CB 3.3Å; H233-H257 WeakPolarHBondContact ND1-CB 3.3Å; H233-H257 AromaticContact ND1-CD2 3.54Å; H233-H257 AromaticContact ND1-CG 3.44Å; N234-H257 PolarHBondContact N-O 2.92Å; H257-S280 PolarHBondContact N-O 2.75Å; H257-H281 WeakPolarHBondContact CA-O 3.48Å; H257-H281 HydrophobicContact CB-CB 4.32Å; H257-H281 AromaticContact CD2-CG 3.89Å; H257-H281 AromaticContact CE1-CD2 3.19Å; H257-H281 PolarHBondContact CE1-CD2 3.08Å; H257-H281 AromaticContact CE1-CG 3.7Å; H257-H281 AromaticContact CE1-NE2 3.79Å; H257-H281 PolarHBondContact N-O 3.05Å; H257-H281 AromaticContact ND1-CD2 3.75Å; H257-H281 AromaticContact NE2-CD2 3.52Å; H257-H281 AromaticContact NE2-CG 3.68Å; H257-H281 AromaticContact NE2-NE2 3.87Å
258	N	98.6	Very high	96.2	Very high	10 Å²	10	43.3 Å²	43.3	5%	0.053	21%	0.214	C	C	.	.	S	Bend	trans	-109.5	-162.6	171.3	-85.1	-86.4	0	0	0	109.2	L231 N234 N235 L236 I255 S256 I260 H281 N282	L231-N258 PolarHBondContact O-ND2 3.29Å; L231-N258 VanDerWaalsContact O-ND2 3.1Å; N234-N258 VanDerWaalsContact CA-OD1 3.3Å; N234-N258 WeakPolarHBondContact CA-OD1 3.32Å; N234-N258 WeakPolarHBondContact CB-OD1 3.28Å; N234-N258 PolarHBondContact O-OD1 2.82Å; N235-N258 PolarHBondContact N-OD1 3.16Å; N235-N258 VanDerWaalsContact N-OD1 3.17Å; L236-N258 HydrophobicContact CB-CB 4.35Å; L236-N258 WeakPolarHBondContact CB-OD1 3.5Å; L236-N258 WeakPolarHBondContact CG-OD1 3.5Å; L236-N258 PolarHBondContact N-OD1 2.75Å; I255-N258 PolarHBondContact O-ND2 2.8Å; S256-N258 VanDerWaalsContact C-N 3.28Å; S256-N258 PolarHBondContact O-N 3.15Å; S256-N258 PolarHBondContact O-ND2 3.34Å; N258-I260 HydrophobicContact CB-CD1 4.07Å; N258-I260 HydrophobicContact CB-CG1 3.95Å; N258-H281 PolarHBondContact N-O 2.93Å; N258-N282 VanDerWaalsContact CA-OD1 3.25Å; N258-N282 WeakPolarHBondContact CA-OD1 3.43Å; N258-N282 WeakPolarHBondContact CB-OD1 3.43Å; N258-N282 PolarHBondContact N-OD1 2.77Å; N258-N282 PolarHBondContact O-OD1 2.96Å
259	A	97.9	Very high	96.2	Very high	21 Å²	21	39.6 Å²	39.6	17%	0.174	20%	0.204	C	C	.	.			trans	-116.4	29.1	176.4	0	0	0	0	0	111.1	L236 T237 G261 N282	L236-A259 CarbonylContact O-C 3.44Å; L236-A259 VanDerWaalsContact O-CA 3.3Å; L236-A259 WeakPolarHBondContact O-CA 3.47Å; L236-A259 PolarHBondContact O-N 2.76Å; T237-A259 WeakPolarHBondContact CA-O 3.43Å; T237-A259 HydrophobicContact CG2-CB 4.34Å; A259-G261 PolarHBondContact O-N 2.99Å; A259-N282 PolarHBondContact N-OD1 3.32Å
260	I	98.1	Very high	96	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.194	C	C	.	.			trans	-69.5	114.6	-170.8	-61.4	167.5	0	0	0	109.2	L236 T237 V239 I255 N258 L279 N282 H283 L284	L236-I260 HydrophobicContact CB-CG1 4.3Å; L236-I260 WeakPolarHBondContact O-CG1 3.41Å; L236-I260 PolarHBondContact O-N 3.26Å; L236-I260 VanDerWaalsContact O-N 3.16Å; T237-I260 WeakPolarHBondContact O-CA 3.16Å; V239-I260 HydrophobicContact CG2-CD1 3.94Å; V239-I260 HydrophobicContact CG2-CG2 3.98Å; I255-I260 HydrophobicContact CB-CD1 4.21Å; I255-I260 HydrophobicContact CD1-CD1 4.11Å; I255-I260 HydrophobicContact CG1-CD1 4.41Å; N258-I260 HydrophobicContact CB-CD1 4.07Å; N258-I260 HydrophobicContact CB-CG1 3.95Å; I260-L279 HydrophobicContact CD1-CD2 3.98Å; I260-L279 HydrophobicContact CG2-CD2 4.47Å; I260-N282 HydrophobicContact CB-CB 4.2Å; I260-N282 VanDerWaalsContact CB-OD1 3.28Å; I260-N282 WeakPolarHBondContact CB-OD1 3.5Å; I260-N282 WeakPolarHBondContact CG1-OD1 3.26Å; I260-N282 PolarHBondContact N-OD1 3.13Å; I260-H283 CarbonylContact O-C 3.22Å; I260-H283 WeakPolarHBondContact O-CA 3.46Å; I260-H283 PolarHBondContact O-N 3.18Å; I260-L284 HydrophobicContact CG2-CD2 4.06Å; I260-L284 PolarHBondContact O-N 2.73Å; I260-L284 VanDerWaalsContact O-N 3.17Å
261	G	96.9	Very high	95.7	Very high	25 Å²	25	37.8 Å²	37.8	26%	0.258	19%	0.194	S	C	.	.			trans	-101.9	-18.9	175.3	0	0	0	0	0	114.3	T237 A259 H283	T237-G261 PolarHBondContact O-N 2.86Å; A259-G261 PolarHBondContact O-N 2.99Å; G261-H283 WeakPolarHBondContact CA-O 3.42Å
262	V	95.5	Very high	95.5	Very high	79 Å²	79	38.4 Å²	38.4	48%	0.479	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	137.3	-173.3	-178.1	0	0	0	0	111.4	E238 V239	E238-V262 VanDerWaalsContact CA-O 3.31Å; E238-V262 WeakPolarHBondContact CA-O 3.3Å; V239-V262 PolarHBondContact N-O 2.87Å
263	I	96.5	Very high	95.3	Very high	20 Å²	20	41.2 Å²	41.2	10%	0.103	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	126.9	165.4	-55.2	171	0	0	0	106.8	V239 A267 W268 L279 L284 L287 A291 F292	V239-I263 HydrophobicContact CB-CG2 4.48Å; I263-A267 HydrophobicContact CG2-CB 4.11Å; I263-W268 HydrophobicContact CG2-CZ2 3.8Å; I263-L279 HydrophobicContact CD1-CD1 3.81Å; I263-L284 HydrophobicContact CD1-CD1 4.38Å; I263-L284 HydrophobicContact CD1-CD2 4.31Å; I263-L284 HydrophobicContact CG1-CD2 4.06Å; I263-L287 HydrophobicContact CD1-CD2 3.98Å; I263-A291 WeakPolarHBondContact CG2-O 3.31Å; I263-F292 HydrophobicContact CD1-CE1 3.9Å; I263-F292 HydrophobicContact CD1-CZ 4.13Å
264	R	93.6	Very high	95.3	Very high	115 Å²	115	41.2 Å²	41.2	43%	0.434	21%	0.211	S	C	.	.			trans	-77.5	145.1	177.5	-59.3	-58.1	-172.1	118.8	3.6	110.9	E238 V239 N240 D266 A267	E238-R264 IonicContact OE1-NH2 3.66Å; E238-R264 IonicContact OE2-CZ 2.86Å; E238-R264 VanDerWaalsContact OE2-CZ 3.27Å; E238-R264 IonicContact OE2-NE 2.8Å; E238-R264 PolarHBondContact OE2-NE 3.17Å; E238-R264 IonicContact OE2-NH2 2.67Å; E238-R264 PolarHBondContact OE2-NH2 3Å; V239-R264 WeakPolarHBondContact O-CG 3.38Å; V239-R264 PolarHBondContact O-N 3.47Å; N240-R264 HydrophobicContact CB-CB 4.45Å; N240-R264 HydrophobicContact CB-CG 3.81Å; R264-D266 PolarHBondContact O-N 2.84Å; R264-A267 WeakPolarHBondContact O-CB 3.28Å; R264-A267 PolarHBondContact O-N 2.97Å
265	P	89.7	Confident	95.3	Very high	80 Å²	80	42.9 Å²	42.9	52%	0.519	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-26.9	-177.3	-30.7	37.1	0	0	0	116	S290	P265-S290 WeakPolarHBondContact CB-OG 3.1Å
266	D	90.3	Very high	95.3	Very high	67 Å²	67	46.2 Å²	46.2	36%	0.358	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	7.1	-177.9	63.4	-3.9	0	0	0	113.6	K241 R264 W268 E269	K241-D266 WeakPolarHBondContact CB-O 3.37Å; K241-D266 HydrophobicContact CD-CB 4.13Å; K241-D266 VanDerWaalsContact CD-OD2 3.26Å; K241-D266 WeakPolarHBondContact CD-OD2 3.25Å; K241-D266 WeakPolarHBondContact CE-OD2 2.93Å; K241-D266 IonicContact NZ-OD2 2.84Å; K241-D266 PolarHBondContact NZ-OD2 2.71Å; R264-D266 PolarHBondContact O-N 2.84Å; D266-W268 PolarHBondContact O-N 3.16Å; D266-W268 VanDerWaalsContact O-N 3.07Å; D266-E269 WeakPolarHBondContact O-CB 3.12Å; D266-E269 PolarHBondContact O-N 2.76Å
267	A	93.3	Very high	95.4	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-38.8	-171.5	0	0	0	0	0	113.9	V239 L244 I263 R264	V239-A267 HydrophobicContact CG1-CB 4.04Å; L244-A267 WeakPolarHBondContact CD1-O 3.3Å; I263-A267 HydrophobicContact CG2-CB 4.11Å; R264-A267 WeakPolarHBondContact O-CB 3.28Å; R264-A267 PolarHBondContact O-N 2.97Å
268	W	94.3	Very high	95.4	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.008	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	4.6	-170	-45.9	115.2	0	0	0	114.8	V239 L244 L253 I263 D266 F270 C271 L277 A291 L295	V239-W268 HydrophobicContact CB-CH2 4.49Å; V239-W268 HydrophobicContact CG1-CH2 3.7Å; V239-W268 HydrophobicContact CG1-CZ2 4.2Å; V239-W268 HydrophobicContact CG1-CZ3 3.93Å; L244-W268 HydrophobicContact CD1-CE3 4.01Å; L244-W268 HydrophobicContact CD1-CZ3 4.03Å; L253-W268 HydrophobicContact CD2-CZ3 3.89Å; I263-W268 HydrophobicContact CG2-CZ2 3.8Å; D266-W268 PolarHBondContact O-N 3.16Å; D266-W268 VanDerWaalsContact O-N 3.07Å; W268-F270 PolarHBondContact O-N 3.02Å; W268-C271 PolarHBondContact O-N 3.47Å; W268-L277 HydrophobicContact CH2-CD1 4.03Å; W268-L277 HydrophobicContact CH2-CD2 3.71Å; W268-L277 HydrophobicContact CZ2-CD2 3.89Å; W268-L277 HydrophobicContact CZ3-CD1 4.39Å; W268-L277 HydrophobicContact CZ3-CD2 4.3Å; W268-A291 PolarHBondContact NE1-O 2.89Å; W268-L295 HydrophobicContact CB-CD2 3.7Å; W268-L295 HydrophobicContact CB-CG 3.94Å; W268-L295 HydrophobicContact CD2-CD1 3.88Å; W268-L295 HydrophobicContact CD2-CD2 4.21Å; W268-L295 HydrophobicContact CD2-CG 4.28Å; W268-L295 HydrophobicContact CE3-CD1 4.49Å; W268-L295 HydrophobicContact CE3-CD2 4.45Å; W268-L295 HydrophobicContact CG-CD1 3.86Å; W268-L295 HydrophobicContact CG-CD2 3.89Å; W268-L295 HydrophobicContact CG-CG 3.8Å
269	E	92.4	Very high	95.4	Very high	90 Å²	90	42.9 Å²	42.9	42%	0.421	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.2	-37.2	-175.5	-170.3	-174.8	154.8	0	0	113.2	K241 D266 Q272	K241-E269 VanDerWaalsContact CD-OE2 3.28Å; K241-E269 WeakPolarHBondContact CD-OE2 3.45Å; K241-E269 IonicContact NZ-OE2 3.39Å; K241-E269 PolarHBondContact NZ-OE2 3.42Å; D266-E269 WeakPolarHBondContact O-CB 3.12Å; D266-E269 PolarHBondContact O-N 2.76Å; E269-Q272 PolarHBondContact O-NE2 3.05Å
270	F	91.8	Very high	95.4	Very high	35 Å²	35	42.1 Å²	42.1	15%	0.154	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-4.7	-177.3	-55	-66	0	0	0	115.4	K241 Y245 L247 R248 W268	K241-F270 HydrophobicContact CB-CD2 4.39Å; K241-F270 HydrophobicContact CB-CE2 4.19Å; K241-F270 HydrophobicContact CD-CE2 4.22Å; K241-F270 HydrophobicContact CG-CE2 4.5Å; Y245-F270 HydrophobicContact CD2-CD1 4.34Å; Y245-F270 HydrophobicContact CD2-CD2 4.02Å; Y245-F270 AromaticContact CD2-CE1 3.98Å; Y245-F270 HydrophobicContact CD2-CE1 3.98Å; Y245-F270 AromaticContact CD2-CE2 3.63Å; Y245-F270 HydrophobicContact CD2-CE2 3.63Å; Y245-F270 HydrophobicContact CD2-CG 4.36Å; Y245-F270 AromaticContact CD2-CZ 3.63Å; Y245-F270 HydrophobicContact CD2-CZ 3.63Å; Y245-F270 AromaticContact CE2-CE1 3.99Å; Y245-F270 HydrophobicContact CE2-CE1 3.99Å; Y245-F270 HydrophobicContact CE2-CE2 4.36Å; Y245-F270 AromaticContact CE2-CZ 3.89Å; Y245-F270 HydrophobicContact CE2-CZ 3.89Å; L247-F270 CarbonylContact C-O 3.24Å; R248-F270 VanDerWaalsContact CA-O 3.32Å; R248-F270 WeakPolarHBondContact CA-O 3.18Å; R248-F270 PolarHBondContact N-O 3Å; W268-F270 PolarHBondContact O-N 3.02Å
271	C	93.1	Very high	95.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.228	C	C	.	.			trans	-112.8	29.7	-170.6	-61.3	0	0	0	0	112.9	W268 K273 L274	W268-C271 PolarHBondContact O-N 3.47Å; C271-K273 PolarHBondContact O-N 2.7Å; C271-L274 WeakPolarHBondContact O-CB 3.23Å; C271-L274 PolarHBondContact O-N 2.99Å
272	Q	92.5	Very high	95.5	Very high	113 Å²	113	44.5 Å²	44.5	53%	0.528	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-6.2	-171.1	-60.3	175.6	9.3	0	0	115.4	E269 F297	E269-Q272 PolarHBondContact O-NE2 3.05Å; Q272-F297 VanDerWaalsContact O-CD2 3.24Å; Q272-F297 WeakPolarHBondContact O-CD2 3.02Å
273	K	95.9	Very high	95.6	Very high	105 Å²	105	46 Å²	46	46%	0.457	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	8.2	175.8	-72.1	-166	176.8	-175.7	0	114	M249 L250 C271 E275	M249-K273 HydrophobicContact SD-CD 4.12Å; M249-K273 PolarHBondContact SD-NZ 2.95Å; L250-K273 CarbonylContact O-C 3.6Å; C271-K273 PolarHBondContact O-N 2.7Å; K273-E275 PolarHBondContact O-N 3.32Å
274	L	97.8	Very high	95.7	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.214	C	C	.	.			trans	-64.3	128.4	-178.7	-159.4	70.3	0	0	0	110.2	L250 L253 C271 L277 L295 F297 L298	L250-L274 HydrophobicContact CD2-CD1 4.1Å; L250-L274 HydrophobicContact CG-CD1 4.02Å; L250-L274 WeakPolarHBondContact O-CA 3.4Å; L250-L274 PolarHBondContact O-N 2.95Å; L253-L274 HydrophobicContact CB-CD1 3.69Å; L253-L274 HydrophobicContact CB-CD2 4.33Å; C271-L274 WeakPolarHBondContact O-CB 3.23Å; C271-L274 PolarHBondContact O-N 2.99Å; L274-L277 HydrophobicContact CD2-CB 3.85Å; L274-L277 HydrophobicContact CD2-CD1 4.2Å; L274-L277 HydrophobicContact CD2-CD2 4.18Å; L274-L277 HydrophobicContact CD2-CG 4.3Å; L274-L295 HydrophobicContact CB-CD2 4.03Å; L274-L295 HydrophobicContact CD2-CD2 4.1Å; L274-F297 CarbonylContact O-C 3.24Å; L274-F297 VanDerWaalsContact O-C 3.27Å; L274-L298 HydrophobicContact CB-CD1 4.25Å; L274-L298 HydrophobicContact CD2-CD1 4.08Å; L274-L298 HydrophobicContact CG-CD1 3.96Å; L274-L298 VanDerWaalsContact O-CA 3.22Å; L274-L298 WeakPolarHBondContact O-CA 3.02Å; L274-L298 PolarHBondContact O-N 3.35Å; L274-L298 VanDerWaalsContact O-N 3.15Å
275	E	98.3	Very high	95.7	Very high	61 Å²	61	43 Å²	43	29%	0.285	21%	0.214	S	C	.	.			trans	-108.3	-32.8	179	-69.2	170	-167.3	0	0	110.8	R251 K273 E299 T300	R251-E275 IonicContact CZ-OE1 2.78Å; R251-E275 IonicContact CZ-OE2 2.79Å; R251-E275 IonicContact NE-OE1 2.72Å; R251-E275 PolarHBondContact NE-OE1 3.17Å; R251-E275 IonicContact NE-OE2 3.82Å; R251-E275 PolarHBondContact NE-OE2 3.22Å; R251-E275 VanDerWaalsContact NE-OE2 3.16Å; R251-E275 IonicContact NH2-OE1 2.77Å; R251-E275 PolarHBondContact NH2-OE1 2.93Å; R251-E275 IonicContact NH2-OE2 2.68Å; R251-E275 PolarHBondContact NH2-OE2 3.41Å; R251-E275 WeakPolarHBondContact O-CA 3.45Å; R251-E275 PolarHBondContact O-N 2.86Å; K273-E275 PolarHBondContact O-N 3.32Å; E275-E299 PolarHBondContact O-N 3.14Å; E275-T300 PolarHBondContact O-N 2.92Å
276	E	98.7	Very high	95.8	Very high	70 Å²	70	43.5 Å²	43.5	33%	0.327	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	128	179	-175.1	177.7	156.2	0	0	111.7	R251 I252 L253 Q254 T300	R251-E276 PolarHBondContact O-N 2.98Å; I252-E276 HydrophobicContact CG1-CB 4.3Å; I252-E276 HydrophobicContact CG2-CB 4.33Å; I252-E276 HydrophobicContact CG2-CG 4.5Å; L253-E276 PolarHBondContact N-O 3.34Å; Q254-E276 PolarHBondContact NE2-OE1 3.06Å; E276-T300 WeakPolarHBondContact CA-O 3.47Å; E276-T300 HydrophobicContact CG-CG2 4.19Å
277	L	98.7	Very high	95.9	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	113.5	177.1	178.5	54.3	0	0	0	110.6	L253 I255 W268 L274 L279 F292 L295 L298 T300 L301 N302	L253-L277 HydrophobicContact CB-CD1 4.18Å; L253-L277 HydrophobicContact CD2-CD1 4.05Å; L253-L277 HydrophobicContact CG-CD1 4.15Å; I255-L277 HydrophobicContact CD1-CD1 4.03Å; I255-L277 HydrophobicContact CG1-CD1 4.18Å; W268-L277 HydrophobicContact CH2-CD1 4.03Å; W268-L277 HydrophobicContact CH2-CD2 3.71Å; W268-L277 HydrophobicContact CZ2-CD2 3.89Å; W268-L277 HydrophobicContact CZ3-CD1 4.39Å; W268-L277 HydrophobicContact CZ3-CD2 4.3Å; L274-L277 HydrophobicContact CD2-CB 3.85Å; L274-L277 HydrophobicContact CD2-CD1 4.2Å; L274-L277 HydrophobicContact CD2-CD2 4.18Å; L274-L277 HydrophobicContact CD2-CG 4.3Å; L277-L279 HydrophobicContact CD1-CD1 4.26Å; L277-L279 HydrophobicContact CD1-CG 4.16Å; L277-L279 HydrophobicContact CD2-CD1 3.87Å; L277-L279 HydrophobicContact CG-CD1 4.01Å; L277-L279 HydrophobicContact CG-CG 4.27Å; L277-F292 HydrophobicContact CD2-CD1 4.5Å; L277-F292 HydrophobicContact CD2-CE1 4.44Å; L277-L295 HydrophobicContact CD2-CD1 4.01Å; L277-L298 HydrophobicContact CB-CD1 3.84Å; L277-L298 HydrophobicContact CB-CD2 4.39Å; L277-T300 PolarHBondContact N-O 3.21Å; L277-L301 HydrophobicContact CB-CD1 4.13Å; L277-L301 HydrophobicContact CD2-CD1 3.97Å; L277-L301 HydrophobicContact CG-CD1 4.02Å; L277-N302 PolarHBondContact O-N 3.29Å
278	D	98.8	Very high	95.8	Very high	17 Å²	17	44.2 Å²	44.2	9%	0.091	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	108.3	171.7	-176.1	20.8	0	0	0	111.4	L253 Q254 I255 S256 S280 N302	L253-D278 PolarHBondContact O-N 2.95Å; Q254-D278 PolarHBondContact OE1-OD2 2.94Å; I255-D278 CarbonylContact C-O 3.17Å; I255-D278 WeakPolarHBondContact CA-O 3.24Å; I255-D278 VanDerWaalsContact CG1-O 3.23Å; I255-D278 WeakPolarHBondContact CG1-O 3.22Å; I255-D278 PolarHBondContact N-O 2.99Å; S256-D278 VanDerWaalsContact CB-CG 3.48Å; S256-D278 WeakPolarHBondContact CB-OD2 3.46Å; S256-D278 PolarHBondContact N-O 2.97Å; S256-D278 VanDerWaalsContact N-O 3.15Å; S256-D278 PolarHBondContact OG-OD2 2.95Å; D278-S280 WeakPolarHBondContact OD1-CB 3.39Å; D278-S280 PolarHBondContact OD1-N 2.99Å; D278-S280 PolarHBondContact OD1-OG 3.03Å; D278-S280 PolarHBondContact OD2-OG 3.34Å; D278-N302 PolarHBondContact OD1-ND2 3.35Å; D278-N302 VanDerWaalsContact OD1-ND2 3.13Å
279	L	98.5	Very high	95.4	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.234	C	C	.	.			trans	-109.5	11.5	174.8	-88.1	162.6	0	0	0	111.9	V239 I255 I260 I263 L277 N282 L284 F292 N302 L303 N306	V239-L279 HydrophobicContact CG2-CD2 4.38Å; I255-L279 HydrophobicContact CD1-CD2 3.46Å; I255-L279 VanDerWaalsContact CD1-CD2 3.46Å; I255-L279 HydrophobicContact CD1-CG 3.91Å; I255-L279 HydrophobicContact CG1-CD2 3.81Å; I255-L279 HydrophobicContact CG1-CG 4.04Å; I260-L279 HydrophobicContact CD1-CD2 3.98Å; I260-L279 HydrophobicContact CG2-CD2 4.47Å; I263-L279 HydrophobicContact CD1-CD1 3.81Å; L277-L279 HydrophobicContact CD1-CD1 4.26Å; L277-L279 HydrophobicContact CD1-CG 4.16Å; L277-L279 HydrophobicContact CD2-CD1 3.87Å; L277-L279 HydrophobicContact CG-CD1 4.01Å; L277-L279 HydrophobicContact CG-CG 4.27Å; L279-N282 WeakPolarHBondContact O-CB 3.49Å; L279-N282 PolarHBondContact O-ND2 2.62Å; L279-L284 HydrophobicContact CB-CD1 4.42Å; L279-L284 HydrophobicContact CD2-CD1 4.47Å; L279-F292 HydrophobicContact CD1-CE1 4.17Å; L279-N302 CarbonylContact C-O 3.56Å; L279-N302 WeakPolarHBondContact CA-O 3.38Å; L279-N302 WeakPolarHBondContact CB-O 3.23Å; L279-N302 PolarHBondContact N-O 3.07Å; L279-L303 HydrophobicContact CB-CD2 3.85Å; L279-L303 HydrophobicContact CD1-CD2 3.98Å; L279-N306 PolarHBondContact O-ND2 3.17Å
280	S	98.7	Very high	95.2	Very high	6 Å²	6	47.5 Å²	47.5	4%	0.042	23%	0.226	C	C	.	.			trans	-64	161.3	-177	63.5	0	0	0	0	114.1	S256 H257 D278 N282 N302 G304	S256-S280 CarbonylContact C-O 3.54Å; S256-S280 WeakPolarHBondContact CA-O 3.41Å; S256-S280 WeakPolarHBondContact CB-O 3.28Å; S256-S280 VanDerWaalsContact CB-OG 3.23Å; S256-S280 WeakPolarHBondContact CB-OG 3.49Å; H257-S280 PolarHBondContact N-O 2.75Å; D278-S280 WeakPolarHBondContact OD1-CB 3.39Å; D278-S280 PolarHBondContact OD1-N 2.99Å; D278-S280 PolarHBondContact OD1-OG 3.03Å; D278-S280 PolarHBondContact OD2-OG 3.34Å; S280-N282 PolarHBondContact O-N 3.15Å; S280-N282 PolarHBondContact O-ND2 3.19Å; S280-N302 PolarHBondContact N-O 3.2Å; S280-N302 PolarHBondContact OG-ND2 2.95Å; S280-G304 CarbonylContact C-O 3.53Å; S280-G304 WeakPolarHBondContact CA-O 3.01Å; S280-G304 WeakPolarHBondContact CB-O 3.2Å
281	H	98.6	Very high	95.3	Very high	69 Å²	69	46.1 Å²	46.1	32%	0.319	22%	0.221	S	C	.	.	S	Bend	trans	53.1	50.7	-180	-62	-80.3	0	0	0	112.9	H257 N258 G304 E305	H257-H281 WeakPolarHBondContact CA-O 3.48Å; H257-H281 HydrophobicContact CB-CB 4.32Å; H257-H281 AromaticContact CD2-CG 3.89Å; H257-H281 AromaticContact CE1-CD2 3.19Å; H257-H281 PolarHBondContact CE1-CD2 3.08Å; H257-H281 AromaticContact CE1-CG 3.7Å; H257-H281 AromaticContact CE1-NE2 3.79Å; H257-H281 PolarHBondContact N-O 3.05Å; H257-H281 AromaticContact ND1-CD2 3.75Å; H257-H281 AromaticContact NE2-CD2 3.52Å; H257-H281 AromaticContact NE2-CG 3.68Å; H257-H281 AromaticContact NE2-NE2 3.87Å; N258-H281 PolarHBondContact N-O 2.93Å; H281-G304 PolarHBondContact N-O 3.42Å; H281-E305 WeakPolarHBondContact CA-O 3.43Å; H281-E305 VanDerWaalsContact CE1-CB 3.48Å; H281-E305 WeakPolarHBondContact CE1-CB 3.16Å; H281-E305 WeakPolarHBondContact CE1-CG 3.47Å; H281-E305 PolarHBondContact N-O 2.81Å; H281-E305 VanDerWaalsContact ND1-CB 3.31Å; H281-E305 WeakPolarHBondContact ND1-CB 3.19Å
282	N	98.7	Very high	95.4	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.027	22%	0.221	C	C	.	.	S	Bend	trans	-122.2	-159.4	177.3	-88.6	-71.1	0	0	0	110.3	I255 N258 A259 I260 L279 S280 N306	I255-N282 PolarHBondContact O-ND2 2.62Å; I255-N282 VanDerWaalsContact O-ND2 3.14Å; N258-N282 VanDerWaalsContact CA-OD1 3.25Å; N258-N282 WeakPolarHBondContact CA-OD1 3.43Å; N258-N282 WeakPolarHBondContact CB-OD1 3.43Å; N258-N282 PolarHBondContact N-OD1 2.77Å; N258-N282 PolarHBondContact O-OD1 2.96Å; A259-N282 PolarHBondContact N-OD1 3.32Å; I260-N282 HydrophobicContact CB-CB 4.2Å; I260-N282 VanDerWaalsContact CB-OD1 3.28Å; I260-N282 WeakPolarHBondContact CB-OD1 3.5Å; I260-N282 WeakPolarHBondContact CG1-OD1 3.26Å; I260-N282 PolarHBondContact N-OD1 3.13Å; L279-N282 WeakPolarHBondContact O-CB 3.49Å; L279-N282 PolarHBondContact O-ND2 2.62Å; S280-N282 PolarHBondContact O-N 3.15Å; S280-N282 PolarHBondContact O-ND2 3.19Å; N282-N306 VanDerWaalsContact CA-OD1 3.26Å; N282-N306 WeakPolarHBondContact CA-OD1 3.17Å; N282-N306 WeakPolarHBondContact CB-OD1 3.47Å; N282-N306 PolarHBondContact N-OD1 3.46Å; N282-N306 PolarHBondContact O-OD1 3.37Å
283	H	97.9	Very high	95.3	Very high	112 Å²	112	44.7 Å²	44.7	52%	0.519	22%	0.22	S	C	.	.			trans	-123.7	26.9	-177.1	-60.7	-21.4	0	0	0	112	I260 G261 T285 N306	I260-H283 CarbonylContact O-C 3.22Å; I260-H283 WeakPolarHBondContact O-CA 3.46Å; I260-H283 PolarHBondContact O-N 3.18Å; G261-H283 WeakPolarHBondContact CA-O 3.42Å; H283-T285 PolarHBondContact O-N 3.04Å; H283-N306 PolarHBondContact N-OD1 3.18Å
284	L	97.8	Very high	95	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	22%	0.219	C	C	.	.			trans	-66.1	129.2	177.1	-61.5	170.7	0	0	0	109.5	I260 I263 L279 L287 L303 N306 S307 I308	I260-L284 HydrophobicContact CG2-CD2 4.06Å; I260-L284 PolarHBondContact O-N 2.73Å; I260-L284 VanDerWaalsContact O-N 3.17Å; I263-L284 HydrophobicContact CD1-CD1 4.38Å; I263-L284 HydrophobicContact CD1-CD2 4.31Å; I263-L284 HydrophobicContact CG1-CD2 4.06Å; L279-L284 HydrophobicContact CB-CD1 4.42Å; L279-L284 HydrophobicContact CD2-CD1 4.47Å; L284-L287 HydrophobicContact CD1-CD2 4.45Å; L284-L303 HydrophobicContact CD1-CD2 3.96Å; L284-N306 HydrophobicContact CB-CB 4.24Å; L284-N306 WeakPolarHBondContact CB-OD1 3.17Å; L284-N306 WeakPolarHBondContact CG-OD1 3.07Å; L284-N306 PolarHBondContact N-OD1 3.37Å; L284-S307 CarbonylContact O-C 3.6Å; L284-S307 WeakPolarHBondContact O-CA 3.37Å; L284-S307 PolarHBondContact O-N 2.99Å; L284-I308 HydrophobicContact CB-CD1 4.27Å; L284-I308 HydrophobicContact CB-CG1 3.87Å; L284-I308 WeakPolarHBondContact O-CG1 3.5Å; L284-I308 PolarHBondContact O-N 3.07Å; L284-I308 VanDerWaalsContact O-N 3.09Å
285	T	94.4	Very high	94.8	Very high	71 Å²	71	41.8 Å²	41.8	44%	0.436	22%	0.22	S	C	.	.			trans	-114.4	-26.4	178.8	54.3	0	0	0	0	113.7	H283 S307 I308 S309 H310	H283-T285 PolarHBondContact O-N 3.04Å; T285-S307 WeakPolarHBondContact CA-O 3.48Å; T285-I308 WeakPolarHBondContact O-CA 3.26Å; T285-S309 PolarHBondContact O-N 2.69Å; T285-S309 PolarHBondContact O-OG 2.97Å; T285-H310 PolarHBondContact O-N 2.85Å
286	R	91.6	Very high	94.6	Very high	90 Å²	90	40 Å²	40	34%	0.34	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	150	-179.6	65.1	-171.4	-62.2	114.7	14.5	110.2	E288 H310 E499	R286-E288 IonicContact CZ-OE1 3.17Å; R286-E288 IonicContact NE-OE1 2.95Å; R286-E288 PolarHBondContact NE-OE1 2.93Å; R286-E288 IonicContact NH2-OE1 2.72Å; R286-E288 PolarHBondContact NH2-OE1 3.03Å; R286-E288 IonicContact NH2-OE2 3.9Å; R286-H310 WeakPolarHBondContact CA-O 3.48Å; R286-H310 HydrophobicContact CB-CB 3.96Å; R286-E499 IonicContact CZ-OE1 3.16Å; R286-E499 VanDerWaalsContact CZ-OE1 3.29Å; R286-E499 IonicContact CZ-OE2 2.64Å; R286-E499 IonicContact NH1-OE1 2.76Å; R286-E499 PolarHBondContact NH1-OE1 2.85Å; R286-E499 IonicContact NH1-OE2 2.75Å; R286-E499 PolarHBondContact NH1-OE2 2.98Å; R286-E499 VanDerWaalsContact NH2-CD 3.32Å; R286-E499 IonicContact NH2-OE1 3.22Å; R286-E499 PolarHBondContact NH2-OE1 2.81Å; R286-E499 IonicContact NH2-OE2 3.68Å
287	L	93.2	Very high	94.4	Very high	3 Å²	3	42.9 Å²	42.9	2%	0.016	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	119.4	172.3	-64.1	170.6	0	0	0	108.8	I263 L284 A291 F292 L303 I308 H310 L311 G312 V315	I263-L287 HydrophobicContact CD1-CD2 3.98Å; L284-L287 HydrophobicContact CD1-CD2 4.45Å; L287-A291 HydrophobicContact CB-CB 4.34Å; L287-A291 HydrophobicContact CD2-CB 4.23Å; L287-F292 HydrophobicContact CD1-CE2 4.04Å; L287-F292 HydrophobicContact CD1-CZ 4.16Å; L287-F292 HydrophobicContact CD2-CE2 4.28Å; L287-F292 HydrophobicContact CD2-CZ 4.03Å; L287-L303 HydrophobicContact CD1-CD1 3.86Å; L287-L303 HydrophobicContact CD1-CD2 4.48Å; L287-I308 HydrophobicContact CD1-CD1 3.81Å; L287-I308 HydrophobicContact CD1-CG1 4.46Å; L287-I308 HydrophobicContact CD1-CG2 4.33Å; L287-I308 HydrophobicContact CG-CD1 4.43Å; L287-I308 HydrophobicContact CG-CG2 4.5Å; L287-H310 PolarHBondContact N-O 3.32Å; L287-H310 VanDerWaalsContact N-O 3.1Å; L287-L311 HydrophobicContact CB-CD2 4.25Å; L287-L311 HydrophobicContact CD1-CD2 3.85Å; L287-L311 HydrophobicContact CG-CD2 4.49Å; L287-G312 PolarHBondContact O-N 2.79Å; L287-V315 HydrophobicContact CB-CG2 3.64Å
288	E	89.1	Confident	94.4	Very high	79 Å²	79	42.9 Å²	42.9	37%	0.369	23%	0.229	S	C	.	.			trans	-81.3	163.6	177.7	-56.5	-55.5	146.3	0	0	111.8	R286 S290 A291 V315	R286-E288 IonicContact CZ-OE1 3.17Å; R286-E288 IonicContact NE-OE1 2.95Å; R286-E288 PolarHBondContact NE-OE1 2.93Å; R286-E288 IonicContact NH2-OE1 2.72Å; R286-E288 PolarHBondContact NH2-OE1 3.03Å; R286-E288 IonicContact NH2-OE2 3.9Å; E288-S290 PolarHBondContact O-N 3.04Å; E288-S290 VanDerWaalsContact O-N 3.08Å; E288-A291 WeakPolarHBondContact O-CB 3.06Å; E288-A291 PolarHBondContact O-N 3.19Å; E288-V315 WeakPolarHBondContact O-CG2 3.48Å
289	E	87.2	Confident	94.3	Very high	122 Å²	122	45 Å²	45	57%	0.57	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-46.1	-41	170.7	-171.9	-173.5	176	0	0	112.4	A291 E313	E289-A291 VanDerWaalsContact C-N 3.29Å; E289-A291 PolarHBondContact O-N 3.01Å; E289-E313 WeakPolarHBondContact CB-O 3.47Å; E289-E313 WeakPolarHBondContact CG-O 3.37Å
290	S	88.6	Confident	94.3	Very high	39 Å²	39	47.1 Å²	47.1	27%	0.273	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-75.1	-5.8	-178.5	62.4	0	0	0	0	115.7	P265 E288 F292 V293	P265-S290 WeakPolarHBondContact CB-OG 3.1Å; E288-S290 PolarHBondContact O-N 3.04Å; E288-S290 VanDerWaalsContact O-N 3.08Å; S290-F292 VanDerWaalsContact C-N 3.29Å; S290-F292 PolarHBondContact O-N 3Å; S290-F292 VanDerWaalsContact O-N 3.17Å; S290-V293 PolarHBondContact O-N 3.17Å
291	A	93.8	Very high	94.3	Very high	5 Å²	5	46.8 Å²	46.8	4%	0.041	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-63.1	-27.8	-166.6	0	0	0	0	0	114.9	I263 W268 L287 E288 E289 V315	I263-A291 WeakPolarHBondContact CG2-O 3.31Å; W268-A291 PolarHBondContact NE1-O 2.89Å; L287-A291 HydrophobicContact CB-CB 4.34Å; L287-A291 HydrophobicContact CD2-CB 4.23Å; E288-A291 WeakPolarHBondContact O-CB 3.06Å; E288-A291 PolarHBondContact O-N 3.19Å; E289-A291 VanDerWaalsContact C-N 3.29Å; E289-A291 PolarHBondContact O-N 3.01Å; A291-V315 HydrophobicContact CB-CG2 4.42Å
292	F	94.1	Very high	94.4	Very high	1 Å²	1	45.2 Å²	45.2	0%	0.004	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-127	16.7	-178.5	-54.8	-68.4	0	0	0	113.8	I263 L277 L279 L287 S290 G294 L295 L301 L303 V315 F316 L319	I263-F292 HydrophobicContact CD1-CE1 3.9Å; I263-F292 HydrophobicContact CD1-CZ 4.13Å; L277-F292 HydrophobicContact CD2-CD1 4.5Å; L277-F292 HydrophobicContact CD2-CE1 4.44Å; L279-F292 HydrophobicContact CD1-CE1 4.17Å; L287-F292 HydrophobicContact CD1-CE2 4.04Å; L287-F292 HydrophobicContact CD1-CZ 4.16Å; L287-F292 HydrophobicContact CD2-CE2 4.28Å; L287-F292 HydrophobicContact CD2-CZ 4.03Å; S290-F292 VanDerWaalsContact C-N 3.29Å; S290-F292 PolarHBondContact O-N 3Å; S290-F292 VanDerWaalsContact O-N 3.17Å; F292-G294 PolarHBondContact O-N 2.9Å; F292-L295 HydrophobicContact CB-CD1 4.21Å; F292-L295 HydrophobicContact CD1-CD1 4.11Å; F292-L295 WeakPolarHBondContact O-CB 3.35Å; F292-L295 PolarHBondContact O-N 3.45Å; F292-L301 HydrophobicContact CD1-CD2 4.43Å; F292-L301 HydrophobicContact CD2-CD2 4.41Å; F292-L301 HydrophobicContact CE1-CD1 4.17Å; F292-L301 HydrophobicContact CE1-CD2 4.25Å; F292-L301 HydrophobicContact CE2-CD2 4.23Å; F292-L301 HydrophobicContact CZ-CD2 4.16Å; F292-L303 HydrophobicContact CE1-CD2 4.49Å; F292-L303 HydrophobicContact CE2-CD1 4.27Å; F292-L303 HydrophobicContact CZ-CD1 3.94Å; F292-L303 HydrophobicContact CZ-CD2 3.92Å; F292-L303 HydrophobicContact CZ-CG 4.5Å; F292-V315 HydrophobicContact CD2-CG2 4.22Å; F292-V315 HydrophobicContact CE2-CG2 4.15Å; F292-F316 HydrophobicContact CD2-CD1 4.25Å; F292-F316 HydrophobicContact CD2-CE1 4.3Å; F292-F316 HydrophobicContact CE2-CD1 4.36Å; F292-F316 AromaticContact CE2-CE1 3.95Å; F292-F316 HydrophobicContact CE2-CE1 3.95Å; F292-L319 HydrophobicContact CB-CD1 4.27Å; F292-L319 HydrophobicContact CB-CD2 4.09Å
293	V	90.7	Very high	94.3	Very high	82 Å²	82	45 Å²	45	50%	0.497	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	132.6	-179.1	169.7	0	0	0	0	111.1	S290	S290-V293 PolarHBondContact O-N 3.17Å
294	G	89.6	Confident	94.4	Very high	43 Å²	43	39.7 Å²	39.7	44%	0.443	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.9	-9.4	-178.6	0	0	0	0	0	115.4	F292 G296	F292-G294 PolarHBondContact O-N 2.9Å; G294-G296 PolarHBondContact O-N 3.28Å; G294-G296 VanDerWaalsContact O-N 3.08Å
295	L	94.5	Very high	94.4	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.01	23%	0.231	C	C	.	.			trans	-84.1	41.7	178.7	-62.7	-177.2	0	0	0	113.6	W268 L274 L277 F292 F297 L298 L319	W268-L295 HydrophobicContact CB-CD2 3.7Å; W268-L295 HydrophobicContact CB-CG 3.94Å; W268-L295 HydrophobicContact CD2-CD1 3.88Å; W268-L295 HydrophobicContact CD2-CD2 4.21Å; W268-L295 HydrophobicContact CD2-CG 4.28Å; W268-L295 HydrophobicContact CE3-CD1 4.49Å; W268-L295 HydrophobicContact CE3-CD2 4.45Å; W268-L295 HydrophobicContact CG-CD1 3.86Å; W268-L295 HydrophobicContact CG-CD2 3.89Å; W268-L295 HydrophobicContact CG-CG 3.8Å; L274-L295 HydrophobicContact CB-CD2 4.03Å; L274-L295 HydrophobicContact CD2-CD2 4.1Å; L277-L295 HydrophobicContact CD2-CD1 4.01Å; F292-L295 HydrophobicContact CB-CD1 4.21Å; F292-L295 HydrophobicContact CD1-CD1 4.11Å; F292-L295 WeakPolarHBondContact O-CB 3.35Å; F292-L295 PolarHBondContact O-N 3.45Å; L295-F297 PolarHBondContact O-N 3.41Å; L295-L298 HydrophobicContact CB-CB 4.24Å; L295-L298 HydrophobicContact CB-CD2 4.48Å; L295-L298 HydrophobicContact CD1-CD2 4.26Å; L295-L298 VanDerWaalsContact O-CB 3.28Å; L295-L298 WeakPolarHBondContact O-CB 3.31Å; L295-L298 PolarHBondContact O-N 3.38Å; L295-L298 VanDerWaalsContact O-N 3.07Å; L295-L319 HydrophobicContact CB-CD2 3.8Å; L295-L319 WeakPolarHBondContact O-CD2 3.48Å
296	G	93.2	Very high	94.6	Very high	24 Å²	24	39.7 Å²	39.7	25%	0.247	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-6.1	-172.4	0	0	0	0	0	116.5	G294 G318 H321	G294-G296 PolarHBondContact O-N 3.28Å; G294-G296 VanDerWaalsContact O-N 3.08Å; G296-G318 WeakPolarHBondContact CA-O 3.31Å; G296-H321 PolarHBondContact O-ND1 3.02Å
297	F	95.6	Very high	94.8	Very high	129 Å²	129	37.7 Å²	37.7	57%	0.566	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-0.1	175.5	-71.7	-87.6	0	0	0	113.6	Q272 L274 L295 E299	Q272-F297 VanDerWaalsContact O-CD2 3.24Å; Q272-F297 WeakPolarHBondContact O-CD2 3.02Å; L274-F297 CarbonylContact O-C 3.24Å; L274-F297 VanDerWaalsContact O-C 3.27Å; L295-F297 PolarHBondContact O-N 3.41Å; F297-E299 PolarHBondContact O-N 3.02Å
298	L	97.6	Very high	95	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.212	C	C	.	.			trans	-65.4	125.5	-177.3	-163.1	72.3	0	0	0	110.1	L274 L277 L295 L301 L319 H321 L322	L274-L298 HydrophobicContact CB-CD1 4.25Å; L274-L298 HydrophobicContact CD2-CD1 4.08Å; L274-L298 HydrophobicContact CG-CD1 3.96Å; L274-L298 VanDerWaalsContact O-CA 3.22Å; L274-L298 WeakPolarHBondContact O-CA 3.02Å; L274-L298 PolarHBondContact O-N 3.35Å; L274-L298 VanDerWaalsContact O-N 3.15Å; L277-L298 HydrophobicContact CB-CD1 3.84Å; L277-L298 HydrophobicContact CB-CD2 4.39Å; L295-L298 HydrophobicContact CB-CB 4.24Å; L295-L298 HydrophobicContact CB-CD2 4.48Å; L295-L298 HydrophobicContact CD1-CD2 4.26Å; L295-L298 VanDerWaalsContact O-CB 3.28Å; L295-L298 WeakPolarHBondContact O-CB 3.31Å; L295-L298 PolarHBondContact O-N 3.38Å; L295-L298 VanDerWaalsContact O-N 3.07Å; L298-L301 HydrophobicContact CD2-CB 3.88Å; L298-L301 HydrophobicContact CD2-CD1 4.26Å; L298-L301 HydrophobicContact CD2-CD2 4.3Å; L298-L301 HydrophobicContact CD2-CG 4.37Å; L298-L319 HydrophobicContact CB-CD2 4.49Å; L298-L319 HydrophobicContact CD2-CD2 4.42Å; L298-H321 CarbonylContact O-C 3.6Å; L298-L322 HydrophobicContact CB-CD1 4.34Å; L298-L322 HydrophobicContact CD2-CD1 4.04Å; L298-L322 HydrophobicContact CG-CD1 4.02Å; L298-L322 WeakPolarHBondContact O-CA 3.45Å; L298-L322 PolarHBondContact O-N 2.73Å
299	E	97.9	Very high	95	Very high	61 Å²	61	36.1 Å²	36.1	29%	0.285	21%	0.211	S	C	.	.			trans	-102.1	-31.5	176.5	-59.6	-154.4	135.4	0	0	111.9	E275 F297 R323 T324	E275-E299 PolarHBondContact O-N 3.14Å; F297-E299 PolarHBondContact O-N 3.02Å; E299-R323 HydrophobicContact CB-CG 4.34Å; E299-R323 WeakPolarHBondContact O-CA 3.07Å; E299-R323 PolarHBondContact O-N 3.03Å; E299-R323 IonicContact OE1-CZ 2.72Å; E299-R323 IonicContact OE1-NE 2.59Å; E299-R323 PolarHBondContact OE1-NE 2.93Å; E299-R323 IonicContact OE1-NH2 3.83Å; E299-R323 PolarHBondContact OE1-NH2 3.09Å; E299-R323 IonicContact OE2-NE 3.55Å; E299-R323 PolarHBondContact OE2-NE 3.21Å; E299-R323 IonicContact OE2-NH2 3.2Å; E299-T324 PolarHBondContact O-N 2.83Å
300	T	98.6	Very high	95	Very high	45 Å²	45	31 Å²	31	28%	0.276	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	125.3	-179.5	-60.1	0	0	0	0	111.5	E275 E276 L277 T324	E275-T300 PolarHBondContact O-N 2.92Å; E276-T300 WeakPolarHBondContact CA-O 3.47Å; E276-T300 HydrophobicContact CG-CG2 4.19Å; L277-T300 PolarHBondContact N-O 3.21Å; T300-T324 WeakPolarHBondContact CA-O 3.48Å; T300-T324 HydrophobicContact CG2-CG2 4.39Å
301	L	98.6	Very high	95.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	118.9	174.2	178.7	54.3	0	0	0	110	L277 F292 L298 L303 F316 L319 L322 T324 L325 D326	L277-L301 HydrophobicContact CB-CD1 4.13Å; L277-L301 HydrophobicContact CD2-CD1 3.97Å; L277-L301 HydrophobicContact CG-CD1 4.02Å; F292-L301 HydrophobicContact CD1-CD2 4.43Å; F292-L301 HydrophobicContact CD2-CD2 4.41Å; F292-L301 HydrophobicContact CE1-CD1 4.17Å; F292-L301 HydrophobicContact CE1-CD2 4.25Å; F292-L301 HydrophobicContact CE2-CD2 4.23Å; F292-L301 HydrophobicContact CZ-CD2 4.16Å; L298-L301 HydrophobicContact CD2-CB 3.88Å; L298-L301 HydrophobicContact CD2-CD1 4.26Å; L298-L301 HydrophobicContact CD2-CD2 4.3Å; L298-L301 HydrophobicContact CD2-CG 4.37Å; L301-L303 HydrophobicContact CD1-CD1 4.39Å; L301-L303 HydrophobicContact CD1-CD2 4.3Å; L301-L303 HydrophobicContact CD1-CG 4.05Å; L301-L303 HydrophobicContact CD2-CD1 3.97Å; L301-L303 HydrophobicContact CD2-CG 4.49Å; L301-L303 HydrophobicContact CG-CD1 4.03Å; L301-L303 HydrophobicContact CG-CG 4.05Å; L301-F316 HydrophobicContact CD2-CD1 4.39Å; L301-F316 HydrophobicContact CD2-CE1 4.21Å; L301-L319 HydrophobicContact CD2-CD1 4.13Å; L301-L322 HydrophobicContact CB-CD1 3.75Å; L301-L322 HydrophobicContact CB-CD2 4.36Å; L301-T324 PolarHBondContact N-O 2.96Å; L301-L325 HydrophobicContact CB-CD1 4.08Å; L301-L325 HydrophobicContact CD2-CD1 3.95Å; L301-L325 HydrophobicContact CG-CD1 3.98Å; L301-L325 WeakPolarHBondContact O-CA 3.45Å; L301-D326 PolarHBondContact O-N 3.08Å
302	N	98.8	Very high	94.7	Very high	36 Å²	36	29.4 Å²	29.4	19%	0.193	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	117.5	174.4	-175.1	6.7	0	0	0	110.7	L277 D278 L279 S280 G304	L277-N302 PolarHBondContact O-N 3.29Å; D278-N302 PolarHBondContact OD1-ND2 3.35Å; D278-N302 VanDerWaalsContact OD1-ND2 3.13Å; L279-N302 CarbonylContact C-O 3.56Å; L279-N302 WeakPolarHBondContact CA-O 3.38Å; L279-N302 WeakPolarHBondContact CB-O 3.23Å; L279-N302 PolarHBondContact N-O 3.07Å; S280-N302 PolarHBondContact N-O 3.2Å; S280-N302 PolarHBondContact OG-ND2 2.95Å; N302-G304 PolarHBondContact OD1-N 3.39Å
303	L	98.5	Very high	94.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.202	C	C	.	.			trans	-120	10.1	178.4	-66.4	165.9	0	0	0	111.4	L279 L284 L287 F292 L301 N306 I308 F316 L325 D326 I327 N330	L279-L303 HydrophobicContact CB-CD2 3.85Å; L279-L303 HydrophobicContact CD1-CD2 3.98Å; L284-L303 HydrophobicContact CD1-CD2 3.96Å; L287-L303 HydrophobicContact CD1-CD1 3.86Å; L287-L303 HydrophobicContact CD1-CD2 4.48Å; F292-L303 HydrophobicContact CE1-CD2 4.49Å; F292-L303 HydrophobicContact CE2-CD1 4.27Å; F292-L303 HydrophobicContact CZ-CD1 3.94Å; F292-L303 HydrophobicContact CZ-CD2 3.92Å; F292-L303 HydrophobicContact CZ-CG 4.5Å; L301-L303 HydrophobicContact CD1-CD1 4.39Å; L301-L303 HydrophobicContact CD1-CD2 4.3Å; L301-L303 HydrophobicContact CD1-CG 4.05Å; L301-L303 HydrophobicContact CD2-CD1 3.97Å; L301-L303 HydrophobicContact CD2-CG 4.49Å; L301-L303 HydrophobicContact CG-CD1 4.03Å; L301-L303 HydrophobicContact CG-CG 4.05Å; L303-N306 PolarHBondContact O-ND2 3.41Å; L303-I308 HydrophobicContact CB-CD1 4.05Å; L303-F316 HydrophobicContact CD1-CE1 4.14Å; L303-F316 HydrophobicContact CD1-CZ 4.48Å; L303-L325 HydrophobicContact CD1-CD1 4.46Å; L303-D326 WeakPolarHBondContact CA-O 3.29Å; L303-D326 PolarHBondContact N-O 2.8Å; L303-I327 HydrophobicContact CB-CB 4.49Å; L303-I327 HydrophobicContact CB-CG1 4.37Å; L303-I327 HydrophobicContact CB-CG2 3.96Å; L303-I327 HydrophobicContact CD1-CD1 4.43Å; L303-I327 HydrophobicContact CD1-CG1 4.37Å; L303-N330 PolarHBondContact O-ND2 2.9Å
304	G	98.3	Very high	93.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.19	C	C	.	.			trans	-60.8	158.1	-176.4	0	0	0	0	0	113.9	S280 H281 N302 N306 D326 H328	S280-G304 CarbonylContact C-O 3.53Å; S280-G304 WeakPolarHBondContact CA-O 3.01Å; S280-G304 WeakPolarHBondContact CB-O 3.2Å; H281-G304 PolarHBondContact N-O 3.42Å; N302-G304 PolarHBondContact OD1-N 3.39Å; G304-N306 VanDerWaalsContact C-N 3.3Å; G304-N306 PolarHBondContact O-N 3.3Å; G304-N306 PolarHBondContact O-ND2 2.75Å; G304-D326 PolarHBondContact N-O 3.3Å; G304-H328 CarbonylContact C-O 3.57Å; G304-H328 WeakPolarHBondContact CA-O 3.21Å
305	E	98.3	Very high	93.9	Very high	62 Å²	62	30.1 Å²	30.1	29%	0.29	17%	0.17	S	C	.	.	S	Bend	trans	56.5	41.5	175.5	-63.7	-96	-170.4	0	0	112.9	H281 H328 N329	H281-E305 WeakPolarHBondContact CA-O 3.43Å; H281-E305 VanDerWaalsContact CE1-CB 3.48Å; H281-E305 WeakPolarHBondContact CE1-CB 3.16Å; H281-E305 WeakPolarHBondContact CE1-CG 3.47Å; H281-E305 PolarHBondContact N-O 2.81Å; H281-E305 VanDerWaalsContact ND1-CB 3.31Å; H281-E305 WeakPolarHBondContact ND1-CB 3.19Å; E305-H328 PolarHBondContact N-O 2.92Å; E305-N329 VanDerWaalsContact CD-ND2 3.28Å; E305-N329 HydrophobicContact CG-CB 4.1Å; E305-N329 PolarHBondContact OE2-ND2 3.13Å
306	N	98.4	Very high	93.7	Very high	10 Å²	10	30.1 Å²	30.1	5%	0.053	17%	0.169	C	C	.	.	S	Bend	trans	-109	-156.6	171.1	-86.2	-87.5	0	0	0	109.4	L279 N282 H283 L284 L303 G304 I308 N330	L279-N306 PolarHBondContact O-ND2 3.17Å; N282-N306 VanDerWaalsContact CA-OD1 3.26Å; N282-N306 WeakPolarHBondContact CA-OD1 3.17Å; N282-N306 WeakPolarHBondContact CB-OD1 3.47Å; N282-N306 PolarHBondContact N-OD1 3.46Å; N282-N306 PolarHBondContact O-OD1 3.37Å; H283-N306 PolarHBondContact N-OD1 3.18Å; L284-N306 HydrophobicContact CB-CB 4.24Å; L284-N306 WeakPolarHBondContact CB-OD1 3.17Å; L284-N306 WeakPolarHBondContact CG-OD1 3.07Å; L284-N306 PolarHBondContact N-OD1 3.37Å; L303-N306 PolarHBondContact O-ND2 3.41Å; G304-N306 VanDerWaalsContact C-N 3.3Å; G304-N306 PolarHBondContact O-N 3.3Å; G304-N306 PolarHBondContact O-ND2 2.75Å; N306-I308 HydrophobicContact CB-CD1 4.05Å; N306-I308 HydrophobicContact CB-CG1 4Å; N306-N330 WeakPolarHBondContact CA-OD1 3.25Å; N306-N330 WeakPolarHBondContact CB-OD1 3.49Å
307	S	96.9	Very high	93.4	Very high	48 Å²	48	31.3 Å²	31.3	34%	0.336	17%	0.174	S	C	.	.			trans	-130.1	33.1	174.3	-54.5	0	0	0	0	111.2	L284 T285 S309 N330	L284-S307 CarbonylContact O-C 3.6Å; L284-S307 WeakPolarHBondContact O-CA 3.37Å; L284-S307 PolarHBondContact O-N 2.99Å; T285-S307 WeakPolarHBondContact CA-O 3.48Å; S307-S309 PolarHBondContact O-N 3.25Å; S307-S309 VanDerWaalsContact O-N 3.12Å; S307-N330 PolarHBondContact N-OD1 2.72Å
308	I	95.8	Very high	93	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	18%	0.175	C	C	.	.			trans	-67	111.7	-173.9	-59.7	161.2	0	0	0	108.7	L284 T285 L287 L303 N306 H310 L311 I327 N330 E331 I332	L284-I308 HydrophobicContact CB-CD1 4.27Å; L284-I308 HydrophobicContact CB-CG1 3.87Å; L284-I308 WeakPolarHBondContact O-CG1 3.5Å; L284-I308 PolarHBondContact O-N 3.07Å; L284-I308 VanDerWaalsContact O-N 3.09Å; T285-I308 WeakPolarHBondContact O-CA 3.26Å; L287-I308 HydrophobicContact CD1-CD1 3.81Å; L287-I308 HydrophobicContact CD1-CG1 4.46Å; L287-I308 HydrophobicContact CD1-CG2 4.33Å; L287-I308 HydrophobicContact CG-CD1 4.43Å; L287-I308 HydrophobicContact CG-CG2 4.5Å; L303-I308 HydrophobicContact CB-CD1 4.05Å; N306-I308 HydrophobicContact CB-CD1 4.05Å; N306-I308 HydrophobicContact CB-CG1 4Å; I308-H310 WeakPolarHBondContact CG2-O 3.36Å; I308-L311 HydrophobicContact CG2-CD2 3.73Å; I308-L311 HydrophobicContact CG2-CG 4.32Å; I308-I327 HydrophobicContact CD1-CG2 4.12Å; I308-N330 HydrophobicContact CB-CB 4.28Å; I308-N330 VanDerWaalsContact CB-OD1 3.28Å; I308-N330 WeakPolarHBondContact CB-OD1 3.47Å; I308-N330 WeakPolarHBondContact CG1-OD1 3.37Å; I308-N330 PolarHBondContact N-OD1 3.36Å; I308-E331 CarbonylContact O-C 3.57Å; I308-E331 VanDerWaalsContact O-C 3.27Å; I308-E331 VanDerWaalsContact O-CA 3.32Å; I308-E331 WeakPolarHBondContact O-CA 3.44Å; I308-E331 PolarHBondContact O-N 3.37Å; I308-I332 HydrophobicContact CG2-CG1 4.47Å; I308-I332 WeakPolarHBondContact O-CG1 3.43Å; I308-I332 PolarHBondContact O-N 3.12Å
309	S	89.9	Confident	92.7	Very high	49 Å²	49	28 Å²	28	34%	0.343	18%	0.176	S	C	.	.			trans	-109.2	-22.3	174.3	57.9	0	0	0	0	112.2	T285 S307 W334	T285-S309 PolarHBondContact O-N 2.69Å; T285-S309 PolarHBondContact O-OG 2.97Å; S307-S309 PolarHBondContact O-N 3.25Å; S307-S309 VanDerWaalsContact O-N 3.12Å; S309-W334 PolarHBondContact O-NE1 2.96Å
310	H	87.4	Confident	92.3	Very high	15 Å²	15	27.5 Å²	27.5	7%	0.069	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	131.4	176.7	-177.3	111.4	0	0	0	112.1	T285 R286 L287 I308 G312 W334 E499	T285-H310 PolarHBondContact O-N 2.85Å; R286-H310 WeakPolarHBondContact CA-O 3.48Å; R286-H310 HydrophobicContact CB-CB 3.96Å; L287-H310 PolarHBondContact N-O 3.32Å; L287-H310 VanDerWaalsContact N-O 3.1Å; I308-H310 WeakPolarHBondContact CG2-O 3.36Å; H310-G312 PolarHBondContact CD2-N 3.14Å; H310-G312 WeakPolarHBondContact NE2-CA 3.24Å; H310-G312 PolarHBondContact NE2-N 3.27Å; H310-W334 HydrophobicContact CB-CZ2 4.21Å; H310-W334 AromaticContact CE1-CZ2 3.88Å; H310-W334 AromaticContact CG-CZ2 3.75Å; H310-W334 AromaticContact ND1-CZ2 3.54Å; H310-E499 IonicContact CE1-OE1 3.87Å; H310-E499 PolarHBondContact CE1-OE1 2.93Å; H310-E499 IonicContact CG-OE1 3.32Å; H310-E499 IonicContact ND1-OE1 3.9Å; H310-E499 PolarHBondContact ND1-OE1 3.2Å; H310-E499 IonicContact NE2-OE1 4Å
311	L	90.1	Very high	92.1	Very high	3 Å²	3	28.3 Å²	28.3	2%	0.016	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	114.8	168.5	-66.8	179	0	0	0	108.5	L287 I308 V315 F316 I332 W334 A335 V342	L287-L311 HydrophobicContact CB-CD2 4.25Å; L287-L311 HydrophobicContact CD1-CD2 3.85Å; L287-L311 HydrophobicContact CG-CD2 4.49Å; I308-L311 HydrophobicContact CG2-CD2 3.73Å; I308-L311 HydrophobicContact CG2-CG 4.32Å; L311-V315 HydrophobicContact CB-CG1 4.22Å; L311-V315 HydrophobicContact CD2-CG1 4.5Å; L311-F316 HydrophobicContact CD1-CE2 4.28Å; L311-F316 HydrophobicContact CD2-CE2 4.45Å; L311-F316 HydrophobicContact CD2-CZ 4.17Å; L311-I332 HydrophobicContact CD1-CD1 3.92Å; L311-I332 HydrophobicContact CD1-CG1 4.34Å; L311-I332 HydrophobicContact CD1-CG2 4.43Å; L311-W334 WeakPolarHBondContact O-CH2 3.49Å; L311-A335 HydrophobicContact CB-CB 4.15Å; L311-A335 HydrophobicContact CD1-CB 4.02Å; L311-A335 HydrophobicContact CG-CB 4.46Å; L311-V342 HydrophobicContact CB-CG2 3.93Å; L311-V342 HydrophobicContact CD1-CG2 4.26Å
312	G	85.4	Confident	92	Very high	7 Å²	7	28.3 Å²	28.3	7%	0.072	18%	0.183	C	C	.	.			trans	-64	152.6	178.8	0	0	0	0	0	111.9	L287 H310 G314 V315	L287-G312 PolarHBondContact O-N 2.79Å; H310-G312 PolarHBondContact CD2-N 3.14Å; H310-G312 WeakPolarHBondContact NE2-CA 3.24Å; H310-G312 PolarHBondContact NE2-N 3.27Å; G312-G314 PolarHBondContact O-N 3.16Å; G312-V315 VanDerWaalsContact O-CB 3.29Å; G312-V315 WeakPolarHBondContact O-CB 3.47Å; G312-V315 WeakPolarHBondContact O-CG1 3.3Å; G312-V315 PolarHBondContact O-N 2.79Å; G312-V315 VanDerWaalsContact O-N 3.13Å
313	E	81.5	Confident	92	Very high	116 Å²	116	31.8 Å²	31.8	54%	0.542	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	132.4	173.6	-161.4	159.5	145.1	0	0	109.4	E289 V315 I340 R551	E289-E313 WeakPolarHBondContact CB-O 3.47Å; E289-E313 WeakPolarHBondContact CG-O 3.37Å; E313-V315 VanDerWaalsContact C-N 3.27Å; E313-V315 PolarHBondContact O-N 2.92Å; E313-I340 HydrophobicContact CG-CG2 4.35Å; E313-R551 IonicContact OE2-CZ 2.73Å; E313-R551 IonicContact OE2-NH1 3.27Å; E313-R551 PolarHBondContact OE2-NH1 3.04Å; E313-R551 IonicContact OE2-NH2 2.84Å; E313-R551 PolarHBondContact OE2-NH2 3.44Å; E313-R551 VanDerWaalsContact OE2-NH2 3.1Å
314	G	85.1	Confident	92	Very high	25 Å²	25	34 Å²	34	26%	0.258	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.8	12.8	-176.1	0	0	0	0	0	116.1	G312 F316 S317	G312-G314 PolarHBondContact O-N 3.16Å; G314-F316 PolarHBondContact O-N 2.93Å; G314-F316 VanDerWaalsContact O-N 3.12Å; G314-S317 WeakPolarHBondContact O-CB 3.46Å; G314-S317 PolarHBondContact O-N 2.92Å; G314-S317 PolarHBondContact O-OG 3.17Å
315	V	90.6	Very high	92	Very high	1 Å²	1	34 Å²	34	1%	0.006	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-31.9	177.7	61.2	0	0	0	0	114.8	L287 E288 A291 F292 L311 G312 E313 V342	L287-V315 HydrophobicContact CB-CG2 3.64Å; E288-V315 WeakPolarHBondContact O-CG2 3.48Å; A291-V315 HydrophobicContact CB-CG2 4.42Å; F292-V315 HydrophobicContact CD2-CG2 4.22Å; F292-V315 HydrophobicContact CE2-CG2 4.15Å; L311-V315 HydrophobicContact CB-CG1 4.22Å; L311-V315 HydrophobicContact CD2-CG1 4.5Å; G312-V315 VanDerWaalsContact O-CB 3.29Å; G312-V315 WeakPolarHBondContact O-CB 3.47Å; G312-V315 WeakPolarHBondContact O-CG1 3.3Å; G312-V315 PolarHBondContact O-N 2.79Å; G312-V315 VanDerWaalsContact O-N 3.13Å; E313-V315 VanDerWaalsContact C-N 3.27Å; E313-V315 PolarHBondContact O-N 2.92Å; V315-V342 HydrophobicContact CG1-CG2 4.21Å
316	F	91.2	Very high	92	Very high	1 Å²	1	32.5 Å²	32.5	0%	0.004	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	8.6	175.9	-54.4	-60.6	0	0	0	113.3	F292 L301 L303 L311 G314 L319 L325 I327 F343 M346	F292-F316 HydrophobicContact CD2-CD1 4.25Å; F292-F316 HydrophobicContact CD2-CE1 4.3Å; F292-F316 HydrophobicContact CE2-CD1 4.36Å; F292-F316 AromaticContact CE2-CE1 3.95Å; F292-F316 HydrophobicContact CE2-CE1 3.95Å; L301-F316 HydrophobicContact CD2-CD1 4.39Å; L301-F316 HydrophobicContact CD2-CE1 4.21Å; L303-F316 HydrophobicContact CD1-CE1 4.14Å; L303-F316 HydrophobicContact CD1-CZ 4.48Å; L311-F316 HydrophobicContact CD1-CE2 4.28Å; L311-F316 HydrophobicContact CD2-CE2 4.45Å; L311-F316 HydrophobicContact CD2-CZ 4.17Å; G314-F316 PolarHBondContact O-N 2.93Å; G314-F316 VanDerWaalsContact O-N 3.12Å; F316-L319 HydrophobicContact CB-CD1 4.13Å; F316-L319 HydrophobicContact CD1-CD1 3.92Å; F316-L319 WeakPolarHBondContact O-CB 3.49Å; F316-L319 WeakPolarHBondContact O-CG 3.35Å; F316-L319 PolarHBondContact O-N 3.04Å; F316-L325 HydrophobicContact CD1-CD2 4.5Å; F316-L325 HydrophobicContact CD2-CD2 4.39Å; F316-L325 HydrophobicContact CE1-CD1 4.26Å; F316-L325 HydrophobicContact CE1-CD2 4.38Å; F316-L325 HydrophobicContact CE2-CD2 4.28Å; F316-L325 HydrophobicContact CZ-CD2 4.28Å; F316-I327 HydrophobicContact CE1-CD1 4.48Å; F316-I327 HydrophobicContact CE2-CD1 4.14Å; F316-I327 HydrophobicContact CZ-CD1 3.61Å; F316-F343 AromaticContact CD2-CD1 3.81Å; F316-F343 HydrophobicContact CD2-CD1 3.81Å; F316-F343 HydrophobicContact CD2-CE1 4.09Å; F316-F343 AromaticContact CE2-CD1 3.97Å; F316-F343 HydrophobicContact CE2-CD1 3.97Å; F316-F343 AromaticContact CE2-CE1 3.76Å; F316-F343 HydrophobicContact CE2-CE1 3.76Å; F316-M346 HydrophobicContact CB-CE 4.17Å; F316-M346 HydrophobicContact CB-CG 4.09Å; F316-M346 HydrophobicContact CB-SD 3.58Å; F316-M346 VanDerWaalsContact CB-SD 3.58Å; F316-M346 HydrophobicContact CD2-CE 4.23Å; F316-M346 HydrophobicContact CG-CE 4.34Å; F316-M346 HydrophobicContact CG-SD 4.06Å
317	S	87.2	Confident	91.9	Very high	49 Å²	49	32 Å²	32	34%	0.343	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	144.3	177	73.4	0	0	0	0	110.8	G314 L319	G314-S317 WeakPolarHBondContact O-CB 3.46Å; G314-S317 PolarHBondContact O-N 2.92Å; G314-S317 PolarHBondContact O-OG 3.17Å; S317-L319 PolarHBondContact O-N 3.08Å
318	G	86.6	Confident	92	Very high	58 Å²	58	31.3 Å²	31.3	60%	0.598	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	78	-9.9	-175.7	0	0	0	0	0	115.7	G296 A320	G296-G318 WeakPolarHBondContact CA-O 3.31Å; G318-A320 PolarHBondContact O-N 3.28Å
319	L	92.6	Very high	92.1	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.01	20%	0.203	C	C	.	.			trans	-76.2	49.6	173.6	-58	-175.4	0	0	0	112.5	F292 L295 L298 L301 F316 S317 H321 L322	F292-L319 HydrophobicContact CB-CD1 4.27Å; F292-L319 HydrophobicContact CB-CD2 4.09Å; L295-L319 HydrophobicContact CB-CD2 3.8Å; L295-L319 WeakPolarHBondContact O-CD2 3.48Å; L298-L319 HydrophobicContact CB-CD2 4.49Å; L298-L319 HydrophobicContact CD2-CD2 4.42Å; L301-L319 HydrophobicContact CD2-CD1 4.13Å; F316-L319 HydrophobicContact CB-CD1 4.13Å; F316-L319 HydrophobicContact CD1-CD1 3.92Å; F316-L319 WeakPolarHBondContact O-CB 3.49Å; F316-L319 WeakPolarHBondContact O-CG 3.35Å; F316-L319 PolarHBondContact O-N 3.04Å; S317-L319 PolarHBondContact O-N 3.08Å; L319-H321 PolarHBondContact O-N 2.84Å; L319-L322 HydrophobicContact CB-CB 4.13Å; L319-L322 HydrophobicContact CD1-CD2 4.14Å; L319-L322 WeakPolarHBondContact O-CB 3.18Å; L319-L322 PolarHBondContact O-N 2.6Å
320	A	88.8	Confident	92.5	Very high	50 Å²	50	31.7 Å²	31.7	41%	0.413	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-3.4	-169.4	0	0	0	0	0	115.7	G318 K348	G318-A320 PolarHBondContact O-N 3.28Å; A320-K348 WeakPolarHBondContact O-CD 3.34Å
321	H	94.1	Very high	92.8	Very high	63 Å²	63	35.5 Å²	35.5	29%	0.292	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-0.3	175.5	-72.8	89.5	0	0	0	113.8	G296 L298 L319 R323 K348	G296-H321 PolarHBondContact O-ND1 3.02Å; L298-H321 CarbonylContact O-C 3.6Å; L319-H321 PolarHBondContact O-N 2.84Å; H321-R323 PolarHBondContact O-N 3.1Å; H321-K348 PolarHBondContact CD2-NZ 2.85Å; H321-K348 PolarHBondContact NE2-NZ 3.21Å
322	L	96.8	Very high	92.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.205	C	C	.	.			trans	-67	125.4	-174.3	-160.7	73.3	0	0	0	110.7	L298 L301 L319 L325 M346 K348 L349	L298-L322 HydrophobicContact CB-CD1 4.34Å; L298-L322 HydrophobicContact CD2-CD1 4.04Å; L298-L322 HydrophobicContact CG-CD1 4.02Å; L298-L322 WeakPolarHBondContact O-CA 3.45Å; L298-L322 PolarHBondContact O-N 2.73Å; L301-L322 HydrophobicContact CB-CD1 3.75Å; L301-L322 HydrophobicContact CB-CD2 4.36Å; L319-L322 HydrophobicContact CB-CB 4.13Å; L319-L322 HydrophobicContact CD1-CD2 4.14Å; L319-L322 WeakPolarHBondContact O-CB 3.18Å; L319-L322 PolarHBondContact O-N 2.6Å; L322-L325 HydrophobicContact CD2-CB 3.96Å; L322-L325 HydrophobicContact CD2-CD1 4.26Å; L322-L325 HydrophobicContact CD2-CD2 4.34Å; L322-L325 HydrophobicContact CD2-CG 4.42Å; L322-M346 HydrophobicContact CD2-SD 3.7Å; L322-K348 CarbonylContact O-C 3.5Å; L322-K348 VanDerWaalsContact O-O 3.09Å; L322-L349 HydrophobicContact CB-CD1 4.5Å; L322-L349 HydrophobicContact CD2-CD1 4.09Å; L322-L349 HydrophobicContact CG-CD1 4.1Å; L322-L349 VanDerWaalsContact O-CA 3.24Å; L322-L349 WeakPolarHBondContact O-CA 3.28Å; L322-L349 PolarHBondContact O-N 3.44Å; L322-L349 VanDerWaalsContact O-N 3.16Å
323	R	97.6	Very high	93.1	Very high	108 Å²	108	36.5 Å²	36.5	41%	0.408	21%	0.211	S	C	.	.			trans	-108	-34.6	179.3	-55.8	179.8	-170.2	-103.1	5.9	111.9	E299 H321 K348 N350 T351	E299-R323 HydrophobicContact CB-CG 4.34Å; E299-R323 WeakPolarHBondContact O-CA 3.07Å; E299-R323 PolarHBondContact O-N 3.03Å; E299-R323 IonicContact OE1-CZ 2.72Å; E299-R323 IonicContact OE1-NE 2.59Å; E299-R323 PolarHBondContact OE1-NE 2.93Å; E299-R323 IonicContact OE1-NH2 3.83Å; E299-R323 PolarHBondContact OE1-NH2 3.09Å; E299-R323 IonicContact OE2-NE 3.55Å; E299-R323 PolarHBondContact OE2-NE 3.21Å; E299-R323 IonicContact OE2-NH2 3.2Å; H321-R323 PolarHBondContact O-N 3.1Å; R323-K348 WeakPolarHBondContact CA-O 3.34Å; R323-N350 WeakPolarHBondContact O-CA 3.38Å; R323-N350 PolarHBondContact O-N 3.27Å; R323-T351 PolarHBondContact O-N 2.86Å
324	T	98.5	Very high	93.1	Very high	47 Å²	47	31.6 Å²	31.6	29%	0.288	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	119.9	-176.5	-57.3	0	0	0	0	109.7	E299 T300 L301 T351	E299-T324 PolarHBondContact O-N 2.83Å; T300-T324 WeakPolarHBondContact CA-O 3.48Å; T300-T324 HydrophobicContact CG2-CG2 4.39Å; L301-T324 PolarHBondContact N-O 2.96Å; T324-T351 WeakPolarHBondContact CA-O 3.48Å; T324-T351 HydrophobicContact CG2-CG2 4.32Å
325	L	98.3	Very high	93	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	113	174.1	-179.9	54.9	0	0	0	109	L301 L303 F316 L322 I327 F343 M346 L349 T351 L352 N353	L301-L325 HydrophobicContact CB-CD1 4.08Å; L301-L325 HydrophobicContact CD2-CD1 3.95Å; L301-L325 HydrophobicContact CG-CD1 3.98Å; L301-L325 WeakPolarHBondContact O-CA 3.45Å; L303-L325 HydrophobicContact CD1-CD1 4.46Å; F316-L325 HydrophobicContact CD1-CD2 4.5Å; F316-L325 HydrophobicContact CD2-CD2 4.39Å; F316-L325 HydrophobicContact CE1-CD1 4.26Å; F316-L325 HydrophobicContact CE1-CD2 4.38Å; F316-L325 HydrophobicContact CE2-CD2 4.28Å; F316-L325 HydrophobicContact CZ-CD2 4.28Å; L322-L325 HydrophobicContact CD2-CB 3.96Å; L322-L325 HydrophobicContact CD2-CD1 4.26Å; L322-L325 HydrophobicContact CD2-CD2 4.34Å; L322-L325 HydrophobicContact CD2-CG 4.42Å; L325-I327 HydrophobicContact CD1-CD1 3.95Å; L325-I327 HydrophobicContact CD1-CG1 3.78Å; L325-I327 HydrophobicContact CD2-CD1 4.08Å; L325-I327 HydrophobicContact CG-CD1 3.99Å; L325-I327 HydrophobicContact CG-CG1 3.9Å; L325-F343 HydrophobicContact CD2-CD1 4.32Å; L325-F343 HydrophobicContact CD2-CE1 4.11Å; L325-M346 HydrophobicContact CD2-CE 3.67Å; L325-M346 HydrophobicContact CD2-SD 3.98Å; L325-L349 HydrophobicContact CB-CD1 3.68Å; L325-L349 HydrophobicContact CB-CD2 4.32Å; L325-T351 PolarHBondContact N-O 3.28Å; L325-L352 HydrophobicContact CB-CD1 4.17Å; L325-L352 HydrophobicContact CD2-CD1 4.08Å; L325-L352 HydrophobicContact CG-CD1 4.08Å; L325-L352 WeakPolarHBondContact O-CA 3.45Å; L325-N353 PolarHBondContact O-N 2.75Å
326	D	98.6	Very high	92.9	Very high	30 Å²	30	30.5 Å²	30.5	16%	0.16	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	118.9	174.2	-166.6	-23.9	0	0	0	110.4	L301 L303 G304 H328 N353	L301-D326 PolarHBondContact O-N 3.08Å; L303-D326 WeakPolarHBondContact CA-O 3.29Å; L303-D326 PolarHBondContact N-O 2.8Å; G304-D326 PolarHBondContact N-O 3.3Å; D326-H328 WeakPolarHBondContact OD1-CB 3.39Å; D326-H328 IonicContact OD1-CE1 3.08Å; D326-H328 IonicContact OD1-CG 3.13Å; D326-H328 PolarHBondContact OD1-N 3.32Å; D326-H328 IonicContact OD1-ND1 2.62Å; D326-H328 PolarHBondContact OD1-ND1 2.74Å; D326-H328 IonicContact OD2-CE1 2.69Å; D326-H328 IonicContact OD2-ND1 2.64Å; D326-H328 PolarHBondContact OD2-ND1 2.84Å; D326-H328 VanDerWaalsContact OD2-ND1 3.12Å; D326-N353 HydrophobicContact CB-CB 4.23Å; D326-N353 VanDerWaalsContact CG-ND2 3.26Å; D326-N353 PolarHBondContact OD1-ND2 2.96Å; D326-N353 VanDerWaalsContact OD1-ND2 3.14Å; D326-N353 PolarHBondContact OD2-ND2 3.03Å
327	I	97.3	Very high	92.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.177	C	C	.	.			trans	-130.5	34.4	173.9	-31.4	177.6	0	0	0	110.4	L303 I308 F316 L325 N330 I332 N353 L354 N357	L303-I327 HydrophobicContact CB-CB 4.49Å; L303-I327 HydrophobicContact CB-CG1 4.37Å; L303-I327 HydrophobicContact CB-CG2 3.96Å; L303-I327 HydrophobicContact CD1-CD1 4.43Å; L303-I327 HydrophobicContact CD1-CG1 4.37Å; I308-I327 HydrophobicContact CD1-CG2 4.12Å; F316-I327 HydrophobicContact CE1-CD1 4.48Å; F316-I327 HydrophobicContact CE2-CD1 4.14Å; F316-I327 HydrophobicContact CZ-CD1 3.61Å; L325-I327 HydrophobicContact CD1-CD1 3.95Å; L325-I327 HydrophobicContact CD1-CG1 3.78Å; L325-I327 HydrophobicContact CD2-CD1 4.08Å; L325-I327 HydrophobicContact CG-CD1 3.99Å; L325-I327 HydrophobicContact CG-CG1 3.9Å; I327-N330 HydrophobicContact CG2-CB 4.36Å; I327-N330 PolarHBondContact O-ND2 2.84Å; I327-I332 HydrophobicContact CB-CD1 4.09Å; I327-I332 HydrophobicContact CD1-CD1 4.41Å; I327-I332 HydrophobicContact CG2-CD1 3.55Å; I327-N353 CarbonylContact C-O 3.57Å; I327-N353 PolarHBondContact N-O 2.86Å; I327-L354 HydrophobicContact CB-CD2 4.5Å; I327-N357 PolarHBondContact O-ND2 2.79Å
328	H	98.1	Very high	92.4	Very high	32 Å²	32	29 Å²	29	15%	0.148	16%	0.164	C	C	.	.			trans	-64.8	159.6	179.2	77.7	-90.2	0	0	0	113.4	G304 E305 D326 N330 N353 Q355	G304-H328 CarbonylContact C-O 3.57Å; G304-H328 WeakPolarHBondContact CA-O 3.21Å; E305-H328 PolarHBondContact N-O 2.92Å; D326-H328 WeakPolarHBondContact OD1-CB 3.39Å; D326-H328 IonicContact OD1-CE1 3.08Å; D326-H328 IonicContact OD1-CG 3.13Å; D326-H328 PolarHBondContact OD1-N 3.32Å; D326-H328 IonicContact OD1-ND1 2.62Å; D326-H328 PolarHBondContact OD1-ND1 2.74Å; D326-H328 IonicContact OD2-CE1 2.69Å; D326-H328 IonicContact OD2-ND1 2.64Å; D326-H328 PolarHBondContact OD2-ND1 2.84Å; D326-H328 VanDerWaalsContact OD2-ND1 3.12Å; H328-N330 VanDerWaalsContact C-N 3.34Å; H328-N330 PolarHBondContact O-N 2.89Å; H328-N330 PolarHBondContact O-ND2 3.08Å; H328-N353 PolarHBondContact N-O 3.4Å; H328-Q355 CarbonylContact C-O 3.53Å; H328-Q355 WeakPolarHBondContact CA-O 3.37Å; H328-Q355 HydrophobicContact CB-CB 4.18Å; H328-Q355 WeakPolarHBondContact CB-O 3.2Å
329	N	98	Very high	91.7	Very high	53 Å²	53	29.9 Å²	29.9	28%	0.283	16%	0.162	S	C	.	.	S	Bend	trans	47.6	52	178.2	-154.8	51.3	0	0	0	113.5	E305 Q355 R356	E305-N329 VanDerWaalsContact CD-ND2 3.28Å; E305-N329 HydrophobicContact CG-CB 4.1Å; E305-N329 PolarHBondContact OE2-ND2 3.13Å; N329-Q355 PolarHBondContact N-O 3.12Å; N329-R356 HydrophobicContact CB-CB 4.11Å; N329-R356 WeakPolarHBondContact OD1-CB 3.09Å; N329-R356 WeakPolarHBondContact OD1-CD 3.48Å
330	N	98	Very high	90.9	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.021	17%	0.166	C	C	.	.	S	Bend	trans	-118.8	-167.6	173.4	-87	-79.1	0	0	0	109.8	L303 N306 S307 I308 I327 H328 I332 N357	L303-N330 PolarHBondContact O-ND2 2.9Å; N306-N330 WeakPolarHBondContact CA-OD1 3.25Å; N306-N330 WeakPolarHBondContact CB-OD1 3.49Å; S307-N330 PolarHBondContact N-OD1 2.72Å; I308-N330 HydrophobicContact CB-CB 4.28Å; I308-N330 VanDerWaalsContact CB-OD1 3.28Å; I308-N330 WeakPolarHBondContact CB-OD1 3.47Å; I308-N330 WeakPolarHBondContact CG1-OD1 3.37Å; I308-N330 PolarHBondContact N-OD1 3.36Å; I327-N330 HydrophobicContact CG2-CB 4.36Å; I327-N330 PolarHBondContact O-ND2 2.84Å; H328-N330 VanDerWaalsContact C-N 3.34Å; H328-N330 PolarHBondContact O-N 2.89Å; H328-N330 PolarHBondContact O-ND2 3.08Å; N330-I332 HydrophobicContact CB-CD1 4.43Å; N330-I332 HydrophobicContact CB-CG1 4.35Å; N330-N357 VanDerWaalsContact CA-OD1 3.32Å; N330-N357 WeakPolarHBondContact CA-OD1 3.18Å; N330-N357 WeakPolarHBondContact CB-OD1 3.44Å; N330-N357 PolarHBondContact N-OD1 2.94Å; N330-N357 PolarHBondContact O-OD1 3.27Å
331	E	95.1	Very high	90.6	Very high	95 Å²	95	29.6 Å²	29.6	44%	0.444	16%	0.156	S	C	.	.			trans	-108.9	18.3	-178.1	-61.1	-162.8	167.8	0	0	113.4	I308 S333	I308-E331 CarbonylContact O-C 3.57Å; I308-E331 VanDerWaalsContact O-C 3.27Å; I308-E331 VanDerWaalsContact O-CA 3.32Å; I308-E331 WeakPolarHBondContact O-CA 3.44Å; I308-E331 PolarHBondContact O-N 3.37Å; E331-S333 PolarHBondContact O-N 2.86Å
332	I	92.6	Very high	90.3	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.005	14%	0.144	C	C	.	.			trans	-64.9	132.4	-175.4	-59.1	167.4	0	0	0	110.5	I308 L311 I327 N330 A335 I336 L354 N357 K358 I359	I308-I332 HydrophobicContact CG2-CG1 4.47Å; I308-I332 WeakPolarHBondContact O-CG1 3.43Å; I308-I332 PolarHBondContact O-N 3.12Å; L311-I332 HydrophobicContact CD1-CD1 3.92Å; L311-I332 HydrophobicContact CD1-CG1 4.34Å; L311-I332 HydrophobicContact CD1-CG2 4.43Å; I327-I332 HydrophobicContact CB-CD1 4.09Å; I327-I332 HydrophobicContact CD1-CD1 4.41Å; I327-I332 HydrophobicContact CG2-CD1 3.55Å; N330-I332 HydrophobicContact CB-CD1 4.43Å; N330-I332 HydrophobicContact CB-CG1 4.35Å; I332-A335 HydrophobicContact CG2-CB 4.19Å; I332-I336 HydrophobicContact CG2-CG1 4.06Å; I332-L354 HydrophobicContact CD1-CD2 4.42Å; I332-N357 HydrophobicContact CB-CB 4.24Å; I332-N357 WeakPolarHBondContact CB-OD1 3.31Å; I332-N357 PolarHBondContact N-OD1 3.26Å; I332-N357 VanDerWaalsContact N-OD1 3.1Å; I332-K358 CarbonylContact O-C 3.15Å; I332-K358 WeakPolarHBondContact O-CA 3.41Å; I332-K358 PolarHBondContact O-N 3.06Å; I332-I359 PolarHBondContact O-N 3.28Å
333	S	88.9	Confident	89.9	Confident	30 Å²	30	26.9 Å²	26.9	21%	0.21	14%	0.144	C	C	.	.			trans	-141.7	-74	171.8	45.4	0	0	0	0	109.9	E331 A335 I336 E337 K358	E331-S333 PolarHBondContact O-N 2.86Å; S333-A335 VanDerWaalsContact C-N 3.29Å; S333-A335 PolarHBondContact O-N 3.34Å; S333-A335 VanDerWaalsContact O-N 3.15Å; S333-I336 PolarHBondContact O-N 2.94Å; S333-E337 WeakPolarHBondContact O-CG 3.34Å; S333-E337 PolarHBondContact O-N 3.2Å; S333-E337 VanDerWaalsContact O-N 3.13Å; S333-K358 WeakPolarHBondContact CB-O 3.26Å
334	W	82.3	Confident	89.3	Confident	14 Å²	14	26.2 Å²	26.2	5%	0.053	15%	0.149	C	C	.	.	H	α-helix	trans	-57.5	-32.1	-171.4	67.7	-87.3	0	0	0	114.9	S309 H310 L311 I336 E337 D338 I340 R495 Y548	S309-W334 PolarHBondContact O-NE1 2.96Å; H310-W334 HydrophobicContact CB-CZ2 4.21Å; H310-W334 AromaticContact CE1-CZ2 3.88Å; H310-W334 AromaticContact CG-CZ2 3.75Å; H310-W334 AromaticContact ND1-CZ2 3.54Å; L311-W334 WeakPolarHBondContact O-CH2 3.49Å; W334-I336 PolarHBondContact O-N 2.74Å; W334-E337 PolarHBondContact O-N 3.1Å; W334-D338 WeakPolarHBondContact O-CB 3.37Å; W334-D338 PolarHBondContact O-N 3.27Å; W334-I340 HydrophobicContact CE3-CD1 3.97Å; W334-I340 HydrophobicContact CZ3-CD1 3.53Å; W334-R495 VanDerWaalsContact CD2-NH1 3.34Å; W334-R495 VanDerWaalsContact CE2-NH1 3.34Å; W334-Y548 WeakPolarHBondContact CA-OH 3.41Å; W334-Y548 HydrophobicContact CB-CE1 3.57Å; W334-Y548 WeakPolarHBondContact CB-OH 3.22Å
335	A	82.3	Confident	88.4	Confident	2 Å²	2	25.6 Å²	25.6	2%	0.017	15%	0.152	C	C	.	.	H	α-helix	trans	-62.3	-15.8	177.5	0	0	0	0	0	113.7	L311 I332 S333 V342	L311-A335 HydrophobicContact CB-CB 4.15Å; L311-A335 HydrophobicContact CD1-CB 4.02Å; L311-A335 HydrophobicContact CG-CB 4.46Å; I332-A335 HydrophobicContact CG2-CB 4.19Å; S333-A335 VanDerWaalsContact C-N 3.29Å; S333-A335 PolarHBondContact O-N 3.34Å; S333-A335 VanDerWaalsContact O-N 3.15Å; A335-V342 HydrophobicContact CB-CG1 4.3Å; A335-V342 HydrophobicContact CB-CG2 4.4Å; A335-V342 WeakPolarHBondContact O-CG1 3.46Å
336	I	87.7	Confident	87.9	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-112.1	-26.1	177.3	-50.4	-58.7	0	0	0	111.6	I332 S333 W334 V342 F343 L354 I359 I362 T363 A366	I332-I336 HydrophobicContact CG2-CG1 4.06Å; S333-I336 PolarHBondContact O-N 2.94Å; W334-I336 PolarHBondContact O-N 2.74Å; I336-V342 HydrophobicContact CD1-CG1 4.26Å; I336-F343 HydrophobicContact CD1-CD2 4.4Å; I336-F343 HydrophobicContact CD1-CE2 3.42Å; I336-F343 VanDerWaalsContact CD1-CE2 3.42Å; I336-F343 HydrophobicContact CD1-CZ 3.82Å; I336-L354 HydrophobicContact CD1-CD1 4.29Å; I336-I359 HydrophobicContact CB-CD1 4.27Å; I336-I359 HydrophobicContact CB-CG1 4.2Å; I336-I359 HydrophobicContact CB-CG2 4.01Å; I336-I359 HydrophobicContact CG1-CD1 3.82Å; I336-I359 HydrophobicContact CG1-CG1 4.09Å; I336-I359 HydrophobicContact CG2-CD1 4.28Å; I336-I359 HydrophobicContact CG2-CG2 3.69Å; I336-I362 HydrophobicContact CG2-CG1 4.16Å; I336-T363 PolarHBondContact O-N 2.9Å; I336-A366 HydrophobicContact CG2-CB 4Å
337	E	87.3	Confident	87.3	Confident	6 Å²	6	30.2 Å²	30.2	3%	0.028	17%	0.171	C	C	.	.	H	α-helix	trans	-89.3	-19.4	179	-59.8	176.5	-178	0	0	114.4	S333 W334 K360 S361 T363 S546 Y548	S333-E337 WeakPolarHBondContact O-CG 3.34Å; S333-E337 PolarHBondContact O-N 3.2Å; S333-E337 VanDerWaalsContact O-N 3.13Å; W334-E337 PolarHBondContact O-N 3.1Å; E337-K360 VanDerWaalsContact OE1-CB 3.31Å; E337-K360 WeakPolarHBondContact OE1-CB 3.42Å; E337-K360 PolarHBondContact OE1-N 3.28Å; E337-S361 WeakPolarHBondContact CG-O 3.49Å; E337-T363 VanDerWaalsContact C-CG2 3.46Å; E337-T363 WeakPolarHBondContact O-CG2 3.43Å; E337-S546 WeakPolarHBondContact OE2-CB 2.98Å; E337-Y548 HydrophobicContact CB-CD2 4.37Å; E337-Y548 HydrophobicContact CB-CE2 3.46Å; E337-Y548 VanDerWaalsContact CB-CE2 3.46Å; E337-Y548 WeakPolarHBondContact O-CD2 3.42Å; E337-Y548 PolarHBondContact OE2-OH 3.26Å
338	D	80.6	Confident	87.2	Confident	13 Å²	13	34 Å²	34	7%	0.07	19%	0.187	C	C	.	.	S	Bend	trans	-85.1	164.4	168.4	-162.8	0.8	0	0	0	109.4	W334 I340 T363 Q537 Y548	W334-D338 WeakPolarHBondContact O-CB 3.37Å; W334-D338 PolarHBondContact O-N 3.27Å; D338-I340 HydrophobicContact CB-CD1 3.93Å; D338-I340 HydrophobicContact CB-CG1 4.02Å; D338-I340 PolarHBondContact O-N 2.7Å; D338-I340 VanDerWaalsContact O-N 3.14Å; D338-I340 WeakPolarHBondContact OD2-CD1 3.49Å; D338-T363 WeakPolarHBondContact O-CG2 3.37Å; D338-T363 PolarHBondContact O-OG1 2.85Å; D338-Q537 PolarHBondContact OD1-NE2 2.01Å; D338-Q537 PolarHBondContact OD2-NE2 2.88Å; D338-Q537 PolarHBondContact OD2-OE1 2.87Å; D338-Y548 HydrophobicContact CB-CD1 4.24Å; D338-Y548 HydrophobicContact CB-CD2 4.39Å; D338-Y548 HydrophobicContact CB-CG 4.13Å
339	S	72.8	Confident	87.1	Confident	77 Å²	77	32.4 Å²	32.4	54%	0.538	18%	0.18	S	C	.	.	S	Bend	trans	-86	32.6	-178.5	-58.2	0	0	0	0	112.8	K365	S339-K365 WeakPolarHBondContact O-CD 3.24Å
340	I	76.1	Confident	87	Confident	18 Å²	18	31.9 Å²	31.9	9%	0.092	18%	0.177	C	C	.	.			trans	-92.3	127.2	179.4	-49.5	162.5	0	0	0	108.3	E313 W334 D338 V342	E313-I340 HydrophobicContact CG-CG2 4.35Å; W334-I340 HydrophobicContact CE3-CD1 3.97Å; W334-I340 HydrophobicContact CZ3-CD1 3.53Å; D338-I340 HydrophobicContact CB-CD1 3.93Å; D338-I340 HydrophobicContact CB-CG1 4.02Å; D338-I340 PolarHBondContact O-N 2.7Å; D338-I340 VanDerWaalsContact O-N 3.14Å; D338-I340 WeakPolarHBondContact OD2-CD1 3.49Å; I340-V342 HydrophobicContact CG2-CB 4.5Å; I340-V342 PolarHBondContact O-N 2.75Å
341	A	82.7	Confident	87.1	Confident	27 Å²	27	33.2 Å²	33.2	22%	0.223	19%	0.185	C	C	.	.			trans	-79.4	67.4	169.4	0	0	0	0	0	110.1	F343 D344 E368	A341-F343 PolarHBondContact O-N 3.03Å; A341-D344 HydrophobicContact CB-CB 3.97Å; A341-D344 WeakPolarHBondContact O-CB 3.42Å; A341-D344 PolarHBondContact O-N 2.78Å; A341-E368 HydrophobicContact CB-CB 4.02Å
342	V	86.8	Confident	87.2	Confident	5 Å²	5	28.8 Å²	28.8	3%	0.03	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-19.1	-176.3	70.4	0	0	0	0	113.3	L311 V315 A335 I336 I340	L311-V342 HydrophobicContact CB-CG2 3.93Å; L311-V342 HydrophobicContact CD1-CG2 4.26Å; V315-V342 HydrophobicContact CG1-CG2 4.21Å; A335-V342 HydrophobicContact CB-CG1 4.3Å; A335-V342 HydrophobicContact CB-CG2 4.4Å; A335-V342 WeakPolarHBondContact O-CG1 3.46Å; I336-V342 HydrophobicContact CD1-CG1 4.26Å; I340-V342 HydrophobicContact CG2-CB 4.5Å; I340-V342 PolarHBondContact O-N 2.75Å
343	F	88.4	Confident	87.5	Confident	1 Å²	1	30 Å²	30	0%	0.004	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	7.2	179	-58	-49.5	0	0	0	114.6	F316 L325 I336 A341 M346 L352 L354 A366 F367 L370	F316-F343 AromaticContact CD2-CD1 3.81Å; F316-F343 HydrophobicContact CD2-CD1 3.81Å; F316-F343 HydrophobicContact CD2-CE1 4.09Å; F316-F343 AromaticContact CE2-CD1 3.97Å; F316-F343 HydrophobicContact CE2-CD1 3.97Å; F316-F343 AromaticContact CE2-CE1 3.76Å; F316-F343 HydrophobicContact CE2-CE1 3.76Å; L325-F343 HydrophobicContact CD2-CD1 4.32Å; L325-F343 HydrophobicContact CD2-CE1 4.11Å; I336-F343 HydrophobicContact CD1-CD2 4.4Å; I336-F343 HydrophobicContact CD1-CE2 3.42Å; I336-F343 VanDerWaalsContact CD1-CE2 3.42Å; I336-F343 HydrophobicContact CD1-CZ 3.82Å; A341-F343 PolarHBondContact O-N 3.03Å; F343-M346 HydrophobicContact CB-CE 3.52Å; F343-M346 HydrophobicContact CD1-CE 3.38Å; F343-M346 HydrophobicContact CE1-CE 4.38Å; F343-M346 HydrophobicContact CG-CE 3.78Å; F343-M346 WeakPolarHBondContact O-CB 3.49Å; F343-M346 PolarHBondContact O-N 2.69Å; F343-L352 HydrophobicContact CD2-CD2 4.14Å; F343-L352 HydrophobicContact CE2-CD2 3.84Å; F343-L352 HydrophobicContact CZ-CD1 4.27Å; F343-L352 HydrophobicContact CZ-CD2 4.23Å; F343-L354 HydrophobicContact CE2-CD1 4.19Å; F343-L354 HydrophobicContact CZ-CD1 4.23Å; F343-L354 HydrophobicContact CZ-CD2 4.26Å; F343-A366 WeakPolarHBondContact CD2-O 3.48Å; F343-F367 HydrophobicContact CD2-CD1 4.1Å; F343-F367 HydrophobicContact CD2-CE1 4.46Å; F343-F367 HydrophobicContact CE2-CD1 4.21Å; F343-F367 HydrophobicContact CE2-CE1 4.11Å; F343-L370 HydrophobicContact CB-CD1 4Å; F343-L370 HydrophobicContact CB-CD2 4.04Å; F343-L370 HydrophobicContact CB-CG 4.18Å; F343-L370 HydrophobicContact CD2-CD1 4.18Å; F343-L370 HydrophobicContact CG-CD1 4.36Å
344	D	84.6	Confident	87.9	Confident	94 Å²	94	28.6 Å²	28.6	50%	0.503	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	149.2	178.8	-173.8	28.1	0	0	0	111.9	A341 M346	A341-D344 HydrophobicContact CB-CB 3.97Å; A341-D344 WeakPolarHBondContact O-CB 3.42Å; A341-D344 PolarHBondContact O-N 2.78Å; D344-M346 VanDerWaalsContact C-N 3.28Å; D344-M346 PolarHBondContact O-N 3.41Å
345	G	79.4	Confident	88.6	Confident	34 Å²	34	29.6 Å²	29.6	35%	0.351	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	-15.3	-176.1	0	0	0	0	0	115.4	K347	G345-K347 PolarHBondContact O-N 3.4Å
346	M	88.3	Confident	89.2	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.183	C	C	.	.			trans	-80.5	53.3	179	-66.1	-160.8	-65.2	0	0	113.7	F316 L322 L325 F343 D344 K348 L349 L370	F316-M346 HydrophobicContact CB-CE 4.17Å; F316-M346 HydrophobicContact CB-CG 4.09Å; F316-M346 HydrophobicContact CB-SD 3.58Å; F316-M346 VanDerWaalsContact CB-SD 3.58Å; F316-M346 HydrophobicContact CD2-CE 4.23Å; F316-M346 HydrophobicContact CG-CE 4.34Å; F316-M346 HydrophobicContact CG-SD 4.06Å; L322-M346 HydrophobicContact CD2-SD 3.7Å; L325-M346 HydrophobicContact CD2-CE 3.67Å; L325-M346 HydrophobicContact CD2-SD 3.98Å; F343-M346 HydrophobicContact CB-CE 3.52Å; F343-M346 HydrophobicContact CD1-CE 3.38Å; F343-M346 HydrophobicContact CE1-CE 4.38Å; F343-M346 HydrophobicContact CG-CE 3.78Å; F343-M346 WeakPolarHBondContact O-CB 3.49Å; F343-M346 PolarHBondContact O-N 2.69Å; D344-M346 VanDerWaalsContact C-N 3.28Å; D344-M346 PolarHBondContact O-N 3.41Å; M346-K348 PolarHBondContact O-N 2.76Å; M346-L349 HydrophobicContact CB-CB 4.24Å; M346-L349 HydrophobicContact CE-CD2 3.95Å; M346-L349 VanDerWaalsContact O-CB 3.31Å; M346-L349 WeakPolarHBondContact O-CB 3.32Å; M346-L349 PolarHBondContact O-N 2.91Å; M346-L349 VanDerWaalsContact O-N 3.08Å; M346-L370 HydrophobicContact CB-CD2 3.89Å; M346-L370 HydrophobicContact CE-CD2 4.32Å
347	K	87.1	Confident	89.6	Confident	129 Å²	129	34.2 Å²	34.2	56%	0.561	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-15.8	-169.1	-57.9	-170.1	179.9	-165.3	0	116.1	G345 E372	G345-K347 PolarHBondContact O-N 3.4Å; K347-E372 WeakPolarHBondContact O-CB 3.42Å; K347-E372 WeakPolarHBondContact O-CG 3.26Å
348	K	93.6	Very high	89.9	Confident	78 Å²	78	39.2 Å²	39.2	34%	0.339	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	9.4	179.5	-64.8	-171.8	-173.8	169.7	0	113.5	A320 H321 L322 R323 M346 N350	A320-K348 WeakPolarHBondContact O-CD 3.34Å; H321-K348 PolarHBondContact CD2-NZ 2.85Å; H321-K348 PolarHBondContact NE2-NZ 3.21Å; L322-K348 CarbonylContact O-C 3.5Å; L322-K348 VanDerWaalsContact O-O 3.09Å; R323-K348 WeakPolarHBondContact CA-O 3.34Å; M346-K348 PolarHBondContact O-N 2.76Å; K348-N350 PolarHBondContact O-N 3.36Å; K348-N350 PolarHBondContact O-OD1 3.43Å
349	L	96.3	Very high	90.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.202	C	C	.	.			trans	-72.7	117	-177.1	-167.9	74.5	0	0	0	109.7	L322 L325 M346 L352 L370 E372 L373	L322-L349 HydrophobicContact CB-CD1 4.5Å; L322-L349 HydrophobicContact CD2-CD1 4.09Å; L322-L349 HydrophobicContact CG-CD1 4.1Å; L322-L349 VanDerWaalsContact O-CA 3.24Å; L322-L349 WeakPolarHBondContact O-CA 3.28Å; L322-L349 PolarHBondContact O-N 3.44Å; L322-L349 VanDerWaalsContact O-N 3.16Å; L325-L349 HydrophobicContact CB-CD1 3.68Å; L325-L349 HydrophobicContact CB-CD2 4.32Å; M346-L349 HydrophobicContact CB-CB 4.24Å; M346-L349 HydrophobicContact CE-CD2 3.95Å; M346-L349 VanDerWaalsContact O-CB 3.31Å; M346-L349 WeakPolarHBondContact O-CB 3.32Å; M346-L349 PolarHBondContact O-N 2.91Å; M346-L349 VanDerWaalsContact O-N 3.08Å; L349-L352 HydrophobicContact CD2-CB 4.07Å; L349-L352 HydrophobicContact CD2-CD1 4.41Å; L349-L352 HydrophobicContact CD2-CD2 4.49Å; L349-L370 HydrophobicContact CB-CD2 4.13Å; L349-L370 HydrophobicContact CD2-CD1 4.29Å; L349-L370 HydrophobicContact CD2-CD2 3.91Å; L349-E372 CarbonylContact O-C 2.97Å; L349-L373 HydrophobicContact CD2-CD1 4.12Å; L349-L373 HydrophobicContact CG-CD1 4.13Å; L349-L373 WeakPolarHBondContact O-CA 3.48Å; L349-L373 PolarHBondContact O-N 3.12Å
350	N	97.3	Very high	91.4	Very high	42 Å²	42	38.3 Å²	38.3	23%	0.225	19%	0.191	C	C	.	.			trans	-94.9	-37.7	179.1	-72.1	14.1	0	0	0	111.9	R323 K348 K374 E375	R323-N350 WeakPolarHBondContact O-CA 3.38Å; R323-N350 PolarHBondContact O-N 3.27Å; K348-N350 PolarHBondContact O-N 3.36Å; K348-N350 PolarHBondContact O-OD1 3.43Å; N350-K374 HydrophobicContact CB-CD 4.21Å; N350-K374 WeakPolarHBondContact O-CA 3.32Å; N350-K374 PolarHBondContact O-N 2.88Å; N350-E375 PolarHBondContact O-N 3.18Å
351	T	98.4	Very high	92.1	Very high	32 Å²	32	37.6 Å²	37.6	20%	0.196	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	122.7	-172.7	-59.8	0	0	0	0	110.7	R323 T324 L325 E375	R323-T351 PolarHBondContact O-N 2.86Å; T324-T351 WeakPolarHBondContact CA-O 3.48Å; T324-T351 HydrophobicContact CG2-CG2 4.32Å; L325-T351 PolarHBondContact N-O 3.28Å; T351-E375 WeakPolarHBondContact CA-O 3.39Å; T351-E375 HydrophobicContact CG2-CB 4.01Å; T351-E375 VanDerWaalsContact CG2-OE2 3.3Å; T351-E375 WeakPolarHBondContact CG2-OE2 3.31Å; T351-E375 PolarHBondContact OG1-OE2 3.14Å
352	L	98	Very high	92.6	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	114	176.3	178.8	56	0	0	0	110.5	L325 F343 L349 L354 F367 L370 L373 E375 L376 D377	L325-L352 HydrophobicContact CB-CD1 4.17Å; L325-L352 HydrophobicContact CD2-CD1 4.08Å; L325-L352 HydrophobicContact CG-CD1 4.08Å; L325-L352 WeakPolarHBondContact O-CA 3.45Å; F343-L352 HydrophobicContact CD2-CD2 4.14Å; F343-L352 HydrophobicContact CE2-CD2 3.84Å; F343-L352 HydrophobicContact CZ-CD1 4.27Å; F343-L352 HydrophobicContact CZ-CD2 4.23Å; L349-L352 HydrophobicContact CD2-CB 4.07Å; L349-L352 HydrophobicContact CD2-CD1 4.41Å; L349-L352 HydrophobicContact CD2-CD2 4.49Å; L352-L354 HydrophobicContact CD1-CD1 4.42Å; L352-L354 HydrophobicContact CD1-CD2 4.46Å; L352-L354 HydrophobicContact CD1-CG 4.1Å; L352-L354 HydrophobicContact CD2-CD1 4.04Å; L352-L354 HydrophobicContact CG-CD1 4.12Å; L352-L354 HydrophobicContact CG-CG 4.11Å; L352-F367 HydrophobicContact CD2-CD1 4.04Å; L352-F367 HydrophobicContact CD2-CE1 3.96Å; L352-L370 HydrophobicContact CD2-CD1 3.92Å; L352-L373 HydrophobicContact CB-CD1 3.79Å; L352-L373 HydrophobicContact CB-CD2 4.42Å; L352-E375 PolarHBondContact N-O 3.2Å; L352-L376 HydrophobicContact CB-CD1 4.16Å; L352-L376 HydrophobicContact CD2-CD1 4.04Å; L352-L376 HydrophobicContact CG-CD1 4.07Å; L352-L376 WeakPolarHBondContact O-CA 3.49Å; L352-D377 PolarHBondContact O-N 3.33Å
353	N	98.3	Very high	92.9	Very high	28 Å²	28	37.4 Å²	37.4	15%	0.15	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	111.5	177	-177.7	8.1	0	0	0	110.9	L325 D326 I327 H328 Q355	L325-N353 PolarHBondContact O-N 2.75Å; D326-N353 HydrophobicContact CB-CB 4.23Å; D326-N353 VanDerWaalsContact CG-ND2 3.26Å; D326-N353 PolarHBondContact OD1-ND2 2.96Å; D326-N353 VanDerWaalsContact OD1-ND2 3.14Å; D326-N353 PolarHBondContact OD2-ND2 3.03Å; I327-N353 CarbonylContact C-O 3.57Å; I327-N353 PolarHBondContact N-O 2.86Å; H328-N353 PolarHBondContact N-O 3.4Å; N353-Q355 VanDerWaalsContact OD1-CB 3.25Å; N353-Q355 WeakPolarHBondContact OD1-CB 3.15Å; N353-Q355 PolarHBondContact OD1-N 3.1Å; N353-Q355 VanDerWaalsContact OD1-N 3.08Å
354	L	97.3	Very high	93	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.204	C	C	.	.			trans	-116.6	16.4	177	-70.3	170.4	0	0	0	111.9	I327 I332 I336 F343 L352 N357 I359 F367 D377 L378 N381	I327-L354 HydrophobicContact CB-CD2 4.5Å; I332-L354 HydrophobicContact CD1-CD2 4.42Å; I336-L354 HydrophobicContact CD1-CD1 4.29Å; F343-L354 HydrophobicContact CE2-CD1 4.19Å; F343-L354 HydrophobicContact CZ-CD1 4.23Å; F343-L354 HydrophobicContact CZ-CD2 4.26Å; L352-L354 HydrophobicContact CD1-CD1 4.42Å; L352-L354 HydrophobicContact CD1-CD2 4.46Å; L352-L354 HydrophobicContact CD1-CG 4.1Å; L352-L354 HydrophobicContact CD2-CD1 4.04Å; L352-L354 HydrophobicContact CG-CD1 4.12Å; L352-L354 HydrophobicContact CG-CG 4.11Å; L354-N357 PolarHBondContact O-ND2 2.87Å; L354-I359 HydrophobicContact CB-CD1 4.17Å; L354-I359 HydrophobicContact CD1-CD1 4.27Å; L354-F367 HydrophobicContact CD1-CE1 3.98Å; L354-F367 HydrophobicContact CD1-CZ 4.43Å; L354-D377 CarbonylContact C-O 3.43Å; L354-D377 WeakPolarHBondContact CA-O 3.34Å; L354-D377 PolarHBondContact N-O 3.42Å; L354-L378 HydrophobicContact CB-CD2 4.13Å; L354-L378 HydrophobicContact CD1-CD2 4.1Å; L354-N381 PolarHBondContact O-ND2 2.85Å
355	Q	96.8	Very high	93.2	Very high	34 Å²	34	41 Å²	41	16%	0.159	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	145.1	-176.5	-159.9	-164.6	111.6	0	0	112	H328 N329 N353 N357 D377 G379	H328-Q355 CarbonylContact C-O 3.53Å; H328-Q355 WeakPolarHBondContact CA-O 3.37Å; H328-Q355 HydrophobicContact CB-CB 4.18Å; H328-Q355 WeakPolarHBondContact CB-O 3.2Å; N329-Q355 PolarHBondContact N-O 3.12Å; N353-Q355 VanDerWaalsContact OD1-CB 3.25Å; N353-Q355 WeakPolarHBondContact OD1-CB 3.15Å; N353-Q355 PolarHBondContact OD1-N 3.1Å; N353-Q355 VanDerWaalsContact OD1-N 3.08Å; Q355-N357 VanDerWaalsContact C-N 3.27Å; Q355-N357 PolarHBondContact O-N 3.24Å; Q355-D377 PolarHBondContact N-O 3.01Å; Q355-D377 PolarHBondContact NE2-OD2 2.78Å; Q355-G379 CarbonylContact C-O 3.49Å; Q355-G379 VanDerWaalsContact CA-O 3.31Å; Q355-G379 WeakPolarHBondContact CA-O 3.1Å; Q355-G379 WeakPolarHBondContact CG-O 3.38Å
356	R	96.4	Very high	93.8	Very high	95 Å²	95	39.4 Å²	39.4	36%	0.358	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	21.6	176.8	-58.5	-178.3	173.8	104	-19.1	116.3	N329 G379 K380	N329-R356 HydrophobicContact CB-CB 4.11Å; N329-R356 WeakPolarHBondContact OD1-CB 3.09Å; N329-R356 WeakPolarHBondContact OD1-CD 3.48Å; R356-G379 PolarHBondContact N-O 3.26Å; R356-K380 HydrophobicContact CG-CB 3.99Å; R356-K380 HydrophobicContact CG-CD 3.7Å; R356-K380 HydrophobicContact CG-CG 4.5Å
357	N	96.4	Very high	93.9	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.021	18%	0.18	C	C	.	.	S	Bend	trans	-79.6	-163.1	168.3	-81.8	-77.4	0	0	0	111.3	I327 N330 I332 L354 Q355 I359 N381	I327-N357 PolarHBondContact O-ND2 2.79Å; N330-N357 VanDerWaalsContact CA-OD1 3.32Å; N330-N357 WeakPolarHBondContact CA-OD1 3.18Å; N330-N357 WeakPolarHBondContact CB-OD1 3.44Å; N330-N357 PolarHBondContact N-OD1 2.94Å; N330-N357 PolarHBondContact O-OD1 3.27Å; I332-N357 HydrophobicContact CB-CB 4.24Å; I332-N357 WeakPolarHBondContact CB-OD1 3.31Å; I332-N357 PolarHBondContact N-OD1 3.26Å; I332-N357 VanDerWaalsContact N-OD1 3.1Å; L354-N357 PolarHBondContact O-ND2 2.87Å; Q355-N357 VanDerWaalsContact C-N 3.27Å; Q355-N357 PolarHBondContact O-N 3.24Å; N357-I359 HydrophobicContact CB-CD1 4.19Å; N357-I359 HydrophobicContact CB-CG1 4.19Å; N357-N381 WeakPolarHBondContact CA-OD1 3.06Å; N357-N381 WeakPolarHBondContact CB-OD1 3.17Å; N357-N381 PolarHBondContact N-OD1 2.88Å; N357-N381 PolarHBondContact O-OD1 3.38Å
358	K	92.8	Very high	94	Very high	112 Å²	112	37 Å²	37	49%	0.487	17%	0.17	S	C	.	.			trans	-112.1	21	-177.7	-52.1	-57.8	177.5	-155.1	0	113.1	I332 S333 K360 N381	I332-K358 CarbonylContact O-C 3.15Å; I332-K358 WeakPolarHBondContact O-CA 3.41Å; I332-K358 PolarHBondContact O-N 3.06Å; S333-K358 WeakPolarHBondContact CB-O 3.26Å; K358-K360 PolarHBondContact O-N 3.2Å; K358-N381 PolarHBondContact N-OD1 3.35Å
359	I	93	Very high	93.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.16	C	C	.	.			trans	-71.9	112.5	-172	-55.2	162.7	0	0	0	110.7	I332 I336 L354 N357 S361 I362 L378 N381 I383	I332-I359 PolarHBondContact O-N 3.28Å; I336-I359 HydrophobicContact CB-CD1 4.27Å; I336-I359 HydrophobicContact CB-CG1 4.2Å; I336-I359 HydrophobicContact CB-CG2 4.01Å; I336-I359 HydrophobicContact CG1-CD1 3.82Å; I336-I359 HydrophobicContact CG1-CG1 4.09Å; I336-I359 HydrophobicContact CG2-CD1 4.28Å; I336-I359 HydrophobicContact CG2-CG2 3.69Å; L354-I359 HydrophobicContact CB-CD1 4.17Å; L354-I359 HydrophobicContact CD1-CD1 4.27Å; N357-I359 HydrophobicContact CB-CD1 4.19Å; N357-I359 HydrophobicContact CB-CG1 4.19Å; I359-S361 WeakPolarHBondContact CG2-O 3.14Å; I359-I362 HydrophobicContact CG2-CG1 4.18Å; I359-L378 HydrophobicContact CD1-CD2 4.48Å; I359-N381 HydrophobicContact CB-CB 4.12Å; I359-N381 WeakPolarHBondContact CB-OD1 3.48Å; I359-N381 WeakPolarHBondContact CG1-OD1 3.38Å; I359-N381 PolarHBondContact N-OD1 3.47Å; I359-I383 HydrophobicContact CG2-CG1 4.36Å; I359-I383 VanDerWaalsContact O-CG1 3.24Å; I359-I383 WeakPolarHBondContact O-CG1 3.44Å
360	K	91	Very high	93.5	Very high	71 Å²	71	33.9 Å²	33.9	31%	0.309	16%	0.16	S	C	.	.			trans	-95.5	-22.4	175.7	-59.8	-177.1	-177.6	179.6	0	113.8	E337 K358 M384 S385	E337-K360 VanDerWaalsContact OE1-CB 3.31Å; E337-K360 WeakPolarHBondContact OE1-CB 3.42Å; E337-K360 PolarHBondContact OE1-N 3.28Å; K358-K360 PolarHBondContact O-N 3.2Å; K360-M384 HydrophobicContact CB-CG 4.15Å; K360-M384 HydrophobicContact CB-SD 4.3Å; K360-M384 HydrophobicContact CD-SD 4.28Å; K360-M384 HydrophobicContact CG-SD 4.49Å; K360-M384 WeakPolarHBondContact O-CA 3.47Å; K360-M384 WeakPolarHBondContact O-CB 3.4Å; K360-M384 PolarHBondContact O-N 2.99Å; K360-S385 PolarHBondContact O-N 2.77Å
361	S	91.4	Very high	93	Very high	3 Å²	3	37 Å²	37	2%	0.021	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	151.7	179.8	-69.5	0	0	0	0	111.1	E337 I359 S385 K458	E337-S361 WeakPolarHBondContact CG-O 3.49Å; I359-S361 WeakPolarHBondContact CG2-O 3.14Å; S361-S385 WeakPolarHBondContact CA-O 3.38Å; S361-S385 PolarHBondContact OG-OG 3Å; S361-K458 PolarHBondContact OG-NZ 2.7Å
362	I	93.6	Very high	92.8	Very high	5 Å²	5	40.7 Å²	40.7	3%	0.026	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	115.8	174.6	-58	-178.2	0	0	0	108.1	I336 I359 A366 F367 L378 I383 S385 I386 H387 A390	I336-I362 HydrophobicContact CG2-CG1 4.16Å; I359-I362 HydrophobicContact CG2-CG1 4.18Å; I362-A366 HydrophobicContact CG2-CB 3.69Å; I362-F367 HydrophobicContact CD1-CE2 4.22Å; I362-F367 HydrophobicContact CD1-CZ 4.42Å; I362-F367 HydrophobicContact CG2-CD2 4.22Å; I362-F367 HydrophobicContact CG2-CE2 3.59Å; I362-F367 HydrophobicContact CG2-CZ 4.29Å; I362-L378 HydrophobicContact CD1-CD1 3.52Å; I362-L378 HydrophobicContact CD1-CD2 4.17Å; I362-L378 HydrophobicContact CD1-CG 4.47Å; I362-I383 HydrophobicContact CD1-CD1 3.96Å; I362-S385 PolarHBondContact N-O 3.03Å; I362-I386 HydrophobicContact CB-CG2 4.15Å; I362-I386 HydrophobicContact CD1-CD1 4.32Å; I362-I386 HydrophobicContact CD1-CG1 4.15Å; I362-I386 HydrophobicContact CD1-CG2 4.41Å; I362-I386 HydrophobicContact CG1-CG1 4.47Å; I362-I386 HydrophobicContact CG2-CG2 4.37Å; I362-H387 PolarHBondContact O-N 2.95Å; I362-A390 HydrophobicContact CG2-CB 3.76Å
363	T	91.9	Very high	92.7	Very high	22 Å²	22	40.7 Å²	40.7	14%	0.135	19%	0.192	C	C	.	.			trans	-79.1	163.9	178.9	63.9	0	0	0	0	111.8	I336 E337 D338 K365 A366 A390	I336-T363 PolarHBondContact O-N 2.9Å; E337-T363 VanDerWaalsContact C-CG2 3.46Å; E337-T363 WeakPolarHBondContact O-CG2 3.43Å; D338-T363 WeakPolarHBondContact O-CG2 3.37Å; D338-T363 PolarHBondContact O-OG1 2.85Å; T363-K365 PolarHBondContact O-N 2.94Å; T363-K365 VanDerWaalsContact O-N 3.16Å; T363-A366 WeakPolarHBondContact O-CB 3.2Å; T363-A366 PolarHBondContact O-N 3.45Å; T363-A366 PolarHBondContact OG1-N 3.07Å; T363-A390 WeakPolarHBondContact O-CB 3.43Å
364	Q	90.9	Very high	92.6	Very high	95 Å²	95	42.8 Å²	42.8	44%	0.444	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50	-37.9	175.3	-178.9	-179.8	17.5	0	0	113.2	E389	Q364-E389 HydrophobicContact CG-CB 4.01Å; Q364-E389 PolarHBondContact NE2-OE2 3.06Å
365	K	89.4	Confident	92.6	Very high	77 Å²	77	46.6 Å²	46.6	34%	0.335	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-4.3	-173.5	-63.9	-175.6	153.8	-84.8	0	114.7	S339 T363 F367 E368	S339-K365 WeakPolarHBondContact O-CD 3.24Å; T363-K365 PolarHBondContact O-N 2.94Å; T363-K365 VanDerWaalsContact O-N 3.16Å; K365-F367 PolarHBondContact O-N 3.02Å; K365-E368 WeakPolarHBondContact CB-OE2 3.47Å; K365-E368 WeakPolarHBondContact CD-OE2 3.41Å; K365-E368 WeakPolarHBondContact CG-OE2 3.35Å; K365-E368 IonicContact NZ-OE1 3.69Å; K365-E368 PolarHBondContact NZ-OE1 3.22Å; K365-E368 IonicContact NZ-OE2 3.46Å; K365-E368 PolarHBondContact NZ-OE2 3.27Å; K365-E368 WeakPolarHBondContact O-CB 3.46Å; K365-E368 PolarHBondContact O-N 2.66Å
366	A	91.1	Very high	92.7	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-28.3	-172.2	0	0	0	0	0	114.9	I336 F343 I362 T363	I336-A366 HydrophobicContact CG2-CB 4Å; F343-A366 WeakPolarHBondContact CD2-O 3.48Å; I362-A366 HydrophobicContact CG2-CB 3.69Å; T363-A366 WeakPolarHBondContact O-CB 3.2Å; T363-A366 PolarHBondContact O-N 3.45Å; T363-A366 PolarHBondContact OG1-N 3.07Å
367	F	92.1	Very high	92.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.1	20.6	179.6	-54.2	-56.3	0	0	0	112.6	F343 L352 L354 I362 K365 G369 L370 L376 L378 L391 L394	F343-F367 HydrophobicContact CD2-CD1 4.1Å; F343-F367 HydrophobicContact CD2-CE1 4.46Å; F343-F367 HydrophobicContact CE2-CD1 4.21Å; F343-F367 HydrophobicContact CE2-CE1 4.11Å; L352-F367 HydrophobicContact CD2-CD1 4.04Å; L352-F367 HydrophobicContact CD2-CE1 3.96Å; L354-F367 HydrophobicContact CD1-CE1 3.98Å; L354-F367 HydrophobicContact CD1-CZ 4.43Å; I362-F367 HydrophobicContact CD1-CE2 4.22Å; I362-F367 HydrophobicContact CD1-CZ 4.42Å; I362-F367 HydrophobicContact CG2-CD2 4.22Å; I362-F367 HydrophobicContact CG2-CE2 3.59Å; I362-F367 HydrophobicContact CG2-CZ 4.29Å; K365-F367 PolarHBondContact O-N 3.02Å; F367-G369 PolarHBondContact O-N 3.31Å; F367-L370 HydrophobicContact CB-CD1 4.08Å; F367-L370 HydrophobicContact CD1-CD1 4.08Å; F367-L370 WeakPolarHBondContact O-CB 3.33Å; F367-L370 PolarHBondContact O-N 3.38Å; F367-L376 HydrophobicContact CD2-CD2 4.39Å; F367-L376 HydrophobicContact CE1-CD1 4.26Å; F367-L376 HydrophobicContact CE2-CD2 4.03Å; F367-L376 HydrophobicContact CZ-CD1 4.28Å; F367-L376 HydrophobicContact CZ-CD2 4.19Å; F367-L378 HydrophobicContact CZ-CD2 4.12Å; F367-L391 HydrophobicContact CD2-CD2 3.8Å; F367-L391 HydrophobicContact CE2-CD2 3.83Å; F367-L394 HydrophobicContact CB-CD1 4.09Å; F367-L394 HydrophobicContact CD2-CD1 4.35Å; F367-L394 HydrophobicContact CG-CD1 4.43Å
368	E	88.6	Confident	92.7	Very high	78 Å²	78	41.6 Å²	41.6	36%	0.364	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	133.3	177	-171.8	171.4	-165.7	0	0	110.4	A341 K365	A341-E368 HydrophobicContact CB-CB 4.02Å; K365-E368 WeakPolarHBondContact CB-OE2 3.47Å; K365-E368 WeakPolarHBondContact CD-OE2 3.41Å; K365-E368 WeakPolarHBondContact CG-OE2 3.35Å; K365-E368 IonicContact NZ-OE1 3.69Å; K365-E368 PolarHBondContact NZ-OE1 3.22Å; K365-E368 IonicContact NZ-OE2 3.46Å; K365-E368 PolarHBondContact NZ-OE2 3.27Å; K365-E368 WeakPolarHBondContact O-CB 3.46Å; K365-E368 PolarHBondContact O-N 2.66Å
369	G	86.6	Confident	92.8	Very high	13 Å²	13	36.4 Å²	36.4	13%	0.134	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.3	-2.1	-177.8	0	0	0	0	0	116.1	F367 D371	F367-G369 PolarHBondContact O-N 3.31Å; G369-D371 VanDerWaalsContact C-N 3.33Å; G369-D371 PolarHBondContact O-N 3.11Å
370	L	91.9	Very high	92.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.201	C	C	.	.			trans	-91.8	48.5	-179.3	-60	-173.1	0	0	0	113.6	F343 M346 L349 L352 F367 E372 L373 L394	F343-L370 HydrophobicContact CB-CD1 4Å; F343-L370 HydrophobicContact CB-CD2 4.04Å; F343-L370 HydrophobicContact CB-CG 4.18Å; F343-L370 HydrophobicContact CD2-CD1 4.18Å; F343-L370 HydrophobicContact CG-CD1 4.36Å; M346-L370 HydrophobicContact CB-CD2 3.89Å; M346-L370 HydrophobicContact CE-CD2 4.32Å; L349-L370 HydrophobicContact CB-CD2 4.13Å; L349-L370 HydrophobicContact CD2-CD1 4.29Å; L349-L370 HydrophobicContact CD2-CD2 3.91Å; L352-L370 HydrophobicContact CD2-CD1 3.92Å; F367-L370 HydrophobicContact CB-CD1 4.08Å; F367-L370 HydrophobicContact CD1-CD1 4.08Å; F367-L370 WeakPolarHBondContact O-CB 3.33Å; F367-L370 PolarHBondContact O-N 3.38Å; L370-E372 VanDerWaalsContact C-N 3.3Å; L370-E372 PolarHBondContact O-N 3.23Å; L370-L373 HydrophobicContact CB-CB 4.13Å; L370-L373 HydrophobicContact CB-CD2 4.45Å; L370-L373 HydrophobicContact CD1-CD2 4.18Å; L370-L373 VanDerWaalsContact O-CB 3.26Å; L370-L373 WeakPolarHBondContact O-CB 3.39Å; L370-L373 PolarHBondContact O-N 3.1Å; L370-L373 VanDerWaalsContact O-N 3.1Å; L370-L394 HydrophobicContact CB-CD2 4.3Å; L370-L394 WeakPolarHBondContact O-CD2 3.1Å
371	D	86.9	Confident	92.9	Very high	107 Å²	107	39 Å²	39	57%	0.572	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-29.1	-170.5	-62.5	-46.5	0	0	0	115.2	G369	G369-D371 VanDerWaalsContact C-N 3.33Å; G369-D371 PolarHBondContact O-N 3.11Å
372	E	94.1	Very high	92.9	Very high	109 Å²	109	40 Å²	40	51%	0.509	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	5.1	179.5	-65.8	-168.7	168.7	0	0	113.9	K347 L349 L370 K374	K347-E372 WeakPolarHBondContact O-CB 3.42Å; K347-E372 WeakPolarHBondContact O-CG 3.26Å; L349-E372 CarbonylContact O-C 2.97Å; L370-E372 VanDerWaalsContact C-N 3.3Å; L370-E372 PolarHBondContact O-N 3.23Å; E372-K374 PolarHBondContact O-N 3.13Å
373	L	96.4	Very high	93	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.01	20%	0.199	C	C	.	.			trans	-65.9	125.8	-175.2	-165	73.6	0	0	0	112.5	L349 L352 L370 L376 L394 L396	L349-L373 HydrophobicContact CD2-CD1 4.12Å; L349-L373 HydrophobicContact CG-CD1 4.13Å; L349-L373 WeakPolarHBondContact O-CA 3.48Å; L349-L373 PolarHBondContact O-N 3.12Å; L352-L373 HydrophobicContact CB-CD1 3.79Å; L352-L373 HydrophobicContact CB-CD2 4.42Å; L370-L373 HydrophobicContact CB-CB 4.13Å; L370-L373 HydrophobicContact CB-CD2 4.45Å; L370-L373 HydrophobicContact CD1-CD2 4.18Å; L370-L373 VanDerWaalsContact O-CB 3.26Å; L370-L373 WeakPolarHBondContact O-CB 3.39Å; L370-L373 PolarHBondContact O-N 3.1Å; L370-L373 VanDerWaalsContact O-N 3.1Å; L373-L376 HydrophobicContact CD2-CB 4.23Å; L373-L376 HydrophobicContact CD2-CD2 4.46Å; L373-L394 HydrophobicContact CB-CD2 4.41Å; L373-L394 HydrophobicContact CD2-CD1 4.27Å; L373-L396 HydrophobicContact CB-CD2 4.46Å; L373-L396 HydrophobicContact CD2-CD2 4.06Å; L373-L396 HydrophobicContact CG-CD2 4Å
374	K	96.2	Very high	93	Very high	71 Å²	71	39.3 Å²	39.3	31%	0.309	20%	0.195	S	C	.	.			trans	-112.1	-37.3	-178.1	-72.7	154.8	166.8	-77.8	0	112.2	N350 E372 L396 E397 V398	N350-K374 HydrophobicContact CB-CD 4.21Å; N350-K374 WeakPolarHBondContact O-CA 3.32Å; N350-K374 PolarHBondContact O-N 2.88Å; E372-K374 PolarHBondContact O-N 3.13Å; K374-L396 CarbonylContact O-C 3.43Å; K374-L396 WeakPolarHBondContact O-CA 3.32Å; K374-E397 HydrophobicContact CB-CB 4.4Å; K374-E397 HydrophobicContact CB-CG 4.4Å; K374-E397 HydrophobicContact CG-CG 4.34Å; K374-E397 IonicContact NZ-OE1 3.32Å; K374-E397 PolarHBondContact NZ-OE1 3.42Å; K374-E397 IonicContact NZ-OE2 3.44Å; K374-E397 PolarHBondContact O-N 2.9Å; K374-V398 PolarHBondContact O-N 3.22Å
375	E	97.5	Very high	93.1	Very high	80 Å²	80	36.1 Å²	36.1	37%	0.374	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	122.9	-174	-52.1	-172.8	146.9	0	0	110.5	N350 T351 L352 V398	N350-E375 PolarHBondContact O-N 3.18Å; T351-E375 WeakPolarHBondContact CA-O 3.39Å; T351-E375 HydrophobicContact CG2-CB 4.01Å; T351-E375 VanDerWaalsContact CG2-OE2 3.3Å; T351-E375 WeakPolarHBondContact CG2-OE2 3.31Å; T351-E375 PolarHBondContact OG1-OE2 3.14Å; L352-E375 PolarHBondContact N-O 3.2Å; E375-V398 WeakPolarHBondContact CA-O 3.2Å; E375-V398 HydrophobicContact CB-CB 4.18Å; E375-V398 HydrophobicContact CG-CB 3.98Å; E375-V398 HydrophobicContact CG-CG2 4.06Å
376	L	97.5	Very high	93.3	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.01	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	113.3	179.2	177.7	58.4	0	0	0	110.6	L352 F367 L373 L378 L391 L396 V398 F399 V400	L352-L376 HydrophobicContact CB-CD1 4.16Å; L352-L376 HydrophobicContact CD2-CD1 4.04Å; L352-L376 HydrophobicContact CG-CD1 4.07Å; L352-L376 WeakPolarHBondContact O-CA 3.49Å; F367-L376 HydrophobicContact CD2-CD2 4.39Å; F367-L376 HydrophobicContact CE1-CD1 4.26Å; F367-L376 HydrophobicContact CE2-CD2 4.03Å; F367-L376 HydrophobicContact CZ-CD1 4.28Å; F367-L376 HydrophobicContact CZ-CD2 4.19Å; L373-L376 HydrophobicContact CD2-CB 4.23Å; L373-L376 HydrophobicContact CD2-CD2 4.46Å; L376-L378 HydrophobicContact CD1-CD2 4.3Å; L376-L378 HydrophobicContact CD1-CG 4.1Å; L376-L378 HydrophobicContact CD2-CD1 4.03Å; L376-L378 HydrophobicContact CD2-CG 4.46Å; L376-L378 HydrophobicContact CG-CD1 4.12Å; L376-L378 HydrophobicContact CG-CG 4.04Å; L376-L391 HydrophobicContact CD2-CD2 3.69Å; L376-L396 HydrophobicContact CB-CD1 4.17Å; L376-L396 HydrophobicContact CB-CD2 3.86Å; L376-L396 HydrophobicContact CD2-CD1 4.2Å; L376-V398 PolarHBondContact N-O 2.89Å; L376-F399 HydrophobicContact CB-CD2 4.26Å; L376-F399 HydrophobicContact CD2-CD2 4.21Å; L376-F399 HydrophobicContact CD2-CE2 4.06Å; L376-F399 HydrophobicContact CG-CD2 4.29Å; L376-F399 HydrophobicContact CG-CE2 4.38Å; L376-F399 WeakPolarHBondContact O-CA 3.17Å; L376-V400 PolarHBondContact O-N 3.37Å
377	D	97.4	Very high	93.4	Very high	27 Å²	27	36 Å²	36	14%	0.144	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	113.3	173.4	-170	-12.5	0	0	0	111.5	L352 L354 Q355 G379 V400	L352-D377 PolarHBondContact O-N 3.33Å; L354-D377 CarbonylContact C-O 3.43Å; L354-D377 WeakPolarHBondContact CA-O 3.34Å; L354-D377 PolarHBondContact N-O 3.42Å; Q355-D377 PolarHBondContact N-O 3.01Å; Q355-D377 PolarHBondContact NE2-OD2 2.78Å; D377-G379 WeakPolarHBondContact OD1-CA 3.08Å; D377-G379 PolarHBondContact OD1-N 3.38Å; D377-V400 HydrophobicContact CB-CB 4.15Å; D377-V400 WeakPolarHBondContact OD1-CG1 3.34Å
378	L	96.4	Very high	93.5	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.197	C	C	.	.			trans	-113.3	9.9	176.7	-68.2	168.2	0	0	0	112.4	L354 I359 I362 F367 L376 N381 I383 F399 V400 L401	L354-L378 HydrophobicContact CB-CD2 4.13Å; L354-L378 HydrophobicContact CD1-CD2 4.1Å; I359-L378 HydrophobicContact CD1-CD2 4.48Å; I362-L378 HydrophobicContact CD1-CD1 3.52Å; I362-L378 HydrophobicContact CD1-CD2 4.17Å; I362-L378 HydrophobicContact CD1-CG 4.47Å; F367-L378 HydrophobicContact CZ-CD2 4.12Å; L376-L378 HydrophobicContact CD1-CD2 4.3Å; L376-L378 HydrophobicContact CD1-CG 4.1Å; L376-L378 HydrophobicContact CD2-CD1 4.03Å; L376-L378 HydrophobicContact CD2-CG 4.46Å; L376-L378 HydrophobicContact CG-CD1 4.12Å; L376-L378 HydrophobicContact CG-CG 4.04Å; L378-N381 PolarHBondContact O-ND2 3.06Å; L378-I383 HydrophobicContact CB-CD1 3.76Å; L378-I383 HydrophobicContact CD1-CD1 4.31Å; L378-I383 HydrophobicContact CD2-CD1 4.41Å; L378-I383 HydrophobicContact CG-CD1 4.4Å; L378-F399 HydrophobicContact CD1-CE2 3.79Å; L378-F399 HydrophobicContact CD1-CZ 4.25Å; L378-V400 PolarHBondContact N-O 2.73Å; L378-L401 HydrophobicContact CB-CD1 4.41Å
379	G	95	Very high	93.7	Very high	2 Å²	2	39.1 Å²	39.1	2%	0.021	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	145.5	-175.2	0	0	0	0	0	113.6	Q355 R356 D377 N381 V400	Q355-G379 CarbonylContact C-O 3.49Å; Q355-G379 VanDerWaalsContact CA-O 3.31Å; Q355-G379 WeakPolarHBondContact CA-O 3.1Å; Q355-G379 WeakPolarHBondContact CG-O 3.38Å; R356-G379 PolarHBondContact N-O 3.26Å; D377-G379 WeakPolarHBondContact OD1-CA 3.08Å; D377-G379 PolarHBondContact OD1-N 3.38Å; G379-N381 PolarHBondContact O-N 2.84Å; G379-V400 PolarHBondContact N-O 3.3Å
380	K	93.3	Very high	94	Very high	114 Å²	114	38.5 Å²	38.5	50%	0.496	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	63	21	172.9	-51.3	169.7	-173.4	151.8	0	115.4	R356 N402	R356-K380 HydrophobicContact CG-CB 3.99Å; R356-K380 HydrophobicContact CG-CD 3.7Å; R356-K380 HydrophobicContact CG-CG 4.5Å; K380-N402 PolarHBondContact N-O 2.9Å
381	N	93.3	Very high	94	Very high	12 Å²	12	38.5 Å²	38.5	6%	0.064	20%	0.196	C	C	.	.	S	Bend	trans	-82.7	-23.7	173	-87.2	-77.7	0	0	0	114.2	L354 N357 K358 I359 L378 G379 I383	L354-N381 PolarHBondContact O-ND2 2.85Å; N357-N381 WeakPolarHBondContact CA-OD1 3.06Å; N357-N381 WeakPolarHBondContact CB-OD1 3.17Å; N357-N381 PolarHBondContact N-OD1 2.88Å; N357-N381 PolarHBondContact O-OD1 3.38Å; K358-N381 PolarHBondContact N-OD1 3.35Å; I359-N381 HydrophobicContact CB-CB 4.12Å; I359-N381 WeakPolarHBondContact CB-OD1 3.48Å; I359-N381 WeakPolarHBondContact CG1-OD1 3.38Å; I359-N381 PolarHBondContact N-OD1 3.47Å; L378-N381 PolarHBondContact O-ND2 3.06Å; G379-N381 PolarHBondContact O-N 2.84Å; N381-I383 HydrophobicContact CB-CD1 4.04Å; N381-I383 HydrophobicContact CB-CG1 3.82Å
382	G	91.3	Very high	94	Very high	25 Å²	25	36.8 Å²	36.8	26%	0.258	19%	0.192	S	C	.	.			trans	77.5	28	-172.2	0	0	0	0	0	113.7	M384 S405	G382-M384 VanDerWaalsContact O-CG 3.25Å; G382-M384 WeakPolarHBondContact O-CG 3.43Å; G382-M384 PolarHBondContact O-N 2.85Å; G382-S405 WeakPolarHBondContact O-CB 3.44Å
383	I	94.4	Very high	93.8	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	19%	0.186	C	C	.	.			trans	-53.3	133	-179	-67.4	159.3	0	0	0	111.1	I359 I362 L378 N381 I386 L401 S403 L406	I359-I383 HydrophobicContact CG2-CG1 4.36Å; I359-I383 VanDerWaalsContact O-CG1 3.24Å; I359-I383 WeakPolarHBondContact O-CG1 3.44Å; I362-I383 HydrophobicContact CD1-CD1 3.96Å; L378-I383 HydrophobicContact CB-CD1 3.76Å; L378-I383 HydrophobicContact CD1-CD1 4.31Å; L378-I383 HydrophobicContact CD2-CD1 4.41Å; L378-I383 HydrophobicContact CG-CD1 4.4Å; N381-I383 HydrophobicContact CB-CD1 4.04Å; N381-I383 HydrophobicContact CB-CG1 3.82Å; I383-I386 HydrophobicContact CG2-CD1 4.02Å; I383-I386 HydrophobicContact CG2-CG1 3.61Å; I383-L401 HydrophobicContact CB-CD1 4.4Å; I383-L401 HydrophobicContact CD1-CD1 3.68Å; I383-S403 WeakPolarHBondContact O-CB 3.47Å; I383-S403 PolarHBondContact O-OG 3.18Å; I383-L406 HydrophobicContact CG2-CD2 4.42Å; I383-L406 VanDerWaalsContact O-CD2 3.27Å; I383-L406 WeakPolarHBondContact O-CD2 3.4Å
384	M	92.6	Very high	93.6	Very high	11 Å²	11	35.9 Å²	35.9	5%	0.054	19%	0.188	C	C	.	.			trans	-109.4	-33.8	-174.7	-46.2	-167.3	78.3	0	0	111.2	K360 G382 S405 L406 L407 F544	K360-M384 HydrophobicContact CB-CG 4.15Å; K360-M384 HydrophobicContact CB-SD 4.3Å; K360-M384 HydrophobicContact CD-SD 4.28Å; K360-M384 HydrophobicContact CG-SD 4.49Å; K360-M384 WeakPolarHBondContact O-CA 3.47Å; K360-M384 WeakPolarHBondContact O-CB 3.4Å; K360-M384 PolarHBondContact O-N 2.99Å; G382-M384 VanDerWaalsContact O-CG 3.25Å; G382-M384 WeakPolarHBondContact O-CG 3.43Å; G382-M384 PolarHBondContact O-N 2.85Å; M384-S405 WeakPolarHBondContact CA-O 3.49Å; M384-S405 WeakPolarHBondContact CB-O 3.43Å; M384-S405 WeakPolarHBondContact CE-O 3.33Å; M384-L406 CarbonylContact O-C 3.55Å; M384-L406 WeakPolarHBondContact O-CA 3.48Å; M384-L407 HydrophobicContact CB-CD1 4.48Å; M384-L407 HydrophobicContact CB-CG 4.23Å; M384-L407 PolarHBondContact O-N 2.9Å; M384-F544 HydrophobicContact CE-CB 4.49Å; M384-F544 HydrophobicContact CE-CD1 4.15Å; M384-F544 VanDerWaalsContact SD-O 3.4Å
385	S	92.5	Very high	93.4	Very high	27 Å²	27	40.9 Å²	40.9	19%	0.189	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	149.8	175.9	60.4	0	0	0	0	112.9	K360 S361 I362	K360-S385 PolarHBondContact O-N 2.77Å; S361-S385 WeakPolarHBondContact CA-O 3.38Å; S361-S385 PolarHBondContact OG-OG 3Å; I362-S385 PolarHBondContact N-O 3.03Å
386	I	94.4	Very high	93.2	Very high	4 Å²	4	38 Å²	38	2%	0.021	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	123.8	178.6	-52.9	-179.5	0	0	0	108.2	I362 I383 L391 L401 M412 W414 L415	I362-I386 HydrophobicContact CB-CG2 4.15Å; I362-I386 HydrophobicContact CD1-CD1 4.32Å; I362-I386 HydrophobicContact CD1-CG1 4.15Å; I362-I386 HydrophobicContact CD1-CG2 4.41Å; I362-I386 HydrophobicContact CG1-CG1 4.47Å; I362-I386 HydrophobicContact CG2-CG2 4.37Å; I383-I386 HydrophobicContact CG2-CD1 4.02Å; I383-I386 HydrophobicContact CG2-CG1 3.61Å; I386-L391 HydrophobicContact CG2-CD1 3.84Å; I386-L391 HydrophobicContact CG2-CG 4.11Å; I386-L401 HydrophobicContact CD1-CD2 3.88Å; I386-M412 HydrophobicContact CB-CE 4.31Å; I386-M412 HydrophobicContact CB-SD 4.39Å; I386-M412 HydrophobicContact CG1-CE 4.38Å; I386-M412 PolarHBondContact N-SD 3.04Å; I386-W414 HydrophobicContact CB-CZ2 4.06Å; I386-W414 HydrophobicContact CG2-CH2 4.12Å; I386-W414 HydrophobicContact CG2-CZ2 3.82Å; I386-W414 WeakPolarHBondContact O-CZ2 3.18Å; I386-W414 PolarHBondContact O-NE1 2.84Å; I386-L415 HydrophobicContact CD1-CD2 4.36Å
387	H	93.9	Very high	93.1	Very high	71 Å²	71	43.9 Å²	43.9	33%	0.329	22%	0.224	S	C	.	.			trans	-70.1	136.4	174.4	-165.4	-92.6	0	0	0	110.8	I362 E389 A390	I362-H387 PolarHBondContact O-N 2.95Å; H387-E389 PolarHBondContact ND1-N 2.92Å; H387-E389 PolarHBondContact O-N 3.44Å; H387-A390 HydrophobicContact CB-CB 4.3Å; H387-A390 VanDerWaalsContact O-CB 3.23Å; H387-A390 WeakPolarHBondContact O-CB 3.5Å; H387-A390 PolarHBondContact O-N 2.76Å; H387-A390 VanDerWaalsContact O-N 3.09Å
388	P	93.3	Very high	93	Very high	43 Å²	43	45.4 Å²	45.4	28%	0.279	23%	0.234	S	C	.	.	H	α-helix	trans	-55.6	-48.8	-177.4	18.7	-31.5	0	0	0	113.2	A390 L391 S392 W414	P388-A390 PolarHBondContact O-N 2.78Å; P388-A390 VanDerWaalsContact O-N 3.15Å; P388-L391 PolarHBondContact O-N 3.43Å; P388-S392 WeakPolarHBondContact O-CB 3.34Å; P388-S392 PolarHBondContact O-N 3.23Å; P388-S392 PolarHBondContact O-OG 2.83Å; P388-W414 VanDerWaalsContact CA-CE2 3.43Å; P388-W414 HydrophobicContact CB-CD2 3.75Å; P388-W414 HydrophobicContact CB-CE3 4.34Å; P388-W414 HydrophobicContact CB-CG 3.82Å; P388-W414 HydrophobicContact CB-CZ2 4.42Å
389	E	92.1	Very high	93	Very high	101 Å²	101	45.4 Å²	45.4	47%	0.472	23%	0.234	S	C	.	.	H	α-helix	trans	-66.1	-15.7	-178.9	-69	175.5	-135.2	0	0	114.1	Q364 H387 L391 S392 H393	Q364-E389 HydrophobicContact CG-CB 4.01Å; Q364-E389 PolarHBondContact NE2-OE2 3.06Å; H387-E389 PolarHBondContact ND1-N 2.92Å; H387-E389 PolarHBondContact O-N 3.44Å; E389-L391 VanDerWaalsContact C-N 3.26Å; E389-L391 PolarHBondContact O-N 3.4Å; E389-S392 WeakPolarHBondContact CA-OG 3.47Å; E389-H393 PolarHBondContact O-CE1 3.48Å; E389-H393 PolarHBondContact O-ND1 2.9Å
390	A	93.6	Very high	93	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-67.1	-29	176.4	0	0	0	0	0	112.6	I362 T363 H387 P388 H393	I362-A390 HydrophobicContact CG2-CB 3.76Å; T363-A390 WeakPolarHBondContact O-CB 3.43Å; H387-A390 HydrophobicContact CB-CB 4.3Å; H387-A390 VanDerWaalsContact O-CB 3.23Å; H387-A390 WeakPolarHBondContact O-CB 3.5Å; H387-A390 PolarHBondContact O-N 2.76Å; H387-A390 VanDerWaalsContact O-N 3.09Å; P388-A390 PolarHBondContact O-N 2.78Å; P388-A390 VanDerWaalsContact O-N 3.15Å; A390-H393 PolarHBondContact O-CE1 2.75Å
391	L	92.6	Very high	93	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-119.9	-24	-177.4	-61.5	-175.7	0	0	0	113.7	F367 L376 I386 P388 E389 H393 L394 F399 W414 W418	F367-L391 HydrophobicContact CD2-CD2 3.8Å; F367-L391 HydrophobicContact CE2-CD2 3.83Å; L376-L391 HydrophobicContact CD2-CD2 3.69Å; I386-L391 HydrophobicContact CG2-CD1 3.84Å; I386-L391 HydrophobicContact CG2-CG 4.11Å; P388-L391 PolarHBondContact O-N 3.43Å; E389-L391 VanDerWaalsContact C-N 3.26Å; E389-L391 PolarHBondContact O-N 3.4Å; L391-H393 VanDerWaalsContact C-N 3.25Å; L391-H393 PolarHBondContact O-N 3.31Å; L391-L394 HydrophobicContact CD2-CD1 3.9Å; L391-L394 PolarHBondContact O-N 3.03Å; L391-L394 VanDerWaalsContact O-N 3.1Å; L391-F399 HydrophobicContact CD1-CE2 3.73Å; L391-F399 HydrophobicContact CD1-CZ 3.63Å; L391-F399 HydrophobicContact CD2-CE2 4.4Å; L391-W414 HydrophobicContact CB-CH2 4.26Å; L391-W414 HydrophobicContact CD1-CH2 4.26Å; L391-W418 HydrophobicContact CB-CH2 4.21Å; L391-W418 HydrophobicContact CB-CZ2 4.01Å; L391-W418 HydrophobicContact CD1-CH2 4.01Å; L391-W418 HydrophobicContact CD1-CZ3 4.28Å
392	S	87.1	Confident	93	Very high	70 Å²	70	45.3 Å²	45.3	49%	0.49	24%	0.24	S	C	.	.	H	α-helix	trans	-66.7	-22.6	-172	65.9	0	0	0	0	114.8	P388 E389	P388-S392 WeakPolarHBondContact O-CB 3.34Å; P388-S392 PolarHBondContact O-N 3.23Å; P388-S392 PolarHBondContact O-OG 2.83Å; E389-S392 WeakPolarHBondContact CA-OG 3.47Å
393	H	89.3	Confident	93.1	Very high	81 Å²	81	44.2 Å²	44.2	38%	0.375	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-18.8	176	69.1	-85.8	0	0	0	113.3	E389 A390 L391	E389-H393 PolarHBondContact O-CE1 3.48Å; E389-H393 PolarHBondContact O-ND1 2.9Å; A390-H393 PolarHBondContact O-CE1 2.75Å; L391-H393 VanDerWaalsContact C-N 3.25Å; L391-H393 PolarHBondContact O-N 3.31Å
394	L	92.3	Very high	93.1	Very high	12 Å²	12	48.1 Å²	48.1	6%	0.063	26%	0.256	C	S	.	.			trans	-82	135.6	-175.1	-57.9	174.7	0	0	0	111.5	F367 L370 L373 L391 L396	F367-L394 HydrophobicContact CB-CD1 4.09Å; F367-L394 HydrophobicContact CD2-CD1 4.35Å; F367-L394 HydrophobicContact CG-CD1 4.43Å; L370-L394 HydrophobicContact CB-CD2 4.3Å; L370-L394 WeakPolarHBondContact O-CD2 3.1Å; L373-L394 HydrophobicContact CB-CD2 4.41Å; L373-L394 HydrophobicContact CD2-CD1 4.27Å; L391-L394 HydrophobicContact CD2-CD1 3.9Å; L391-L394 PolarHBondContact O-N 3.03Å; L391-L394 VanDerWaalsContact O-N 3.1Å; L394-L396 VanDerWaalsContact C-N 3.33Å; L394-L396 HydrophobicContact CB-CD1 4.43Å; L394-L396 HydrophobicContact CB-CD2 4.41Å; L394-L396 HydrophobicContact CB-CG 3.97Å; L394-L396 PolarHBondContact O-N 2.78Å
395	K	91.4	Very high	93.2	Very high	175 Å²	175	49.2 Å²	49.2	76%	0.761	27%	0.265	S	S	*	.			trans	-96.8	55.9	180	-66.2	175.6	-174.6	163.7	0	111.5
396	L	94.7	Very high	93.2	Very high	19 Å²	19	48 Å²	48	10%	0.099	26%	0.256	C	S	.	.			trans	-62.6	134.9	-176.1	-62.6	173.6	0	0	0	111.9	L373 K374 L376 L394 F399 W418 F424	L373-L396 HydrophobicContact CB-CD2 4.46Å; L373-L396 HydrophobicContact CD2-CD2 4.06Å; L373-L396 HydrophobicContact CG-CD2 4Å; K374-L396 CarbonylContact O-C 3.43Å; K374-L396 WeakPolarHBondContact O-CA 3.32Å; L376-L396 HydrophobicContact CB-CD1 4.17Å; L376-L396 HydrophobicContact CB-CD2 3.86Å; L376-L396 HydrophobicContact CD2-CD1 4.2Å; L394-L396 VanDerWaalsContact C-N 3.33Å; L394-L396 HydrophobicContact CB-CD1 4.43Å; L394-L396 HydrophobicContact CB-CD2 4.41Å; L394-L396 HydrophobicContact CB-CG 3.97Å; L394-L396 PolarHBondContact O-N 2.78Å; L396-F399 HydrophobicContact CD1-CB 4.15Å; L396-F399 HydrophobicContact CD1-CD2 3.72Å; L396-F399 HydrophobicContact CD1-CE2 4.49Å; L396-F399 HydrophobicContact CD1-CG 4.24Å; L396-W418 HydrophobicContact CD1-CH2 4.41Å; L396-F424 HydrophobicContact CB-CE2 4.39Å; L396-F424 HydrophobicContact CB-CZ 3.76Å; L396-F424 WeakPolarHBondContact O-CZ 3.35Å
397	E	94.3	Very high	93.2	Very high	126 Å²	126	48 Å²	48	59%	0.589	26%	0.256	S	S	*	.	S	Bend	trans	-95.2	-31.5	168.3	-66.9	174.7	-166.6	0	0	110.6	K374	K374-E397 HydrophobicContact CB-CB 4.4Å; K374-E397 HydrophobicContact CB-CG 4.4Å; K374-E397 HydrophobicContact CG-CG 4.34Å; K374-E397 IonicContact NZ-OE1 3.32Å; K374-E397 PolarHBondContact NZ-OE1 3.42Å; K374-E397 IonicContact NZ-OE2 3.44Å; K374-E397 PolarHBondContact O-N 2.9Å
398	V	94.8	Very high	93.2	Very high	59 Å²	59	44.6 Å²	44.6	36%	0.358	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	123	177	-176.1	0	0	0	0	109.7	K374 E375 L376 V400	K374-V398 PolarHBondContact O-N 3.22Å; E375-V398 WeakPolarHBondContact CA-O 3.2Å; E375-V398 HydrophobicContact CB-CB 4.18Å; E375-V398 HydrophobicContact CG-CB 3.98Å; E375-V398 HydrophobicContact CG-CG2 4.06Å; L376-V398 PolarHBondContact N-O 2.89Å; V398-V400 HydrophobicContact CG1-CG2 4.26Å
399	F	96.1	Very high	93.2	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	122.8	173.2	-179.6	-113.2	0	0	0	110	L376 L378 L391 L396 L401 W418 L419 F424 S427 V428	L376-F399 HydrophobicContact CB-CD2 4.26Å; L376-F399 HydrophobicContact CD2-CD2 4.21Å; L376-F399 HydrophobicContact CD2-CE2 4.06Å; L376-F399 HydrophobicContact CG-CD2 4.29Å; L376-F399 HydrophobicContact CG-CE2 4.38Å; L376-F399 WeakPolarHBondContact O-CA 3.17Å; L378-F399 HydrophobicContact CD1-CE2 3.79Å; L378-F399 HydrophobicContact CD1-CZ 4.25Å; L391-F399 HydrophobicContact CD1-CE2 3.73Å; L391-F399 HydrophobicContact CD1-CZ 3.63Å; L391-F399 HydrophobicContact CD2-CE2 4.4Å; L396-F399 HydrophobicContact CD1-CB 4.15Å; L396-F399 HydrophobicContact CD1-CD2 3.72Å; L396-F399 HydrophobicContact CD1-CE2 4.49Å; L396-F399 HydrophobicContact CD1-CG 4.24Å; F399-L401 HydrophobicContact CD1-CB 4.46Å; F399-L401 HydrophobicContact CE1-CB 3.69Å; F399-L401 HydrophobicContact CE1-CD2 4.08Å; F399-L401 HydrophobicContact CZ-CB 3.9Å; F399-L401 HydrophobicContact CZ-CD2 4.17Å; F399-W418 HydrophobicContact CD1-CH2 4.01Å; F399-W418 AromaticContact CD1-CZ3 3.83Å; F399-W418 HydrophobicContact CD1-CZ3 3.83Å; F399-W418 HydrophobicContact CD2-CH2 4.43Å; F399-W418 HydrophobicContact CE1-CH2 4.15Å; F399-W418 AromaticContact CE1-CZ3 3.75Å; F399-W418 HydrophobicContact CE1-CZ3 3.75Å; F399-W418 HydrophobicContact CG-CH2 4.17Å; F399-W418 HydrophobicContact CG-CZ3 4.45Å; F399-W418 HydrophobicContact CZ-CH2 4.39Å; F399-W418 HydrophobicContact CZ-CZ3 4.27Å; F399-L419 HydrophobicContact CD1-CD2 4.09Å; F399-L419 HydrophobicContact CE1-CD2 4.07Å; F399-F424 HydrophobicContact CB-CB 4.49Å; F399-F424 HydrophobicContact CB-CD1 3.89Å; F399-F424 HydrophobicContact CB-CD2 3.65Å; F399-F424 HydrophobicContact CB-CE1 3.94Å; F399-F424 HydrophobicContact CB-CE2 3.69Å; F399-F424 HydrophobicContact CB-CG 3.76Å; F399-F424 HydrophobicContact CB-CZ 3.85Å; F399-F424 AromaticContact CD1-CD2 3.98Å; F399-F424 HydrophobicContact CD1-CD2 3.98Å; F399-F424 HydrophobicContact CD1-CG 4.37Å; F399-F424 HydrophobicContact CG-CD2 4.17Å; F399-F424 HydrophobicContact CG-CE2 4.35Å; F399-S427 WeakPolarHBondContact O-CB 3.19Å; F399-S427 PolarHBondContact O-OG 2.81Å; F399-V428 HydrophobicContact CD1-CG2 3.61Å; F399-V428 HydrophobicContact CE1-CG2 3.97Å
400	V	95.9	Very high	93.2	Very high	41 Å²	41	40.9 Å²	40.9	25%	0.248	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	119.3	178.7	-177.7	0	0	0	0	109.4	L376 D377 L378 G379 V398	L376-V400 PolarHBondContact O-N 3.37Å; D377-V400 HydrophobicContact CB-CB 4.15Å; D377-V400 WeakPolarHBondContact OD1-CG1 3.34Å; L378-V400 PolarHBondContact N-O 2.73Å; G379-V400 PolarHBondContact N-O 3.3Å; V398-V400 HydrophobicContact CG1-CG2 4.26Å
401	L	94.3	Very high	93	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	120.5	176.7	172.4	66.1	0	0	0	108.7	L378 I383 I386 F399 L415 V428 S429	L378-L401 HydrophobicContact CB-CD1 4.41Å; I383-L401 HydrophobicContact CB-CD1 4.4Å; I383-L401 HydrophobicContact CD1-CD1 3.68Å; I386-L401 HydrophobicContact CD1-CD2 3.88Å; F399-L401 HydrophobicContact CD1-CB 4.46Å; F399-L401 HydrophobicContact CE1-CB 3.69Å; F399-L401 HydrophobicContact CE1-CD2 4.08Å; F399-L401 HydrophobicContact CZ-CB 3.9Å; F399-L401 HydrophobicContact CZ-CD2 4.17Å; L401-L415 HydrophobicContact CD2-CD2 4.43Å; L401-V428 HydrophobicContact CB-CG1 4.04Å; L401-V428 HydrophobicContact CB-CG2 4.12Å; L401-V428 HydrophobicContact CD2-CG1 4.27Å; L401-V428 HydrophobicContact CG-CG1 4.38Å; L401-V428 CarbonylContact O-C 3.23Å; L401-V428 VanDerWaalsContact O-CA 3.27Å; L401-V428 WeakPolarHBondContact O-CA 3.42Å; L401-S429 PolarHBondContact O-N 2.82Å
402	N	92.4	Very high	93.1	Very high	84 Å²	84	45.9 Å²	45.9	45%	0.449	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	104	171.5	-172.5	-10.9	0	0	0	108.8	K380 S429	K380-N402 PolarHBondContact N-O 2.9Å; N402-S429 WeakPolarHBondContact CA-O 3.11Å
403	S	93.4	Very high	93.4	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.021	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	135.6	176.2	-173.6	0	0	0	0	111.8	I383 S405 S429 V431	I383-S403 WeakPolarHBondContact O-CB 3.47Å; I383-S403 PolarHBondContact O-OG 3.18Å; S403-S405 PolarHBondContact OG-N 3.28Å; S403-S405 VanDerWaalsContact OG-N 3.1Å; S403-S429 PolarHBondContact N-O 2.79Å; S403-V431 PolarHBondContact O-N 2.96Å
404	S	94.4	Very high	93.7	Very high	83 Å²	83	44.8 Å²	44.8	58%	0.58	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	21.3	168.3	64.2	0	0	0	0	112.3	V431	S404-V431 CarbonylContact C-O 3.55Å; S404-V431 WeakPolarHBondContact CA-O 3.24Å
405	S	93.6	Very high	93.8	Very high	34 Å²	34	44.2 Å²	44.2	24%	0.238	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	10	-170.9	-61	0	0	0	0	113.2	G382 M384 S403	G382-S405 WeakPolarHBondContact O-CB 3.44Å; M384-S405 WeakPolarHBondContact CA-O 3.49Å; M384-S405 WeakPolarHBondContact CB-O 3.43Å; M384-S405 WeakPolarHBondContact CE-O 3.33Å; S403-S405 PolarHBondContact OG-N 3.28Å; S403-S405 VanDerWaalsContact OG-N 3.1Å
406	L	94.3	Very high	93.8	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	137.2	-169.2	-62.5	170.2	0	0	0	113.2	I383 M384 C408 M412 A430 V431 A433 H434	I383-L406 HydrophobicContact CG2-CD2 4.42Å; I383-L406 VanDerWaalsContact O-CD2 3.27Å; I383-L406 WeakPolarHBondContact O-CD2 3.4Å; M384-L406 CarbonylContact O-C 3.55Å; M384-L406 WeakPolarHBondContact O-CA 3.48Å; L406-C408 PolarHBondContact O-N 3.22Å; L406-M412 HydrophobicContact CD2-CE 4.11Å; L406-A430 HydrophobicContact CD1-CB 3.59Å; L406-V431 PolarHBondContact N-O 3.42Å; L406-A433 PolarHBondContact O-N 3.29Å; L406-H434 PolarHBondContact O-N 3.11Å
407	L	93.1	Very high	93.8	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.021	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	93.5	167.1	-61.4	178.5	0	0	0	108.3	M384 D409 M412 H434 P457 K458 F544	M384-L407 HydrophobicContact CB-CD1 4.48Å; M384-L407 HydrophobicContact CB-CG 4.23Å; M384-L407 PolarHBondContact O-N 2.9Å; L407-D409 PolarHBondContact O-N 2.8Å; L407-M412 WeakPolarHBondContact O-CG 3.34Å; L407-H434 HydrophobicContact CD2-CB 3.57Å; L407-P457 HydrophobicContact CD2-CG 3.85Å; L407-K458 HydrophobicContact CD1-CB 4.15Å; L407-F544 HydrophobicContact CD2-CB 4.45Å; L407-F544 HydrophobicContact CD2-CD1 3.65Å; L407-F544 HydrophobicContact CD2-CE1 4.28Å; L407-F544 HydrophobicContact CD2-CG 4.41Å
408	C	94.3	Very high	93.7	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.184	C	C	.	.			trans	-82.2	62	-178.5	-65.5	0	0	0	0	111.5	L406 C432 H434 P435 L438 F451	L406-C408 PolarHBondContact O-N 3.22Å; C408-C432 HydrophobicContact CB-CB 3.8Å; C408-C432 WeakPolarHBondContact CB-SG 3.38Å; C408-C432 WeakPolarHBondContact SG-CB 3.42Å; C408-C432 CovalentContact SG-SG 2.03Å; C408-C432 PolarHBondContact SG-SG 2.67Å; C408-H434 WeakPolarHBondContact CB-O 3.09Å; C408-H434 PolarHBondContact N-O 3.1Å; C408-P435 WeakPolarHBondContact O-CD 3.09Å; C408-L438 HydrophobicContact CB-CD1 4.07Å; C408-F451 HydrophobicContact CB-CD1 4.14Å; C408-F451 HydrophobicContact CB-CE1 3.89Å
409	D	92.4	Very high	93.6	Very high	21 Å²	21	30.3 Å²	30.3	11%	0.112	17%	0.167	C	C	.	.	S	Bend	trans	-89.9	-178.8	170.8	68.1	16.7	0	0	0	111.5	L407 H411 M412 F451 V452	L407-D409 PolarHBondContact O-N 2.8Å; D409-H411 PolarHBondContact O-N 3.13Å; D409-H411 VanDerWaalsContact O-N 3.14Å; D409-H411 WeakPolarHBondContact OD1-CA 3.46Å; D409-H411 VanDerWaalsContact OD1-CB 3.29Å; D409-H411 WeakPolarHBondContact OD1-CB 3.15Å; D409-H411 IonicContact OD1-CD2 2.78Å; D409-H411 IonicContact OD1-CG 3.89Å; D409-H411 PolarHBondContact OD1-N 3.04Å; D409-H411 IonicContact OD2-CD2 3.94Å; D409-M412 PolarHBondContact O-N 3.15Å; D409-M412 PolarHBondContact OD1-N 2.78Å; D409-F451 WeakPolarHBondContact O-CD1 3.22Å; D409-V452 WeakPolarHBondContact CA-O 3.27Å; D409-V452 WeakPolarHBondContact CB-O 3.5Å
410	C	91.9	Very high	93.4	Very high	46 Å²	46	35.2 Å²	35.2	31%	0.311	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-59.2	-23.8	179	81.3	0	0	0	0	114	M412 Q413 V452 C453	C410-M412 VanDerWaalsContact C-N 3.25Å; C410-M412 PolarHBondContact O-N 2.97Å; C410-Q413 WeakPolarHBondContact O-CB 3.23Å; C410-Q413 PolarHBondContact O-N 3.14Å; C410-V452 PolarHBondContact N-O 3.2Å; C410-C453 VanDerWaalsContact CA-SG 3.54Å; C410-C453 HydrophobicContact CB-CB 3.92Å; C410-C453 WeakPolarHBondContact CB-SG 3.28Å; C410-C453 PolarHBondContact N-SG 3.46Å; C410-C453 WeakPolarHBondContact SG-CB 3.33Å; C410-C453 CovalentContact SG-SG 2.03Å; C410-C453 PolarHBondContact SG-SG 2.92Å
411	H	91.4	Very high	93.2	Very high	103 Å²	103	40.6 Å²	40.6	48%	0.477	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-74.9	-14.7	177.4	-56.8	-61.1	0	0	0	112.9	D409 W414 C453	D409-H411 PolarHBondContact O-N 3.13Å; D409-H411 VanDerWaalsContact O-N 3.14Å; D409-H411 WeakPolarHBondContact OD1-CA 3.46Å; D409-H411 VanDerWaalsContact OD1-CB 3.29Å; D409-H411 WeakPolarHBondContact OD1-CB 3.15Å; D409-H411 IonicContact OD1-CD2 2.78Å; D409-H411 IonicContact OD1-CG 3.89Å; D409-H411 PolarHBondContact OD1-N 3.04Å; D409-H411 IonicContact OD2-CD2 3.94Å; H411-W414 PolarHBondContact O-NE1 3Å; H411-W414 VanDerWaalsContact O-NE1 3.12Å; H411-C453 VanDerWaalsContact CD2-SG 3.6Å
412	M	93.8	Very high	92.9	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-101.3	-2.2	176.7	-67	-60	-67.3	0	0	114.2	I386 L406 L407 D409 C410 W414 L415 I443	I386-M412 HydrophobicContact CB-CE 4.31Å; I386-M412 HydrophobicContact CB-SD 4.39Å; I386-M412 HydrophobicContact CG1-CE 4.38Å; I386-M412 PolarHBondContact N-SD 3.04Å; L406-M412 HydrophobicContact CD2-CE 4.11Å; L407-M412 WeakPolarHBondContact O-CG 3.34Å; D409-M412 PolarHBondContact O-N 3.15Å; D409-M412 PolarHBondContact OD1-N 2.78Å; C410-M412 VanDerWaalsContact C-N 3.25Å; C410-M412 PolarHBondContact O-N 2.97Å; M412-W414 PolarHBondContact O-N 3.45Å; M412-W414 VanDerWaalsContact O-N 3.13Å; M412-L415 HydrophobicContact CE-CB 4.35Å; M412-L415 HydrophobicContact CE-CD2 3.46Å; M412-L415 VanDerWaalsContact CE-CD2 3.46Å; M412-L415 PolarHBondContact O-N 3.39Å; M412-L415 VanDerWaalsContact O-N 3.14Å; M412-I443 HydrophobicContact CB-CD1 4.4Å
413	Q	93.8	Very high	92.8	Very high	80 Å²	80	46.4 Å²	46.4	37%	0.374	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-34.1	-178.6	-169.6	-171.8	24.7	0	0	113.5	C410 P417 P448 F451	C410-Q413 WeakPolarHBondContact O-CB 3.23Å; C410-Q413 PolarHBondContact O-N 3.14Å; Q413-P417 VanDerWaalsContact O-CD 3.24Å; Q413-P417 WeakPolarHBondContact O-CD 3.47Å; Q413-P448 HydrophobicContact CG-CB 4.15Å; Q413-P448 PolarHBondContact NE2-O 3.35Å; Q413-F451 HydrophobicContact CB-CB 3.96Å; Q413-F451 HydrophobicContact CB-CD2 4.26Å; Q413-F451 HydrophobicContact CB-CG 4.03Å; Q413-F451 HydrophobicContact CG-CB 4.13Å; Q413-F451 HydrophobicContact CG-CD2 4Å; Q413-F451 HydrophobicContact CG-CG 4.21Å
414	W	94.4	Very high	92.6	Very high	48 Å²	48	47 Å²	47	18%	0.182	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-28	-177.8	70.3	-87.8	0	0	0	114.3	I386 P388 L391 H411 M412 G416 P417 W418	I386-W414 HydrophobicContact CB-CZ2 4.06Å; I386-W414 HydrophobicContact CG2-CH2 4.12Å; I386-W414 HydrophobicContact CG2-CZ2 3.82Å; I386-W414 WeakPolarHBondContact O-CZ2 3.18Å; I386-W414 PolarHBondContact O-NE1 2.84Å; P388-W414 VanDerWaalsContact CA-CE2 3.43Å; P388-W414 HydrophobicContact CB-CD2 3.75Å; P388-W414 HydrophobicContact CB-CE3 4.34Å; P388-W414 HydrophobicContact CB-CG 3.82Å; P388-W414 HydrophobicContact CB-CZ2 4.42Å; L391-W414 HydrophobicContact CB-CH2 4.26Å; L391-W414 HydrophobicContact CD1-CH2 4.26Å; H411-W414 PolarHBondContact O-NE1 3Å; H411-W414 VanDerWaalsContact O-NE1 3.12Å; M412-W414 PolarHBondContact O-N 3.45Å; M412-W414 VanDerWaalsContact O-N 3.13Å; W414-G416 PolarHBondContact O-N 2.8Å; W414-P417 WeakPolarHBondContact O-CD 3.34Å; W414-W418 HydrophobicContact CE3-CB 3.84Å; W414-W418 HydrophobicContact CE3-CG 4.11Å; W414-W418 HydrophobicContact CZ3-CB 3.99Å; W414-W418 AromaticContact CZ3-CD2 3.84Å; W414-W418 HydrophobicContact CZ3-CD2 3.84Å; W414-W418 HydrophobicContact CZ3-CE3 4.09Å; W414-W418 AromaticContact CZ3-CG 3.8Å; W414-W418 HydrophobicContact CZ3-CG 3.8Å; W414-W418 WeakPolarHBondContact O-CB 3.49Å; W414-W418 PolarHBondContact O-N 3.21Å; W414-W418 VanDerWaalsContact O-N 3.09Å
415	L	94.3	Very high	92.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-70.1	-36.6	-167.9	177.6	64.8	0	0	0	111.6	I386 L401 M412 W418 L419 I443	I386-L415 HydrophobicContact CD1-CD2 4.36Å; L401-L415 HydrophobicContact CD2-CD2 4.43Å; M412-L415 HydrophobicContact CE-CB 4.35Å; M412-L415 HydrophobicContact CE-CD2 3.46Å; M412-L415 VanDerWaalsContact CE-CD2 3.46Å; M412-L415 PolarHBondContact O-N 3.39Å; M412-L415 VanDerWaalsContact O-N 3.14Å; L415-W418 HydrophobicContact CD1-CE3 3.81Å; L415-W418 HydrophobicContact CD1-CZ3 4.15Å; L415-W418 PolarHBondContact O-N 2.93Å; L415-L419 HydrophobicContact CD1-CD1 4.08Å; L415-L419 HydrophobicContact CD1-CD2 4.41Å; L415-L419 HydrophobicContact CD1-CG 3.94Å; L415-L419 HydrophobicContact CG-CD1 3.91Å; L415-L419 HydrophobicContact CG-CG 4.24Å; L415-L419 WeakPolarHBondContact O-CB 3.45Å; L415-L419 WeakPolarHBondContact O-CG 3.24Å; L415-L419 PolarHBondContact O-N 3.09Å; L415-I443 HydrophobicContact CB-CD1 3.93Å; L415-I443 HydrophobicContact CD2-CD1 3.97Å; L415-I443 HydrophobicContact CG-CD1 4.2Å
416	G	93.3	Very high	91.5	Very high	2 Å²	2	55.1 Å²	55.1	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-61.4	-50.4	177.7	0	0	0	0	0	113.9	W414 K420	W414-G416 PolarHBondContact O-N 2.8Å; G416-K420 WeakPolarHBondContact O-CG 3.41Å
417	P	92.8	Very high	91	Very high	54 Å²	54	57.3 Å²	57.3	35%	0.351	29%	0.285	S	S	.	.	H	α-helix	trans	-58.4	-51.3	170	-28.1	35.7	0	0	0	113.5	Q413 W414 L419 K420 E421	Q413-P417 VanDerWaalsContact O-CD 3.24Å; Q413-P417 WeakPolarHBondContact O-CD 3.47Å; W414-P417 WeakPolarHBondContact O-CD 3.34Å; P417-L419 VanDerWaalsContact C-N 3.33Å; P417-L419 PolarHBondContact O-N 3.15Å; P417-K420 WeakPolarHBondContact O-CA 3.37Å; P417-K420 WeakPolarHBondContact O-CB 3.4Å; P417-K420 PolarHBondContact O-N 2.7Å; P417-E421 PolarHBondContact O-N 3.24Å
418	W	93.4	Very high	90.9	Very high	31 Å²	31	57.9 Å²	57.9	12%	0.117	29%	0.289	C	S	.	.	H	α-helix	trans	-56.9	-43.7	-178.3	178.5	85	0	0	0	112.4	L391 L396 F399 W414 L415 K420 E421 S422 F424	L391-W418 HydrophobicContact CB-CH2 4.21Å; L391-W418 HydrophobicContact CB-CZ2 4.01Å; L391-W418 HydrophobicContact CD1-CH2 4.01Å; L391-W418 HydrophobicContact CD1-CZ3 4.28Å; L396-W418 HydrophobicContact CD1-CH2 4.41Å; F399-W418 HydrophobicContact CD1-CH2 4.01Å; F399-W418 AromaticContact CD1-CZ3 3.83Å; F399-W418 HydrophobicContact CD1-CZ3 3.83Å; F399-W418 HydrophobicContact CD2-CH2 4.43Å; F399-W418 HydrophobicContact CE1-CH2 4.15Å; F399-W418 AromaticContact CE1-CZ3 3.75Å; F399-W418 HydrophobicContact CE1-CZ3 3.75Å; F399-W418 HydrophobicContact CG-CH2 4.17Å; F399-W418 HydrophobicContact CG-CZ3 4.45Å; F399-W418 HydrophobicContact CZ-CH2 4.39Å; F399-W418 HydrophobicContact CZ-CZ3 4.27Å; W414-W418 HydrophobicContact CE3-CB 3.84Å; W414-W418 HydrophobicContact CE3-CG 4.11Å; W414-W418 HydrophobicContact CZ3-CB 3.99Å; W414-W418 AromaticContact CZ3-CD2 3.84Å; W414-W418 HydrophobicContact CZ3-CD2 3.84Å; W414-W418 HydrophobicContact CZ3-CE3 4.09Å; W414-W418 AromaticContact CZ3-CG 3.8Å; W414-W418 HydrophobicContact CZ3-CG 3.8Å; W414-W418 WeakPolarHBondContact O-CB 3.49Å; W414-W418 PolarHBondContact O-N 3.21Å; W414-W418 VanDerWaalsContact O-N 3.09Å; L415-W418 HydrophobicContact CD1-CE3 3.81Å; L415-W418 HydrophobicContact CD1-CZ3 4.15Å; L415-W418 PolarHBondContact O-N 2.93Å; W418-K420 VanDerWaalsContact C-N 3.25Å; W418-K420 PolarHBondContact O-N 3.16Å; W418-E421 PolarHBondContact O-N 3.41Å; W418-S422 WeakPolarHBondContact O-CB 3.33Å; W418-S422 PolarHBondContact O-N 2.97Å; W418-S422 PolarHBondContact O-OG 3.22Å; W418-S422 VanDerWaalsContact O-OG 3.14Å; W418-F424 AromaticContact CH2-CD2 3.98Å; W418-F424 HydrophobicContact CH2-CD2 3.98Å; W418-F424 AromaticContact CH2-CE2 3.7Å; W418-F424 HydrophobicContact CH2-CE2 3.7Å; W418-F424 AromaticContact CZ2-CE2 3.99Å; W418-F424 HydrophobicContact CZ2-CE2 3.99Å; W418-F424 HydrophobicContact CZ3-CD2 4Å; W418-F424 HydrophobicContact CZ3-CE2 4.19Å
419	L	93.1	Very high	90.8	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.2	-29.2	175.5	-74	172.6	0	0	0	114.1	F399 L415 P417 Q423 F424 V428 A430 I443 L444	F399-L419 HydrophobicContact CD1-CD2 4.09Å; F399-L419 HydrophobicContact CE1-CD2 4.07Å; L415-L419 HydrophobicContact CD1-CD1 4.08Å; L415-L419 HydrophobicContact CD1-CD2 4.41Å; L415-L419 HydrophobicContact CD1-CG 3.94Å; L415-L419 HydrophobicContact CG-CD1 3.91Å; L415-L419 HydrophobicContact CG-CG 4.24Å; L415-L419 WeakPolarHBondContact O-CB 3.45Å; L415-L419 WeakPolarHBondContact O-CG 3.24Å; L415-L419 PolarHBondContact O-N 3.09Å; P417-L419 VanDerWaalsContact C-N 3.33Å; P417-L419 PolarHBondContact O-N 3.15Å; L419-Q423 PolarHBondContact O-N 2.77Å; L419-F424 HydrophobicContact CD2-CB 4.07Å; L419-F424 HydrophobicContact CD2-CD2 4.35Å; L419-F424 PolarHBondContact O-N 3.3Å; L419-V428 HydrophobicContact CD1-CG1 3.78Å; L419-V428 HydrophobicContact CD2-CB 4.08Å; L419-V428 HydrophobicContact CD2-CG1 3.89Å; L419-V428 HydrophobicContact CD2-CG2 3.77Å; L419-A430 HydrophobicContact CD1-CB 4.49Å; L419-I443 HydrophobicContact CD1-CG2 4.18Å; L419-L444 HydrophobicContact CB-CD2 3.94Å; L419-L444 HydrophobicContact CD1-CD2 4.27Å
420	K	90.9	Very high	90.9	Very high	104 Å²	104	59.5 Å²	59.5	45%	0.452	30%	0.302	S	S	.	.	H	α-helix	trans	-79	-44.5	177.4	-69	167.7	-177.2	173	0	110.9	G416 P417 W418 Q423 L425 L444	G416-K420 WeakPolarHBondContact O-CG 3.41Å; P417-K420 WeakPolarHBondContact O-CA 3.37Å; P417-K420 WeakPolarHBondContact O-CB 3.4Å; P417-K420 PolarHBondContact O-N 2.7Å; W418-K420 VanDerWaalsContact C-N 3.25Å; W418-K420 PolarHBondContact O-N 3.16Å; K420-Q423 PolarHBondContact O-N 2.98Å; K420-L425 HydrophobicContact CG-CD2 3.98Å; K420-L444 WeakPolarHBondContact CE-O 3.5Å; K420-L444 HydrophobicContact CG-CD2 4Å; K420-L444 PolarHBondContact NZ-O 2.9Å
421	E	91.1	Very high	91.1	Very high	153 Å²	153	58.9 Å²	58.9	72%	0.715	30%	0.297	S	S	*	.	H	α-helix	trans	-65.5	-43.7	179.3	-70.2	170.6	-167.1	0	0	111.5	P417 W418 Q423	P417-E421 PolarHBondContact O-N 3.24Å; W418-E421 PolarHBondContact O-N 3.41Å; E421-Q423 VanDerWaalsContact C-N 3.26Å; E421-Q423 PolarHBondContact O-N 3.26Å
422	S	88.9	Confident	91.3	Very high	42 Å²	42	54 Å²	54	29%	0.294	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	4.5	177	-51	0	0	0	0	114.5	W418 F424	W418-S422 WeakPolarHBondContact O-CB 3.33Å; W418-S422 PolarHBondContact O-N 2.97Å; W418-S422 PolarHBondContact O-OG 3.22Å; W418-S422 VanDerWaalsContact O-OG 3.14Å; S422-F424 VanDerWaalsContact C-N 3.26Å; S422-F424 WeakPolarHBondContact O-CD1 3.25Å; S422-F424 PolarHBondContact O-N 3.4Å; S422-F424 VanDerWaalsContact O-N 3.13Å
423	Q	89.4	Confident	91.2	Very high	166 Å²	166	55.7 Å²	55.7	78%	0.776	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	14.4	173.9	-52.1	-172.5	-2	0	0	117.1	L419 K420 E421 L425	L419-Q423 PolarHBondContact O-N 2.77Å; K420-Q423 PolarHBondContact O-N 2.98Å; E421-Q423 VanDerWaalsContact C-N 3.26Å; E421-Q423 PolarHBondContact O-N 3.26Å; Q423-L425 PolarHBondContact O-N 3.3Å
424	F	90.3	Very high	91.1	Very high	15 Å²	15	53.3 Å²	53.3	7%	0.066	28%	0.277	C	S	.	.			trans	-74.2	20.3	-177.7	-56.3	-46.9	0	0	0	115.7	L396 F399 W418 L419 S422 Q426 S427 V428	L396-F424 HydrophobicContact CB-CE2 4.39Å; L396-F424 HydrophobicContact CB-CZ 3.76Å; L396-F424 WeakPolarHBondContact O-CZ 3.35Å; F399-F424 HydrophobicContact CB-CB 4.49Å; F399-F424 HydrophobicContact CB-CD1 3.89Å; F399-F424 HydrophobicContact CB-CD2 3.65Å; F399-F424 HydrophobicContact CB-CE1 3.94Å; F399-F424 HydrophobicContact CB-CE2 3.69Å; F399-F424 HydrophobicContact CB-CG 3.76Å; F399-F424 HydrophobicContact CB-CZ 3.85Å; F399-F424 AromaticContact CD1-CD2 3.98Å; F399-F424 HydrophobicContact CD1-CD2 3.98Å; F399-F424 HydrophobicContact CD1-CG 4.37Å; F399-F424 HydrophobicContact CG-CD2 4.17Å; F399-F424 HydrophobicContact CG-CE2 4.35Å; W418-F424 AromaticContact CH2-CD2 3.98Å; W418-F424 HydrophobicContact CH2-CD2 3.98Å; W418-F424 AromaticContact CH2-CE2 3.7Å; W418-F424 HydrophobicContact CH2-CE2 3.7Å; W418-F424 AromaticContact CZ2-CE2 3.99Å; W418-F424 HydrophobicContact CZ2-CE2 3.99Å; W418-F424 HydrophobicContact CZ3-CD2 4Å; W418-F424 HydrophobicContact CZ3-CE2 4.19Å; L419-F424 HydrophobicContact CD2-CB 4.07Å; L419-F424 HydrophobicContact CD2-CD2 4.35Å; L419-F424 PolarHBondContact O-N 3.3Å; S422-F424 VanDerWaalsContact C-N 3.26Å; S422-F424 WeakPolarHBondContact O-CD1 3.25Å; S422-F424 PolarHBondContact O-N 3.4Å; S422-F424 VanDerWaalsContact O-N 3.13Å; F424-Q426 PolarHBondContact O-N 3.42Å; F424-Q426 VanDerWaalsContact O-N 3.11Å; F424-S427 PolarHBondContact O-N 3.25Å; F424-S427 PolarHBondContact O-OG 3Å; F424-V428 HydrophobicContact CB-CG2 3.95Å; F424-V428 WeakPolarHBondContact O-CB 3.44Å; F424-V428 WeakPolarHBondContact O-CG2 3.43Å; F424-V428 PolarHBondContact O-N 2.95Å
425	L	83.1	Confident	91	Very high	88 Å²	88	53 Å²	53	46%	0.461	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-15.5	-169.8	-59.3	175	0	0	0	114.8	K420 Q423 L444	K420-L425 HydrophobicContact CG-CD2 3.98Å; Q423-L425 PolarHBondContact O-N 3.3Å; L425-L444 HydrophobicContact CD2-CD1 3.75Å; L425-L444 HydrophobicContact CD2-CD2 3.69Å; L425-L444 HydrophobicContact CD2-CG 4.38Å
426	Q	81.6	Confident	90.8	Very high	199 Å²	199	57.1 Å²	57.1	93%	0.93	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-27.4	179.2	-62.4	-173	11	0	0	113.4	F424	F424-Q426 PolarHBondContact O-N 3.42Å; F424-Q426 VanDerWaalsContact O-N 3.11Å
427	S	84.8	Confident	90.7	Very high	46 Å²	46	60.2 Å²	60.2	32%	0.322	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-9.1	-177.6	51.8	0	0	0	0	113.4	F399 F424	F399-S427 WeakPolarHBondContact O-CB 3.19Å; F399-S427 PolarHBondContact O-OG 2.81Å; F424-S427 PolarHBondContact O-N 3.25Å; F424-S427 PolarHBondContact O-OG 3Å
428	V	90.1	Very high	90.7	Very high	16 Å²	16	58 Å²	58	10%	0.097	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	127.6	-175.7	177.8	0	0	0	0	112.9	F399 L401 L419 F424 A430	F399-V428 HydrophobicContact CD1-CG2 3.61Å; F399-V428 HydrophobicContact CE1-CG2 3.97Å; L401-V428 HydrophobicContact CB-CG1 4.04Å; L401-V428 HydrophobicContact CB-CG2 4.12Å; L401-V428 HydrophobicContact CD2-CG1 4.27Å; L401-V428 HydrophobicContact CG-CG1 4.38Å; L401-V428 CarbonylContact O-C 3.23Å; L401-V428 VanDerWaalsContact O-CA 3.27Å; L401-V428 WeakPolarHBondContact O-CA 3.42Å; L419-V428 HydrophobicContact CD1-CG1 3.78Å; L419-V428 HydrophobicContact CD2-CB 4.08Å; L419-V428 HydrophobicContact CD2-CG1 3.89Å; L419-V428 HydrophobicContact CD2-CG2 3.77Å; F424-V428 HydrophobicContact CB-CG2 3.95Å; F424-V428 WeakPolarHBondContact O-CB 3.44Å; F424-V428 WeakPolarHBondContact O-CG2 3.43Å; F424-V428 PolarHBondContact O-N 2.95Å; V428-A430 HydrophobicContact CG1-CB 4.03Å
429	S	92.9	Very high	90.8	Very high	53 Å²	53	62 Å²	62	37%	0.371	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	103.2	166.1	177.2	0	0	0	0	108.8	L401 N402 S403	L401-S429 PolarHBondContact O-N 2.82Å; N402-S429 WeakPolarHBondContact CA-O 3.11Å; S403-S429 PolarHBondContact N-O 2.79Å
430	A	93.9	Very high	90.8	Very high	2 Å²	2	64.7 Å²	64.7	2%	0.017	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	108	-178.3	0	0	0	0	0	109.7	L406 L419 V428 S442 I443	L406-A430 HydrophobicContact CD1-CB 3.59Å; L419-A430 HydrophobicContact CD1-CB 4.49Å; V428-A430 HydrophobicContact CG1-CB 4.03Å; A430-S442 VanDerWaalsContact O-CA 3.31Å; A430-S442 WeakPolarHBondContact O-CA 3.28Å; A430-S442 PolarHBondContact O-OG 2.68Å; A430-I443 HydrophobicContact CB-CB 4.38Å; A430-I443 HydrophobicContact CB-CG2 3.59Å; A430-I443 PolarHBondContact O-N 2.86Å
431	V	95.4	Very high	91.1	Very high	34 Å²	34	63.5 Å²	63.5	21%	0.206	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	134.5	-176	178.5	0	0	0	0	110.5	S403 S404 L406 R441	S403-V431 PolarHBondContact O-N 2.96Å; S404-V431 CarbonylContact C-O 3.55Å; S404-V431 WeakPolarHBondContact CA-O 3.24Å; L406-V431 PolarHBondContact N-O 3.42Å; V431-R441 WeakPolarHBondContact CA-O 3.45Å
432	C	95.3	Very high	91.2	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.007	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	132.3	-178	-54.7	0	0	0	0	111.9	C408 L438 G440 R441 I446	C408-C432 HydrophobicContact CB-CB 3.8Å; C408-C432 WeakPolarHBondContact CB-SG 3.38Å; C408-C432 WeakPolarHBondContact SG-CB 3.42Å; C408-C432 CovalentContact SG-SG 2.03Å; C408-C432 PolarHBondContact SG-SG 2.67Å; C432-L438 HydrophobicContact CB-CB 4.22Å; C432-L438 WeakPolarHBondContact CB-O 3.37Å; C432-G440 PolarHBondContact O-N 2.87Å; C432-R441 PolarHBondContact N-O 2.95Å; C432-I446 WeakPolarHBondContact SG-CD1 3.15Å
433	A	93.4	Very high	91.5	Very high	35 Å²	35	56.2 Å²	56.2	29%	0.289	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-23.4	165.4	0	0	0	0	0	112.3	L406 L439	L406-A433 PolarHBondContact O-N 3.29Å; A433-L439 WeakPolarHBondContact O-CD1 3.41Å
434	H	91.4	Very high	91.6	Very high	30 Å²	30	50.5 Å²	50.5	14%	0.139	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	152.6	-176.7	-164	-90.3	0	0	0	109.9	L406 L407 C408 D455 F544	L406-H434 PolarHBondContact O-N 3.11Å; L407-H434 HydrophobicContact CD2-CB 3.57Å; C408-H434 WeakPolarHBondContact CB-O 3.09Å; C408-H434 PolarHBondContact N-O 3.1Å; H434-D455 IonicContact CE1-OD2 3.15Å; H434-D455 PolarHBondContact CE1-OD2 3.4Å; H434-D455 IonicContact NE2-OD2 3.06Å; H434-D455 PolarHBondContact NE2-OD2 3.12Å; H434-F544 HydrophobicContact CB-CE1 4.36Å
435	P	91.9	Very high	91.6	Very high	42 Å²	42	53 Å²	53	27%	0.273	34%	0.335	S	S	.	.	S	Bend	cis	-65.8	167.3	-11.7	29.4	-36.8	0	0	0	113.3	C408 G437 L438 L439	C408-P435 WeakPolarHBondContact O-CD 3.09Å; P435-G437 PolarHBondContact O-N 2.78Å; P435-G437 VanDerWaalsContact O-N 3.09Å; P435-L438 HydrophobicContact CG-CB 4.41Å; P435-L438 HydrophobicContact CG-CD1 4.1Å; P435-L438 HydrophobicContact CG-CG 4.16Å; P435-L438 PolarHBondContact O-N 2.77Å; P435-L439 PolarHBondContact O-N 3.14Å
436	A	89	Confident	92.2	Very high	86 Å²	86	49.5 Å²	49.5	71%	0.711	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-30	-176.8	0	0	0	0	0	114	L438 L439	A436-L438 VanDerWaalsContact C-N 3.29Å; A436-L438 PolarHBondContact O-N 2.86Å; A436-L439 WeakPolarHBondContact O-CB 3.33Å
437	G	91.1	Very high	92.6	Very high	67 Å²	67	42.4 Å²	42.4	69%	0.691	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-17.5	174.9	0	0	0	0	0	115	P435	P435-G437 PolarHBondContact O-N 2.78Å; P435-G437 VanDerWaalsContact O-N 3.09Å
438	L	94.1	Very high	92.9	Very high	7 Å²	7	43.1 Å²	43.1	4%	0.037	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109	-2.1	178.1	-61	-178.5	0	0	0	113.1	C408 C432 P435 A436 G440 R441 I446 E450	C408-L438 HydrophobicContact CB-CD1 4.07Å; C432-L438 HydrophobicContact CB-CB 4.22Å; C432-L438 WeakPolarHBondContact CB-O 3.37Å; P435-L438 HydrophobicContact CG-CB 4.41Å; P435-L438 HydrophobicContact CG-CD1 4.1Å; P435-L438 HydrophobicContact CG-CG 4.16Å; P435-L438 PolarHBondContact O-N 2.77Å; A436-L438 VanDerWaalsContact C-N 3.29Å; A436-L438 PolarHBondContact O-N 2.86Å; L438-G440 PolarHBondContact O-N 2.79Å; L438-R441 WeakPolarHBondContact O-CB 3.3Å; L438-R441 PolarHBondContact O-N 2.93Å; L438-I446 HydrophobicContact CB-CD1 4.35Å; L438-I446 HydrophobicContact CD1-CD1 4.26Å; L438-I446 HydrophobicContact CD1-CG2 4.18Å; L438-I446 HydrophobicContact CD2-CD1 4.2Å; L438-I446 HydrophobicContact CD2-CG1 4.38Å; L438-I446 HydrophobicContact CD2-CG2 4.12Å; L438-E450 HydrophobicContact CD2-CB 4.38Å
439	L	94.1	Very high	92.9	Very high	117 Å²	117	49 Å²	49	61%	0.613	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	125.2	-178.7	177	63.3	0	0	0	112.5	A433 P435 A436 R441	A433-L439 WeakPolarHBondContact O-CD1 3.41Å; P435-L439 PolarHBondContact O-N 3.14Å; A436-L439 WeakPolarHBondContact O-CB 3.33Å; L439-R441 PolarHBondContact O-N 3.02Å
440	G	94.9	Very high	93	Very high	55 Å²	55	50 Å²	50	57%	0.567	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	-4.2	178.4	0	0	0	0	0	115.3	C432 L438	C432-G440 PolarHBondContact O-N 2.87Å; L438-G440 PolarHBondContact O-N 2.79Å
441	R	95.6	Very high	92.9	Very high	80 Å²	80	50.5 Å²	50.5	30%	0.302	32%	0.324	S	S	.	.			trans	-79	145.2	173	-67	177	63.9	-171.2	-6.8	110.7	V431 C432 L438 L439 S445 I446 E450	V431-R441 WeakPolarHBondContact CA-O 3.45Å; C432-R441 PolarHBondContact N-O 2.95Å; L438-R441 WeakPolarHBondContact O-CB 3.3Å; L438-R441 PolarHBondContact O-N 2.93Å; L439-R441 PolarHBondContact O-N 3.02Å; R441-S445 PolarHBondContact NH2-O 2.86Å; R441-S445 VanDerWaalsContact NH2-O 3.09Å; R441-I446 HydrophobicContact CB-CD1 3.97Å; R441-I446 HydrophobicContact CB-CG1 4.13Å; R441-E450 IonicContact CZ-OE1 2.76Å; R441-E450 IonicContact CZ-OE2 3.54Å; R441-E450 IonicContact NH1-OE1 2.78Å; R441-E450 IonicContact NH1-OE2 3.17Å; R441-E450 PolarHBondContact NH1-OE2 2.88Å; R441-E450 IonicContact NH2-OE1 3.38Å; R441-E450 PolarHBondContact NH2-OE1 2.84Å; R441-E450 IonicContact NH2-OE2 3.09Å; R441-E450 PolarHBondContact NH2-OE2 3.09Å
442	S	94.3	Very high	92.7	Very high	40 Å²	40	52.4 Å²	52.4	28%	0.28	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-79.3	138.9	172.1	178	0	0	0	0	110.5	A430 L444 S445	A430-S442 VanDerWaalsContact O-CA 3.31Å; A430-S442 WeakPolarHBondContact O-CA 3.28Å; A430-S442 PolarHBondContact O-OG 2.68Å; S442-L444 PolarHBondContact O-N 3.02Å; S442-L444 VanDerWaalsContact O-N 3.07Å; S442-S445 WeakPolarHBondContact O-CB 3.41Å; S442-S445 PolarHBondContact O-N 3.34Å; S442-S445 PolarHBondContact O-OG 3.11Å
443	I	94	Very high	92.3	Very high	2 Å²	2	54 Å²	54	1%	0.01	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-57.6	-26.7	180	-153.8	171.1	0	0	0	113.1	M412 L415 L419 A430 S445 F451	M412-I443 HydrophobicContact CB-CD1 4.4Å; L415-I443 HydrophobicContact CB-CD1 3.93Å; L415-I443 HydrophobicContact CD2-CD1 3.97Å; L415-I443 HydrophobicContact CG-CD1 4.2Å; L419-I443 HydrophobicContact CD1-CG2 4.18Å; A430-I443 HydrophobicContact CB-CB 4.38Å; A430-I443 HydrophobicContact CB-CG2 3.59Å; A430-I443 PolarHBondContact O-N 2.86Å; I443-S445 PolarHBondContact O-N 3.49Å; I443-F451 HydrophobicContact CD1-CE1 4.2Å; I443-F451 HydrophobicContact CD1-CZ 4.39Å; I443-F451 HydrophobicContact CG1-CE1 3.86Å; I443-F451 HydrophobicContact CG1-CZ 3.66Å
444	L	91.3	Very high	91.9	Very high	45 Å²	45	59.3 Å²	59.3	24%	0.236	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-69.4	-16.5	177.2	-61.3	170.9	0	0	0	113.5	L419 K420 L425 S442	L419-L444 HydrophobicContact CB-CD2 3.94Å; L419-L444 HydrophobicContact CD1-CD2 4.27Å; K420-L444 WeakPolarHBondContact CE-O 3.5Å; K420-L444 HydrophobicContact CG-CD2 4Å; K420-L444 PolarHBondContact NZ-O 2.9Å; L425-L444 HydrophobicContact CD2-CD1 3.75Å; L425-L444 HydrophobicContact CD2-CD2 3.69Å; L425-L444 HydrophobicContact CD2-CG 4.38Å; S442-L444 PolarHBondContact O-N 3.02Å; S442-L444 VanDerWaalsContact O-N 3.07Å
445	S	92.2	Very high	91.5	Very high	69 Å²	69	60.8 Å²	60.8	48%	0.483	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-110.8	10.1	-173.3	71.7	0	0	0	0	114.6	R441 S442 I443	R441-S445 PolarHBondContact NH2-O 2.86Å; R441-S445 VanDerWaalsContact NH2-O 3.09Å; S442-S445 WeakPolarHBondContact O-CB 3.41Å; S442-S445 PolarHBondContact O-N 3.34Å; S442-S445 PolarHBondContact O-OG 3.11Å; I443-S445 PolarHBondContact O-N 3.49Å
446	I	93.9	Very high	91.3	Very high	13 Å²	13	60.7 Å²	60.7	7%	0.067	37%	0.374	C	S	.	.	S	Bend	trans	-108.8	136.8	-176.8	-61.6	171.5	0	0	0	108.3	C432 L438 R441 E450 F451	C432-I446 WeakPolarHBondContact SG-CD1 3.15Å; L438-I446 HydrophobicContact CB-CD1 4.35Å; L438-I446 HydrophobicContact CD1-CD1 4.26Å; L438-I446 HydrophobicContact CD1-CG2 4.18Å; L438-I446 HydrophobicContact CD2-CD1 4.2Å; L438-I446 HydrophobicContact CD2-CG1 4.38Å; L438-I446 HydrophobicContact CD2-CG2 4.12Å; R441-I446 HydrophobicContact CB-CD1 3.97Å; R441-I446 HydrophobicContact CB-CG1 4.13Å; I446-E450 HydrophobicContact CG2-CB 3.64Å; I446-E450 HydrophobicContact CG2-CG 4.34Å; I446-F451 HydrophobicContact CB-CE2 3.88Å; I446-F451 HydrophobicContact CB-CZ 3.88Å; I446-F451 HydrophobicContact CG2-CD2 3.97Å; I446-F451 HydrophobicContact CG2-CE1 4.42Å; I446-F451 HydrophobicContact CG2-CE2 3.43Å; I446-F451 VanDerWaalsContact CG2-CE2 3.43Å; I446-F451 HydrophobicContact CG2-CZ 3.7Å
447	S	91.9	Very high	91.2	Very high	50 Å²	50	56.7 Å²	56.7	35%	0.35	34%	0.341	S	S	.	.			trans	-71.3	144.1	175.8	-162.7	0	0	0	0	110	D449 E450 F451	S447-D449 PolarHBondContact O-N 3.38Å; S447-D449 VanDerWaalsContact O-N 3.07Å; S447-D449 PolarHBondContact OG-OD2 2.86Å; S447-E450 PolarHBondContact N-OE1 3.02Å; S447-E450 WeakPolarHBondContact O-CB 3.44Å; S447-E450 PolarHBondContact O-N 3.08Å; S447-F451 WeakPolarHBondContact O-CD2 3.29Å
448	P	90.4	Very high	91.1	Very high	62 Å²	62	54.8 Å²	54.8	40%	0.403	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-52.3	-31.5	176.2	-28.5	36.7	0	0	0	113.9	Q413 E450	Q413-P448 HydrophobicContact CG-CB 4.15Å; Q413-P448 PolarHBondContact NE2-O 3.35Å; P448-E450 VanDerWaalsContact C-N 3.3Å; P448-E450 PolarHBondContact O-N 2.86Å
449	D	90.8	Very high	91	Very high	140 Å²	140	54.4 Å²	54.4	75%	0.749	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-75.5	-12.4	179.5	-42.1	-68.4	0	0	0	114.3	S447 F451	S447-D449 PolarHBondContact O-N 3.38Å; S447-D449 VanDerWaalsContact O-N 3.07Å; S447-D449 PolarHBondContact OG-OD2 2.86Å; D449-F451 VanDerWaalsContact C-N 3.32Å
450	E	93.3	Very high	90.9	Very high	72 Å²	72	53.8 Å²	53.8	34%	0.336	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-82.5	-10.3	177.3	-63.7	-177.6	-90.6	0	0	112.6	L438 R441 I446 S447 P448	L438-E450 HydrophobicContact CD2-CB 4.38Å; R441-E450 IonicContact CZ-OE1 2.76Å; R441-E450 IonicContact CZ-OE2 3.54Å; R441-E450 IonicContact NH1-OE1 2.78Å; R441-E450 IonicContact NH1-OE2 3.17Å; R441-E450 PolarHBondContact NH1-OE2 2.88Å; R441-E450 IonicContact NH2-OE1 3.38Å; R441-E450 PolarHBondContact NH2-OE1 2.84Å; R441-E450 IonicContact NH2-OE2 3.09Å; R441-E450 PolarHBondContact NH2-OE2 3.09Å; I446-E450 HydrophobicContact CG2-CB 3.64Å; I446-E450 HydrophobicContact CG2-CG 4.34Å; S447-E450 PolarHBondContact N-OE1 3.02Å; S447-E450 WeakPolarHBondContact O-CB 3.44Å; S447-E450 PolarHBondContact O-N 3.08Å; P448-E450 VanDerWaalsContact C-N 3.3Å; P448-E450 PolarHBondContact O-N 2.86Å
451	F	93.1	Very high	90.9	Very high	14 Å²	14	52.3 Å²	52.3	6%	0.061	28%	0.28	C	S	.	.			trans	-89.6	104.3	179.7	-66.2	-91.6	0	0	0	110.6	C408 D409 Q413 I443 I446 S447 D449	C408-F451 HydrophobicContact CB-CD1 4.14Å; C408-F451 HydrophobicContact CB-CE1 3.89Å; D409-F451 WeakPolarHBondContact O-CD1 3.22Å; Q413-F451 HydrophobicContact CB-CB 3.96Å; Q413-F451 HydrophobicContact CB-CD2 4.26Å; Q413-F451 HydrophobicContact CB-CG 4.03Å; Q413-F451 HydrophobicContact CG-CB 4.13Å; Q413-F451 HydrophobicContact CG-CD2 4Å; Q413-F451 HydrophobicContact CG-CG 4.21Å; I443-F451 HydrophobicContact CD1-CE1 4.2Å; I443-F451 HydrophobicContact CD1-CZ 4.39Å; I443-F451 HydrophobicContact CG1-CE1 3.86Å; I443-F451 HydrophobicContact CG1-CZ 3.66Å; I446-F451 HydrophobicContact CB-CE2 3.88Å; I446-F451 HydrophobicContact CB-CZ 3.88Å; I446-F451 HydrophobicContact CG2-CD2 3.97Å; I446-F451 HydrophobicContact CG2-CE1 4.42Å; I446-F451 HydrophobicContact CG2-CE2 3.43Å; I446-F451 VanDerWaalsContact CG2-CE2 3.43Å; I446-F451 HydrophobicContact CG2-CZ 3.7Å; S447-F451 WeakPolarHBondContact O-CD2 3.29Å; D449-F451 VanDerWaalsContact C-N 3.32Å
452	V	91.6	Very high	90.8	Very high	74 Å²	74	52.5 Å²	52.5	45%	0.448	29%	0.29	S	S	.	.			trans	-121.7	148.9	-174.3	-163.7	0	0	0	0	110.5	D409 C410 D454	D409-V452 WeakPolarHBondContact CA-O 3.27Å; D409-V452 WeakPolarHBondContact CB-O 3.5Å; C410-V452 PolarHBondContact N-O 3.2Å; V452-D454 HydrophobicContact CG1-CB 4.3Å; V452-D454 VanDerWaalsContact CG1-CG 3.5Å; V452-D454 WeakPolarHBondContact CG1-OD2 3.32Å
453	C	87.1	Confident	90.9	Very high	35 Å²	35	53.8 Å²	53.8	24%	0.236	30%	0.296	C	S	.	.			trans	-108.8	20	-177.5	-83.4	0	0	0	0	114.4	C410 H411 D455	C410-C453 VanDerWaalsContact CA-SG 3.54Å; C410-C453 HydrophobicContact CB-CB 3.92Å; C410-C453 WeakPolarHBondContact CB-SG 3.28Å; C410-C453 PolarHBondContact N-SG 3.46Å; C410-C453 WeakPolarHBondContact SG-CB 3.33Å; C410-C453 CovalentContact SG-SG 2.03Å; C410-C453 PolarHBondContact SG-SG 2.92Å; H411-C453 VanDerWaalsContact CD2-SG 3.6Å; C453-D455 PolarHBondContact O-N 2.8Å
454	D	83.9	Confident	90.9	Very high	145 Å²	145	56.8 Å²	56.8	78%	0.775	31%	0.311	S	S	*	.	S	Bend	trans	-66.2	-20.1	178.2	-61.9	-15.6	0	0	0	112.5	V452	V452-D454 HydrophobicContact CG1-CB 4.3Å; V452-D454 VanDerWaalsContact CG1-CG 3.5Å; V452-D454 WeakPolarHBondContact CG1-OD2 3.32Å
455	D	83.1	Confident	91.2	Very high	61 Å²	61	55.1 Å²	55.1	33%	0.326	30%	0.302	S	S	.	.			trans	-124	126.9	-178.3	-168	-5.8	0	0	0	110.3	H434 C453 P457 S485	H434-D455 IonicContact CE1-OD2 3.15Å; H434-D455 PolarHBondContact CE1-OD2 3.4Å; H434-D455 IonicContact NE2-OD2 3.06Å; H434-D455 PolarHBondContact NE2-OD2 3.12Å; C453-D455 PolarHBondContact O-N 2.8Å; D455-P457 WeakPolarHBondContact O-CD 3.22Å; D455-S485 VanDerWaalsContact OD1-CB 3.3Å; D455-S485 WeakPolarHBondContact OD1-CB 3.35Å; D455-S485 PolarHBondContact OD1-OG 2.84Å
456	F	86.8	Confident	91.4	Very high	40 Å²	40	59.3 Å²	59.3	18%	0.175	31%	0.314	C	S	.	.			trans	-125.8	73.5	-178.4	54.4	-79.6	0	0	0	110	K458 R460 S484 S485 Q516	F456-K458 PolarHBondContact O-N 3.1Å; F456-K458 VanDerWaalsContact O-O 3.12Å; F456-R460 HydrophobicContact CD2-CG 4.11Å; F456-S484 PolarHBondContact O-OG 2.67Å; F456-S484 VanDerWaalsContact O-OG 3.12Å; F456-S485 PolarHBondContact N-OG 3.34Å; F456-S485 PolarHBondContact O-OG 2.97Å; F456-S485 VanDerWaalsContact O-OG 3.13Å; F456-Q516 HydrophobicContact CZ-CG 4.29Å
457	P	88.2	Confident	91.5	Very high	3 Å²	3	63.4 Å²	63.4	2%	0.019	34%	0.34	C	S	.	.			trans	-71.5	-13.2	-172.2	32.9	-41.3	0	0	0	113.4	L407 D455 S484 N542 F544	L407-P457 HydrophobicContact CD2-CG 3.85Å; D455-P457 WeakPolarHBondContact O-CD 3.22Å; P457-S484 PolarHBondContact O-OG 3.44Å; P457-S484 VanDerWaalsContact O-OG 3.08Å; P457-N542 PolarHBondContact O-ND2 2.79Å; P457-F544 HydrophobicContact CB-CB 4.41Å; P457-F544 HydrophobicContact CB-CD1 4.25Å; P457-F544 HydrophobicContact CB-CD2 3.63Å; P457-F544 HydrophobicContact CB-CE1 4.38Å; P457-F544 HydrophobicContact CB-CE2 3.79Å; P457-F544 HydrophobicContact CB-CG 3.84Å; P457-F544 HydrophobicContact CB-CZ 4.15Å; P457-F544 HydrophobicContact CG-CD1 4.26Å; P457-F544 HydrophobicContact CG-CD2 4.45Å; P457-F544 HydrophobicContact CG-CG 4.19Å; P457-F544 WeakPolarHBondContact O-CD2 3.48Å
458	K	89.1	Confident	91.7	Very high	26 Å²	26	62.3 Å²	62.3	11%	0.113	33%	0.332	C	S	.	.	S	Bend	trans	-79.9	137.5	169	-173.4	-178.9	-178.6	-170	0	109.9	S361 L407 F456 R460 F544 S546 N547	S361-K458 PolarHBondContact OG-NZ 2.7Å; L407-K458 HydrophobicContact CD1-CB 4.15Å; F456-K458 PolarHBondContact O-N 3.1Å; F456-K458 VanDerWaalsContact O-O 3.12Å; K458-R460 PolarHBondContact O-N 3Å; K458-F544 HydrophobicContact CB-CB 4.4Å; K458-S546 VanDerWaalsContact CE-C 3.47Å; K458-S546 WeakPolarHBondContact CE-O 3.44Å; K458-S546 PolarHBondContact NZ-O 2.77Å; K458-N547 WeakPolarHBondContact CE-OD1 3.49Å; K458-N547 PolarHBondContact NZ-OD1 3.29Å
459	P	91.8	Very high	91.9	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-63.6	128.6	-177	-18.6	32.1	0	0	0	111.2	M490 V540 N542 N547	P459-M490 HydrophobicContact CB-SD 4.09Å; P459-M490 HydrophobicContact CG-SD 4.31Å; P459-V540 HydrophobicContact CB-CB 4.45Å; P459-V540 HydrophobicContact CB-CG1 4Å; P459-V540 HydrophobicContact CG-CG1 4.41Å; P459-N542 WeakPolarHBondContact CD-OD1 3.37Å; P459-N542 HydrophobicContact CG-CB 4.04Å; P459-N547 WeakPolarHBondContact O-CB 3.15Å; P459-N547 PolarHBondContact O-ND2 3.36Å
460	R	92.1	Very high	92.1	Very high	103 Å²	103	57.4 Å²	57.4	39%	0.389	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	122.3	173.6	-70.3	-177.5	170	175.6	-3.8	109.1	F456 K458 A482 S483	F456-R460 HydrophobicContact CD2-CG 4.11Å; K458-R460 PolarHBondContact O-N 3Å; R460-A482 CarbonylContact O-C 3.58Å; R460-A482 WeakPolarHBondContact O-CA 3.28Å; R460-S483 PolarHBondContact N-O 2.9Å; R460-S483 PolarHBondContact O-N 2.7Å
461	I	94.3	Very high	92.1	Very high	25 Å²	25	56.3 Å²	56.3	13%	0.128	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	127.7	174.4	-65.7	167.9	0	0	0	108.1	T463 H464 V481 A482 V540 N547 Y548	I461-T463 WeakPolarHBondContact CG2-O 3.26Å; I461-H464 WeakPolarHBondContact CG2-ND1 2.96Å; I461-V481 CarbonylContact C-O 3.49Å; I461-V481 WeakPolarHBondContact CA-O 3.38Å; I461-V481 WeakPolarHBondContact CG2-O 3.29Å; I461-A482 HydrophobicContact CG1-CB 4.04Å; I461-V540 HydrophobicContact CD1-CG2 4.36Å; I461-V540 HydrophobicContact CG1-CG2 4.23Å; I461-N547 HydrophobicContact CD1-CB 4.3Å; I461-Y548 VanDerWaalsContact CD1-C 3.43Å
462	T	94.1	Very high	92.3	Very high	83 Å²	83	61.5 Å²	61.5	51%	0.509	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	-16.6	-178.2	54.8	0	0	0	0	112.6	V481	T462-V481 PolarHBondContact N-O 3.1Å; T462-V481 PolarHBondContact OG1-O 2.78Å
463	T	95.4	Very high	92.4	Very high	67 Å²	67	59.6 Å²	59.6	41%	0.411	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	123.3	170.6	-49.9	0	0	0	0	108.3	I461 C480 V481	I461-T463 WeakPolarHBondContact CG2-O 3.26Å; T463-C480 WeakPolarHBondContact O-CA 3.35Å; T463-V481 HydrophobicContact CG2-CG2 4.47Å; T463-V481 PolarHBondContact N-O 2.88Å; T463-V481 VanDerWaalsContact N-O 3.11Å; T463-V481 PolarHBondContact O-N 2.84Å
464	H	95.8	Very high	92.7	Very high	66 Å²	66	62.1 Å²	62.1	31%	0.306	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-96.1	156.5	177.7	-58	-76.3	0	0	0	109.8	I461 S549 N550	I461-H464 WeakPolarHBondContact CG2-ND1 2.96Å; H464-S549 WeakPolarHBondContact ND1-CA 3.39Å; H464-S549 WeakPolarHBondContact ND1-CB 3.44Å; H464-N550 HydrophobicContact CB-CB 4.2Å; H464-N550 PolarHBondContact ND1-N 3.43Å
465	P	96.8	Very high	93.3	Very high	10 Å²	10	60.6 Å²	60.6	7%	0.065	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-63.7	149.4	169.5	29.4	-34	0	0	0	110.5	L478 S479 W494 S549 A552	P465-L478 HydrophobicContact CB-CB 4.3Å; P465-S479 WeakPolarHBondContact CA-O 3.41Å; P465-W494 HydrophobicContact CB-CH2 4.05Å; P465-W494 HydrophobicContact CB-CZ3 4.01Å; P465-W494 HydrophobicContact CG-CH2 4.38Å; P465-W494 HydrophobicContact CG-CZ3 4.1Å; P465-S549 WeakPolarHBondContact CD-OG 3.29Å; P465-A552 HydrophobicContact CB-CB 3.82Å; P465-A552 HydrophobicContact CG-CB 3.94Å
466	E	96.3	Very high	93.8	Very high	157 Å²	157	59.4 Å²	59.4	73%	0.734	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-100.1	136.5	179.9	-64.2	-174.6	167.5	0	0	111.1	S468	E466-S468 PolarHBondContact O-N 2.86Å; E466-S468 PolarHBondContact O-OG 3.09Å
467	T	96.8	Very high	94.3	Very high	99 Å²	99	61.3 Å²	61.3	61%	0.607	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-57	127.5	167.9	-73.4	0	0	0	0	109.1	M553	T467-M553 CarbonylContact C-O 3.53Å; T467-M553 VanDerWaalsContact CA-O 3.28Å; T467-M553 WeakPolarHBondContact CA-O 3.37Å; T467-M553 HydrophobicContact CG2-CB 4Å; T467-M553 WeakPolarHBondContact CG2-O 3.34Å; T467-M553 PolarHBondContact OG1-N 2.98Å
468	S	94.8	Very high	94.7	Very high	27 Å²	27	61.5 Å²	61.5	19%	0.189	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	158.9	-167.9	54.2	0	0	0	0	112.3	E466 M476 M553 L554 T555	E466-S468 PolarHBondContact O-N 2.86Å; E466-S468 PolarHBondContact O-OG 3.09Å; S468-M476 WeakPolarHBondContact OG-CE 3.19Å; S468-M553 PolarHBondContact N-O 2.85Å; S468-L554 WeakPolarHBondContact O-CA 3.34Å; S468-T555 PolarHBondContact O-N 2.81Å; S468-T555 VanDerWaalsContact O-N 3.09Å
469	V	94.6	Very high	95	Very high	90 Å²	90	62.5 Å²	62.5	55%	0.545	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	126.1	178.2	180	0	0	0	0	107.5	T555 N557	V469-T555 WeakPolarHBondContact CA-O 3.45Å; V469-N557 HydrophobicContact CG1-CB 4.26Å; V469-N557 VanDerWaalsContact CG1-ND2 3.32Å; V469-N557 WeakPolarHBondContact CG1-ND2 3.49Å
470	A	95.1	Very high	95.3	Very high	8 Å²	8	62.5 Å²	62.5	7%	0.066	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	152.5	176.6	0	0	0	0	0	111.3	M476 V528 L554 T555 I556 N557	A470-M476 HydrophobicContact CB-CB 4.49Å; A470-M476 HydrophobicContact CB-CE 3.85Å; A470-M476 HydrophobicContact CB-SD 3.88Å; A470-V528 HydrophobicContact CB-CG2 3.79Å; A470-L554 HydrophobicContact CB-CD1 3.96Å; A470-T555 PolarHBondContact N-O 2.85Å; A470-I556 HydrophobicContact CB-CD1 3.88Å; A470-N557 PolarHBondContact O-N 3.3Å
471	L	94.6	Very high	95.5	Very high	50 Å²	50	58.2 Å²	58.2	26%	0.262	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	132.8	170.2	-62.3	179.1	0	0	0	109.3	G473 N474 N557 M559 A639	L471-G473 PolarHBondContact O-N 3.2Å; L471-N474 WeakPolarHBondContact O-CB 3.47Å; L471-N474 PolarHBondContact O-N 2.96Å; L471-N557 CarbonylContact C-O 3.55Å; L471-N557 WeakPolarHBondContact CA-O 3.49Å; L471-N557 HydrophobicContact CD2-CB 4.37Å; L471-M559 HydrophobicContact CD1-CG 4.34Å; L471-M559 HydrophobicContact CD1-SD 4.46Å; L471-M559 HydrophobicContact CD2-CG 4.21Å; L471-A639 HydrophobicContact CD2-CB 3.36Å
472	R	95.4	Very high	95.5	Very high	123 Å²	123	57.1 Å²	57.1	46%	0.464	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	127.1	174.7	-174.1	-176.9	178.2	-166.5	-4.4	110.9	V528 I556 N557 E558	R472-V528 CarbonylContact C-O 3.44Å; R472-V528 WeakPolarHBondContact CA-O 3.41Å; R472-I556 HydrophobicContact CB-CG2 4.07Å; R472-N557 PolarHBondContact N-O 2.98Å; R472-E558 HydrophobicContact CB-CB 4.36Å; R472-E558 WeakPolarHBondContact CD-OE1 3.31Å; R472-E558 IonicContact CZ-OE1 2.97Å; R472-E558 IonicContact CZ-OE2 2.71Å; R472-E558 IonicContact NE-OE1 3.76Å; R472-E558 IonicContact NH1-OE1 2.7Å; R472-E558 PolarHBondContact NH1-OE1 2.8Å; R472-E558 IonicContact NH1-OE2 3.89Å; R472-E558 PolarHBondContact NH1-OE2 2.72Å
473	G	93.5	Very high	95.5	Very high	33 Å²	33	53.4 Å²	53.4	34%	0.34	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	89	-8.2	-179.1	0	0	0	0	0	115.8	L471 N527 V528	L471-G473 PolarHBondContact O-N 3.2Å; G473-N527 WeakPolarHBondContact CA-OD1 3.34Å; G473-N527 PolarHBondContact O-OD1 2.82Å; G473-V528 PolarHBondContact N-O 2.94Å
474	N	94.3	Very high	95.3	Very high	88 Å²	88	50.2 Å²	50.2	47%	0.471	28%	0.277	S	S	.	.	S	Bend	trans	-80.7	171.9	172.4	-73.9	-0.3	0	0	0	111.6	L471 N527 V528	L471-N474 WeakPolarHBondContact O-CB 3.47Å; L471-N474 PolarHBondContact O-N 2.96Å; N474-N527 CarbonylContact O-C 3.57Å; N474-N527 VanDerWaalsContact O-CA 3.25Å; N474-N527 WeakPolarHBondContact O-CA 3.31Å; N474-N527 PolarHBondContact O-N 2.88Å; N474-N527 VanDerWaalsContact O-N 3.14Å; N474-V528 VanDerWaalsContact O-CG2 3.24Å; N474-V528 WeakPolarHBondContact O-CG2 3.44Å; N474-V528 PolarHBondContact O-N 2.82Å
475	N	95.9	Very high	94.9	Very high	113 Å²	113	49.3 Å²	49.3	60%	0.604	28%	0.278	S	S	*	.			trans	-99.2	146.2	167.1	-62.3	-9.3	0	0	0	109.8	L525 L526 N527	N475-L525 CarbonylContact C-O 3.41Å; N475-L525 WeakPolarHBondContact CA-O 3.4Å; N475-L526 HydrophobicContact CB-CD2 4.18Å; N475-L526 WeakPolarHBondContact OD1-CA 3.46Å; N475-N527 PolarHBondContact OD1-N 2.87Å
476	M	94.7	Very high	94.4	Very high	36 Å²	36	50 Å²	50	18%	0.177	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	155.3	177.5	170.7	168.1	-95.6	0	0	110.6	S468 A470 L525 L554	S468-M476 WeakPolarHBondContact OG-CE 3.19Å; A470-M476 HydrophobicContact CB-CB 4.49Å; A470-M476 HydrophobicContact CB-CE 3.85Å; A470-M476 HydrophobicContact CB-SD 3.88Å; M476-L525 PolarHBondContact N-O 3Å; M476-L525 PolarHBondContact O-N 2.92Å; M476-L554 HydrophobicContact CE-CD1 4.28Å; M476-L554 HydrophobicContact SD-CD1 3.4Å; M476-L554 WeakPolarHBondContact SD-CD1 3.4Å; M476-L554 HydrophobicContact SD-CD2 4.18Å; M476-L554 HydrophobicContact SD-CG 4.43Å
477	T	96.2	Very high	93.8	Very high	81 Å²	81	48.2 Å²	48.2	50%	0.497	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	136.2	171.9	59.8	0	0	0	0	111.6	V522 L523 H524	T477-V522 HydrophobicContact CG2-CG1 4.1Å; T477-L523 CarbonylContact C-O 3.59Å; T477-L523 VanDerWaalsContact CA-O 3.22Å; T477-L523 WeakPolarHBondContact CA-O 3.27Å; T477-H524 VanDerWaalsContact CG2-ND1 3.33Å; T477-H524 WeakPolarHBondContact CG2-ND1 3.25Å
478	L	97.1	Very high	93.3	Very high	6 Å²	6	44.6 Å²	44.6	3%	0.031	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	133.3	166	-61.7	178.9	0	0	0	109.1	P465 W494 V522 L523 Y536	P465-L478 HydrophobicContact CB-CB 4.3Å; L478-W494 HydrophobicContact CB-CH2 3.69Å; L478-W494 HydrophobicContact CB-CZ3 3.77Å; L478-W494 HydrophobicContact CD1-CZ3 4.36Å; L478-W494 WeakPolarHBondContact O-CH2 3.33Å; L478-W494 WeakPolarHBondContact O-CZ2 3.41Å; L478-V522 CarbonylContact O-C 3.23Å; L478-V522 WeakPolarHBondContact O-CA 3.24Å; L478-L523 HydrophobicContact CB-CB 4.44Å; L478-L523 HydrophobicContact CD1-CD2 4.48Å; L478-L523 PolarHBondContact N-O 2.93Å; L478-L523 PolarHBondContact O-N 2.94Å; L478-Y536 VanDerWaalsContact CD1-CB 3.44Å; L478-Y536 HydrophobicContact CD1-CD1 3.87Å; L478-Y536 HydrophobicContact CD1-CD2 3.98Å; L478-Y536 HydrophobicContact CD1-CG 3.49Å; L478-Y536 VanDerWaalsContact CD1-CG 3.49Å
479	S	96.3	Very high	93.1	Very high	47 Å²	47	48.7 Å²	48.7	33%	0.329	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	146.5	-175.1	-173.6	0	0	0	0	111.7	P465	P465-S479 WeakPolarHBondContact CA-O 3.41Å
480	C	97.1	Very high	92.9	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	134.9	177.9	157.2	0	0	0	0	110.2	T463 W494 T520 T521 C538	T463-C480 WeakPolarHBondContact O-CA 3.35Å; C480-W494 HydrophobicContact CB-CH2 3.94Å; C480-W494 HydrophobicContact CB-CZ2 3.87Å; C480-T520 WeakPolarHBondContact O-CA 3.37Å; C480-T521 HydrophobicContact CB-CG2 3.71Å; C480-T521 PolarHBondContact N-O 3.19Å; C480-T521 PolarHBondContact O-N 3.2Å; C480-C538 HydrophobicContact CB-CB 3.45Å; C480-C538 VanDerWaalsContact CB-CB 3.45Å; C480-C538 WeakPolarHBondContact CB-SG 3.33Å; C480-C538 WeakPolarHBondContact SG-CB 3.35Å; C480-C538 CovalentContact SG-SG 2.02Å; C480-C538 PolarHBondContact SG-SG 3.16Å
481	V	95.8	Very high	92.8	Very high	14 Å²	14	48.6 Å²	48.6	9%	0.085	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	134.1	-177.8	-174	0	0	0	0	109	I461 T462 T463 I518 Y519 T520	I461-V481 CarbonylContact C-O 3.49Å; I461-V481 WeakPolarHBondContact CA-O 3.38Å; I461-V481 WeakPolarHBondContact CG2-O 3.29Å; T462-V481 PolarHBondContact N-O 3.1Å; T462-V481 PolarHBondContact OG1-O 2.78Å; T463-V481 HydrophobicContact CG2-CG2 4.47Å; T463-V481 PolarHBondContact N-O 2.88Å; T463-V481 VanDerWaalsContact N-O 3.11Å; T463-V481 PolarHBondContact O-N 2.84Å; V481-I518 HydrophobicContact CG1-CG2 3.44Å; V481-I518 VanDerWaalsContact CG1-CG2 3.44Å; V481-Y519 WeakPolarHBondContact CA-O 3.45Å; V481-T520 HydrophobicContact CG2-CG2 3.95Å
482	A	95.6	Very high	92.7	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.008	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	163.1	175.1	0	0	0	0	0	111.3	R460 I461 I518 Y519 V540	R460-A482 CarbonylContact O-C 3.58Å; R460-A482 WeakPolarHBondContact O-CA 3.28Å; I461-A482 HydrophobicContact CG1-CB 4.04Å; A482-I518 CarbonylContact O-C 3.4Å; A482-I518 WeakPolarHBondContact O-CA 3.23Å; A482-Y519 PolarHBondContact N-O 2.85Å; A482-Y519 PolarHBondContact O-N 3.47Å; A482-V540 HydrophobicContact CB-CB 4.02Å; A482-V540 HydrophobicContact CB-CG1 3.86Å; A482-V540 HydrophobicContact CB-CG2 3.86Å
483	S	93.6	Very high	92.6	Very high	6 Å²	6	43.6 Å²	43.6	4%	0.042	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	154.6	179.3	62.6	0	0	0	0	112.9	R460 Q516 L517	R460-S483 PolarHBondContact N-O 2.9Å; R460-S483 PolarHBondContact O-N 2.7Å; S483-Q516 VanDerWaalsContact CB-NE2 3.27Å; S483-Q516 PolarHBondContact OG-NE2 2.86Å; S483-L517 WeakPolarHBondContact CA-O 3.37Å
484	S	90.6	Very high	92.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	153.5	176.2	-169.4	0	0	0	0	111.2	F456 P457 S486 Q516 L517	F456-S484 PolarHBondContact O-OG 2.67Å; F456-S484 VanDerWaalsContact O-OG 3.12Å; P457-S484 PolarHBondContact O-OG 3.44Å; P457-S484 VanDerWaalsContact O-OG 3.08Å; S484-S486 VanDerWaalsContact C-N 3.31Å; S484-S486 PolarHBondContact OG-N 2.8Å; S484-S486 VanDerWaalsContact OG-N 3.16Å; S484-Q516 WeakPolarHBondContact O-CG 3.31Å; S484-L517 PolarHBondContact N-O 3.14Å; S484-L517 VanDerWaalsContact N-O 3.14Å; S484-L517 PolarHBondContact O-N 3.49Å
485	S	88	Confident	92.6	Very high	47 Å²	47	39 Å²	39	33%	0.329	24%	0.236	S	C	.	.	S	Bend	trans	-78.6	-13.1	166.4	51.2	0	0	0	0	113.1	D455 F456	D455-S485 VanDerWaalsContact OD1-CB 3.3Å; D455-S485 WeakPolarHBondContact OD1-CB 3.35Å; D455-S485 PolarHBondContact OD1-OG 2.84Å; F456-S485 PolarHBondContact N-OG 3.34Å; F456-S485 PolarHBondContact O-OG 2.97Å; F456-S485 VanDerWaalsContact O-OG 3.13Å
486	S	85.6	Confident	92.4	Very high	23 Å²	23	35.2 Å²	35.2	16%	0.161	22%	0.215	C	C	.	.	S	Bend	trans	-93.9	136.1	177.8	-172.7	0	0	0	0	112.2	S484 S488 F544	S484-S486 VanDerWaalsContact C-N 3.31Å; S484-S486 PolarHBondContact OG-N 2.8Å; S484-S486 VanDerWaalsContact OG-N 3.16Å; S486-S488 PolarHBondContact O-N 3.32Å; S486-S488 VanDerWaalsContact O-N 3.08Å; S486-S488 WeakPolarHBondContact OG-CB 3.45Å; S486-S488 PolarHBondContact OG-N 2.72Å; S486-S488 PolarHBondContact OG-OG 3.48Å; S486-F544 WeakPolarHBondContact OG-CE2 3.25Å
487	D	84.3	Confident	92.1	Very high	120 Å²	120	37.7 Å²	37.7	64%	0.642	23%	0.228	S	C	*	.			trans	-70.3	10	167	-65.2	-50.8	0	0	0	113.7	Y512	D487-Y512 PolarHBondContact OD1-OH 3.04Å
488	S	86.6	Confident	91.3	Very high	24 Å²	24	34.5 Å²	34.5	17%	0.168	21%	0.211	C	C	.	.	S	Bend	trans	-62.9	128.2	175.4	-67	0	0	0	0	110.8	S486 M490 F544	S486-S488 PolarHBondContact O-N 3.32Å; S486-S488 VanDerWaalsContact O-N 3.08Å; S486-S488 WeakPolarHBondContact OG-CB 3.45Å; S486-S488 PolarHBondContact OG-N 2.72Å; S486-S488 PolarHBondContact OG-OG 3.48Å; S488-M490 PolarHBondContact O-N 3.36Å; S488-F544 VanDerWaalsContact OG-CE2 3.3Å; S488-F544 WeakPolarHBondContact OG-CE2 3.43Å
489	P	89.6	Confident	90.6	Very high	112 Å²	112	37.3 Å²	37.3	73%	0.727	22%	0.224	S	C	*	.	P	Polyproline II helix	trans	-52.7	125.8	179.8	-28.1	35	0	0	0	112.1	N542	P489-N542 WeakPolarHBondContact O-CB 3.01Å
490	M	90.9	Very high	90.2	Very high	11 Å²	11	36.9 Å²	36.9	5%	0.054	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-86.8	145.9	172.3	-57.8	-165.5	-142.1	0	0	110.2	P459 S488 L517 Y519 V540 S541 N542	P459-M490 HydrophobicContact CB-SD 4.09Å; P459-M490 HydrophobicContact CG-SD 4.31Å; S488-M490 PolarHBondContact O-N 3.36Å; M490-L517 HydrophobicContact CE-CB 4.18Å; M490-L517 HydrophobicContact CE-CD2 3.85Å; M490-L517 HydrophobicContact CE-CG 3.9Å; M490-Y519 HydrophobicContact CB-CD2 3.81Å; M490-Y519 HydrophobicContact CB-CE2 4.11Å; M490-Y519 HydrophobicContact CB-CG 4.11Å; M490-Y519 HydrophobicContact CG-CD2 4.45Å; M490-Y519 HydrophobicContact SD-CG 4.32Å; M490-V540 HydrophobicContact CB-CG1 4.36Å; M490-V540 HydrophobicContact SD-CG1 4.08Å; M490-S541 CarbonylContact C-O 3.47Å; M490-S541 WeakPolarHBondContact CA-O 3.02Å; M490-N542 HydrophobicContact CG-CB 4.43Å
491	T	92.8	Very high	90	Very high	85 Å²	85	39.4 Å²	39.4	52%	0.521	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	148.8	175.3	51.1	0	0	0	0	107.7	S541	T491-S541 PolarHBondContact N-O 2.88Å; T491-S541 PolarHBondContact O-N 3.35Å; T491-S541 PolarHBondContact OG1-O 2.89Å
492	T	93	Very high	89.6	Confident	33 Å²	33	48.1 Å²	48.1	20%	0.202	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	146.9	-176.4	52.6	0	0	0	0	110.4	N508 Y519 T521 V539 V540	T492-N508 VanDerWaalsContact OG1-CG 3.31Å; T492-N508 PolarHBondContact OG1-ND2 3.42Å; T492-N508 PolarHBondContact OG1-OD1 2.85Å; T492-Y519 HydrophobicContact CG2-CD1 3.75Å; T492-Y519 HydrophobicContact CG2-CE1 3.51Å; T492-T521 HydrophobicContact CG2-CG2 4.1Å; T492-V539 VanDerWaalsContact CA-O 3.32Å; T492-V539 WeakPolarHBondContact CA-O 3.27Å; T492-V540 HydrophobicContact CG2-CG1 4.2Å; T492-V540 HydrophobicContact CG2-CG2 4.14Å
493	A	93.4	Very high	89.1	Confident	35 Å²	35	56 Å²	56	29%	0.289	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	139.7	170.5	0	0	0	0	0	108.3	V500 V539	A493-V500 HydrophobicContact CB-CG1 4.27Å; A493-V539 HydrophobicContact CB-CB 4.48Å; A493-V539 PolarHBondContact N-O 3.27Å; A493-V539 PolarHBondContact O-N 3.2Å
494	W	95.6	Very high	89	Confident	3 Å²	3	57.3 Å²	57.3	1%	0.011	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	144.7	169.1	-76.7	86.4	0	0	0	109.5	P465 L478 C480 L501 T521 L523 Q537 C538	P465-W494 HydrophobicContact CB-CH2 4.05Å; P465-W494 HydrophobicContact CB-CZ3 4.01Å; P465-W494 HydrophobicContact CG-CH2 4.38Å; P465-W494 HydrophobicContact CG-CZ3 4.1Å; L478-W494 HydrophobicContact CB-CH2 3.69Å; L478-W494 HydrophobicContact CB-CZ3 3.77Å; L478-W494 HydrophobicContact CD1-CZ3 4.36Å; L478-W494 WeakPolarHBondContact O-CH2 3.33Å; L478-W494 WeakPolarHBondContact O-CZ2 3.41Å; C480-W494 HydrophobicContact CB-CH2 3.94Å; C480-W494 HydrophobicContact CB-CZ2 3.87Å; W494-L501 HydrophobicContact CB-CD1 4.2Å; W494-L501 PolarHBondContact O-N 3.05Å; W494-T521 HydrophobicContact CZ2-CG2 4Å; W494-T521 PolarHBondContact NE1-OG1 2.83Å; W494-L523 HydrophobicContact CB-CD2 4.18Å; W494-L523 HydrophobicContact CD2-CB 3.64Å; W494-L523 HydrophobicContact CD2-CD2 3.93Å; W494-L523 HydrophobicContact CD2-CG 4.37Å; W494-L523 HydrophobicContact CE3-CB 4.11Å; W494-L523 HydrophobicContact CE3-CD2 3.85Å; W494-L523 HydrophobicContact CG-CB 3.93Å; W494-L523 HydrophobicContact CG-CD2 4.08Å; W494-L523 HydrophobicContact CG-CG 4.43Å; W494-L523 HydrophobicContact CH2-CB 4.41Å; W494-L523 HydrophobicContact CZ2-CB 3.98Å; W494-L523 HydrophobicContact CZ3-CB 4.47Å; W494-Q537 CarbonylContact C-O 3.49Å; W494-C538 HydrophobicContact CD2-CB 4.15Å; W494-C538 HydrophobicContact CE3-CB 4.16Å; W494-C538 HydrophobicContact CH2-CB 4.04Å; W494-C538 HydrophobicContact CZ2-CB 4.02Å; W494-C538 HydrophobicContact CZ3-CB 4.11Å
495	R	91.8	Very high	89.2	Confident	23 Å²	23	62.9 Å²	62.9	9%	0.087	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	150.5	172.3	-66.3	-178.2	179.5	-122.2	7.3	111	W334 G498 E499 V500 Y536 Q537 V539	W334-R495 VanDerWaalsContact CD2-NH1 3.34Å; W334-R495 VanDerWaalsContact CE2-NH1 3.34Å; R495-G498 PolarHBondContact NH1-O 3.43Å; R495-E499 CarbonylContact C-O 3.21Å; R495-E499 WeakPolarHBondContact CA-O 3.43Å; R495-E499 VanDerWaalsContact CB-O 3.27Å; R495-E499 WeakPolarHBondContact CB-O 3.48Å; R495-V500 HydrophobicContact CG-CG2 4.02Å; R495-Y536 CarbonylContact O-C 3.49Å; R495-Y536 VanDerWaalsContact O-CA 3.24Å; R495-Y536 WeakPolarHBondContact O-CA 3.24Å; R495-Q537 HydrophobicContact CB-CB 4.35Å; R495-Q537 PolarHBondContact N-O 2.86Å; R495-Q537 PolarHBondContact O-N 3.33Å; R495-V539 HydrophobicContact CG-CG2 4.32Å
496	K	92.6	Very high	89.5	Confident	33 Å²	33	62.9 Å²	62.9	14%	0.143	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	125.4	168.1	-176.8	-174.2	-173.1	-72.4	0	107.6	G498 E499 L501 T531 D532 E533 L535 Y536	K496-G498 PolarHBondContact O-N 3Å; K496-G498 VanDerWaalsContact O-N 3.09Å; K496-E499 PolarHBondContact N-O 3.1Å; K496-E499 WeakPolarHBondContact O-CB 3.32Å; K496-E499 PolarHBondContact O-N 3.43Å; K496-L501 HydrophobicContact CB-CD1 4.18Å; K496-L501 HydrophobicContact CB-CD2 3.9Å; K496-L501 HydrophobicContact CB-CG 4.21Å; K496-T531 WeakPolarHBondContact CE-O 3.46Å; K496-T531 PolarHBondContact NZ-O 2.8Å; K496-T531 VanDerWaalsContact NZ-O 3.11Å; K496-D532 VanDerWaalsContact CE-C 3.49Å; K496-D532 WeakPolarHBondContact CE-O 3.36Å; K496-E533 WeakPolarHBondContact CE-O 3.28Å; K496-E533 PolarHBondContact NZ-O 2.85Å; K496-L535 CarbonylContact C-O 3.59Å; K496-L535 WeakPolarHBondContact CA-O 3.41Å; K496-Y536 HydrophobicContact CB-CD1 4.27Å; K496-Y536 HydrophobicContact CB-CE1 4.02Å; K496-Y536 HydrophobicContact CD-CE1 4.23Å; K496-Y536 HydrophobicContact CD-CE2 4.19Å; K496-Y536 WeakPolarHBondContact CD-OH 3.42Å; K496-Y536 WeakPolarHBondContact CE-OH 3.2Å; K496-Y536 HydrophobicContact CG-CD2 4.5Å; K496-Y536 HydrophobicContact CG-CE1 4.11Å; K496-Y536 HydrophobicContact CG-CE2 4.01Å
497	D	86.8	Confident	90	Very high	88 Å²	88	66.6 Å²	66.6	47%	0.471	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	33.7	178.8	-51.6	-46	0	0	0	113.3	E499 G534 L535	D497-E499 VanDerWaalsContact C-N 3.33Å; D497-E499 PolarHBondContact O-N 2.59Å; D497-G534 VanDerWaalsContact OD1-CA 3.25Å; D497-G534 WeakPolarHBondContact OD1-CA 3.47Å; D497-L535 PolarHBondContact N-O 2.78Å; D497-L535 PolarHBondContact OD1-N 2.74Å
498	G	79.3	Confident	90.5	Very high	13 Å²	13	64 Å²	64	13%	0.134	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	-19.6	-176.9	0	0	0	0	0	115.4	R495 K496	R495-G498 PolarHBondContact NH1-O 3.43Å; K496-G498 PolarHBondContact O-N 3Å; K496-G498 VanDerWaalsContact O-N 3.09Å
499	E	82.9	Confident	90.8	Very high	66 Å²	66	68 Å²	68	31%	0.308	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	143.7	178.7	-68.2	-61.1	118.6	0	0	112.7	R286 H310 R495 K496 D497	R286-E499 IonicContact CZ-OE1 3.16Å; R286-E499 VanDerWaalsContact CZ-OE1 3.29Å; R286-E499 IonicContact CZ-OE2 2.64Å; R286-E499 IonicContact NH1-OE1 2.76Å; R286-E499 PolarHBondContact NH1-OE1 2.85Å; R286-E499 IonicContact NH1-OE2 2.75Å; R286-E499 PolarHBondContact NH1-OE2 2.98Å; R286-E499 VanDerWaalsContact NH2-CD 3.32Å; R286-E499 IonicContact NH2-OE1 3.22Å; R286-E499 PolarHBondContact NH2-OE1 2.81Å; R286-E499 IonicContact NH2-OE2 3.68Å; H310-E499 IonicContact CE1-OE1 3.87Å; H310-E499 PolarHBondContact CE1-OE1 2.93Å; H310-E499 IonicContact CG-OE1 3.32Å; H310-E499 IonicContact ND1-OE1 3.9Å; H310-E499 PolarHBondContact ND1-OE1 3.2Å; H310-E499 IonicContact NE2-OE1 4Å; R495-E499 CarbonylContact C-O 3.21Å; R495-E499 WeakPolarHBondContact CA-O 3.43Å; R495-E499 VanDerWaalsContact CB-O 3.27Å; R495-E499 WeakPolarHBondContact CB-O 3.48Å; K496-E499 PolarHBondContact N-O 3.1Å; K496-E499 WeakPolarHBondContact O-CB 3.32Å; K496-E499 PolarHBondContact O-N 3.43Å; D497-E499 VanDerWaalsContact C-N 3.33Å; D497-E499 PolarHBondContact O-N 2.59Å
500	V	88.3	Confident	90.8	Very high	37 Å²	37	65.3 Å²	65.3	22%	0.224	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	129.8	175.7	176.6	0	0	0	0	110.7	A493 R495 Y502	A493-V500 HydrophobicContact CB-CG1 4.27Å; R495-V500 HydrophobicContact CG-CG2 4.02Å; V500-Y502 HydrophobicContact CB-CE2 4.07Å; V500-Y502 HydrophobicContact CG1-CD1 4.32Å; V500-Y502 HydrophobicContact CG1-CD2 4.5Å; V500-Y502 HydrophobicContact CG1-CE1 4.07Å; V500-Y502 HydrophobicContact CG1-CE2 4.26Å; V500-Y502 WeakPolarHBondContact O-CD2 3.41Å; V500-Y502 PolarHBondContact O-N 3.05Å
501	L	92.3	Very high	90.7	Very high	54 Å²	54	69.5 Å²	69.5	28%	0.283	36%	0.358	S	S	.	.			trans	-85.2	98.1	175	-58.6	177.7	0	0	0	110	W494 K496 A504 L523 Y536	W494-L501 HydrophobicContact CB-CD1 4.2Å; W494-L501 PolarHBondContact O-N 3.05Å; K496-L501 HydrophobicContact CB-CD1 4.18Å; K496-L501 HydrophobicContact CB-CD2 3.9Å; K496-L501 HydrophobicContact CB-CG 4.21Å; L501-A504 HydrophobicContact CB-CB 3.81Å; L501-A504 HydrophobicContact CD1-CB 4.4Å; L501-L523 HydrophobicContact CD1-CD2 4.12Å; L501-Y536 HydrophobicContact CD1-CD1 4.29Å; L501-Y536 HydrophobicContact CD1-CE1 3.88Å
502	Y	87.4	Confident	90.4	Very high	196 Å²	196	72.7 Å²	72.7	77%	0.769	36%	0.362	S	S	*	.	S	Bend	trans	-75.5	-40.6	-177.9	-67.2	-79.9	0	0	0	113.7	V500	V500-Y502 HydrophobicContact CB-CE2 4.07Å; V500-Y502 HydrophobicContact CG1-CD1 4.32Å; V500-Y502 HydrophobicContact CG1-CD2 4.5Å; V500-Y502 HydrophobicContact CG1-CE1 4.07Å; V500-Y502 HydrophobicContact CG1-CE2 4.26Å; V500-Y502 WeakPolarHBondContact O-CD2 3.41Å; V500-Y502 PolarHBondContact O-N 3.05Å
503	D	86.9	Confident	89.9	Confident	167 Å²	167	75.3 Å²	75.3	89%	0.893	37%	0.372	S	S	*	.	S	Bend	trans	-104.7	24.3	-173.7	-58.8	-53.4	0	0	0	112.9
504	A	89.8	Confident	89.3	Confident	33 Å²	33	81.2 Å²	81.2	27%	0.273	40%	0.399	S	S	.	.			trans	-75	145.5	179	0	0	0	0	0	112.8	L501 V506 L523	L501-A504 HydrophobicContact CB-CB 3.81Å; L501-A504 HydrophobicContact CD1-CB 4.4Å; A504-V506 HydrophobicContact CB-CG2 3.92Å; A504-V506 PolarHBondContact O-N 3.25Å; A504-L523 HydrophobicContact CB-CD1 3.62Å
505	E	94.8	Very high	88.3	Confident	117 Å²	117	84.7 Å²	84.7	55%	0.547	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	97	170.1	-67.6	-167.4	-178.8	0	0	109.9	H524 L526	E505-H524 HydrophobicContact CB-CB 4.13Å; E505-H524 PolarHBondContact O-N 2.91Å; E505-L526 VanDerWaalsContact OE2-CD1 3.22Å; E505-L526 WeakPolarHBondContact OE2-CD1 3.48Å
506	V	95.8	Very high	87.7	Confident	48 Å²	48	86.3 Å²	86.3	29%	0.291	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	121.9	-178	-175.5	0	0	0	0	110.7	A504 N508 T521 V522 L523	A504-V506 HydrophobicContact CB-CG2 3.92Å; A504-V506 PolarHBondContact O-N 3.25Å; V506-N508 WeakPolarHBondContact CG1-ND2 3.45Å; V506-T521 WeakPolarHBondContact CG1-OG1 3.43Å; V506-V522 CarbonylContact C-O 3.5Å; V506-V522 WeakPolarHBondContact CA-O 3.37Å; V506-L523 HydrophobicContact CG2-CD1 4.09Å
507	E	95.8	Very high	87.2	Confident	101 Å²	101	85.7 Å²	85.7	47%	0.472	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	126.6	169.3	-175.2	178.9	-175.9	0	0	109.5	Y509 T521 V522 H524	E507-Y509 HydrophobicContact CG-CD1 4.37Å; E507-T521 CarbonylContact O-C 3.52Å; E507-T521 WeakPolarHBondContact O-CA 3.09Å; E507-V522 HydrophobicContact CB-CB 4.4Å; E507-V522 PolarHBondContact N-O 2.78Å; E507-V522 PolarHBondContact O-N 2.97Å; E507-H524 WeakPolarHBondContact CB-NE2 3.45Å; E507-H524 IonicContact OE2-CE1 2.73Å; E507-H524 IonicContact OE2-NE2 3.78Å; E507-H524 PolarHBondContact OE2-NE2 2.81Å; E507-H524 VanDerWaalsContact OE2-NE2 3.09Å
508	N	94.1	Very high	87.4	Confident	65 Å²	65	82.5 Å²	82.5	35%	0.348	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	126.4	-179.7	-68.4	-60.9	0	0	0	109.9	T492 V506 Y519 T520 T521	T492-N508 VanDerWaalsContact OG1-CG 3.31Å; T492-N508 PolarHBondContact OG1-ND2 3.42Å; T492-N508 PolarHBondContact OG1-OD1 2.85Å; V506-N508 WeakPolarHBondContact CG1-ND2 3.45Å; N508-Y519 HydrophobicContact CB-CE1 3.93Å; N508-T520 WeakPolarHBondContact CA-O 2.95Å; N508-T521 WeakPolarHBondContact OD1-CB 3.41Å; N508-T521 PolarHBondContact OD1-OG1 3.31Å
509	Y	92.9	Very high	88.1	Confident	107 Å²	107	84 Å²	84	42%	0.42	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	149.5	175.7	60.7	-89	0	0	0	112	E507 T520 V522	E507-Y509 HydrophobicContact CG-CD1 4.37Å; Y509-T520 HydrophobicContact CE1-CG2 3.83Å; Y509-T520 HydrophobicContact CE2-CG2 4.1Å; Y509-T520 PolarHBondContact N-O 2.92Å; Y509-T520 PolarHBondContact O-N 3.36Å; Y509-T520 WeakPolarHBondContact OH-CG2 3.43Å; Y509-V522 HydrophobicContact CE1-CG2 4.43Å
510	A	89.9	Confident	88.7	Confident	56 Å²	56	81 Å²	81	46%	0.463	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	142.1	179.6	0	0	0	0	0	111	L517 I518 Y519	A510-L517 HydrophobicContact CB-CD1 3.94Å; A510-I518 CarbonylContact C-O 3.51Å; A510-I518 VanDerWaalsContact CA-O 3.31Å; A510-I518 WeakPolarHBondContact CA-O 3.04Å; A510-Y519 HydrophobicContact CB-CD2 3.78Å; A510-Y519 HydrophobicContact CB-CE2 4.17Å
511	R	89.1	Confident	89.1	Confident	99 Å²	99	79.2 Å²	79.2	37%	0.374	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	139.1	173.8	65.6	-177.6	-176.4	-89.5	5.8	109.9	I518 T520	R511-I518 HydrophobicContact CG-CB 3.93Å; R511-I518 HydrophobicContact CG-CG2 4.39Å; R511-I518 PolarHBondContact N-O 3.36Å; R511-I518 PolarHBondContact O-N 3.09Å; R511-T520 PolarHBondContact NH1-OG1 3.1Å; R511-T520 VanDerWaalsContact NH1-OG1 3.14Å
512	Y	85.2	Confident	89.3	Confident	152 Å²	152	77.3 Å²	77.3	60%	0.596	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	126.5	165.7	-81.5	-88.7	0	0	0	108.9	D487 Q516 L517	D487-Y512 PolarHBondContact OD1-OH 3.04Å; Y512-Q516 WeakPolarHBondContact CA-O 3.37Å; Y512-L517 HydrophobicContact CD2-CD1 4.08Å; Y512-L517 HydrophobicContact CE1-CB 4.14Å; Y512-L517 HydrophobicContact CE1-CD1 4.32Å; Y512-L517 HydrophobicContact CE2-CD1 3.75Å
513	Q	82.7	Confident	89.8	Confident	89 Å²	89	68 Å²	68	42%	0.416	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	128.1	177.2	-174	173.9	-18.3	0	0	107.8	G515 Q516 I518	Q513-G515 PolarHBondContact O-N 2.71Å; Q513-G515 VanDerWaalsContact O-N 3.07Å; Q513-Q516 PolarHBondContact N-O 3.18Å; Q513-Q516 WeakPolarHBondContact O-CB 3.37Å; Q513-Q516 PolarHBondContact O-N 3.45Å; Q513-I518 HydrophobicContact CB-CD1 3.72Å; Q513-I518 HydrophobicContact CB-CG1 4.4Å; Q513-I518 HydrophobicContact CG-CD1 4.32Å
514	D	80.7	Confident	90.2	Very high	159 Å²	159	62.5 Å²	62.5	85%	0.85	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	32	179.7	-54	-44.2	0	0	0	115.2	Q516	D514-Q516 VanDerWaalsContact C-N 3.3Å
515	G	74.3	Confident	90.5	Very high	76 Å²	76	61.8 Å²	61.8	78%	0.784	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	1.1	-178.2	0	0	0	0	0	114.9	Q513	Q513-G515 PolarHBondContact O-N 2.71Å; Q513-G515 VanDerWaalsContact O-N 3.07Å
516	Q	79.9	Confident	90.5	Very high	57 Å²	57	60.4 Å²	60.4	27%	0.266	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	139.9	-178.6	-167	178.6	12.6	0	0	110.6	F456 S483 S484 Y512 Q513 D514 I518	F456-Q516 HydrophobicContact CZ-CG 4.29Å; S483-Q516 VanDerWaalsContact CB-NE2 3.27Å; S483-Q516 PolarHBondContact OG-NE2 2.86Å; S484-Q516 WeakPolarHBondContact O-CG 3.31Å; Y512-Q516 WeakPolarHBondContact CA-O 3.37Å; Q513-Q516 PolarHBondContact N-O 3.18Å; Q513-Q516 WeakPolarHBondContact O-CB 3.37Å; Q513-Q516 PolarHBondContact O-N 3.45Å; D514-Q516 VanDerWaalsContact C-N 3.3Å; Q516-I518 PolarHBondContact O-N 3.28Å
517	L	83.1	Confident	90.4	Very high	20 Å²	20	63.3 Å²	63.3	11%	0.105	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	112.7	172.1	-177.1	61.9	0	0	0	108.8	S483 S484 M490 A510 Y512	S483-L517 WeakPolarHBondContact CA-O 3.37Å; S484-L517 PolarHBondContact N-O 3.14Å; S484-L517 VanDerWaalsContact N-O 3.14Å; S484-L517 PolarHBondContact O-N 3.49Å; M490-L517 HydrophobicContact CE-CB 4.18Å; M490-L517 HydrophobicContact CE-CD2 3.85Å; M490-L517 HydrophobicContact CE-CG 3.9Å; A510-L517 HydrophobicContact CB-CD1 3.94Å; Y512-L517 HydrophobicContact CD2-CD1 4.08Å; Y512-L517 HydrophobicContact CE1-CB 4.14Å; Y512-L517 HydrophobicContact CE1-CD1 4.32Å; Y512-L517 HydrophobicContact CE2-CD1 3.75Å
518	I	90.4	Very high	90.4	Very high	20 Å²	20	58.5 Å²	58.5	10%	0.103	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	120.9	172.9	-57.1	-178	0	0	0	108.6	V481 A482 A510 R511 Q513 Q516	V481-I518 HydrophobicContact CG1-CG2 3.44Å; V481-I518 VanDerWaalsContact CG1-CG2 3.44Å; A482-I518 CarbonylContact O-C 3.4Å; A482-I518 WeakPolarHBondContact O-CA 3.23Å; A510-I518 CarbonylContact C-O 3.51Å; A510-I518 VanDerWaalsContact CA-O 3.31Å; A510-I518 WeakPolarHBondContact CA-O 3.04Å; R511-I518 HydrophobicContact CG-CB 3.93Å; R511-I518 HydrophobicContact CG-CG2 4.39Å; R511-I518 PolarHBondContact N-O 3.36Å; R511-I518 PolarHBondContact O-N 3.09Å; Q513-I518 HydrophobicContact CB-CD1 3.72Å; Q513-I518 HydrophobicContact CB-CG1 4.4Å; Q513-I518 HydrophobicContact CG-CD1 4.32Å; Q516-I518 PolarHBondContact O-N 3.28Å
519	Y	93.3	Very high	90.5	Very high	45 Å²	45	58.3 Å²	58.3	18%	0.176	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	136	175.9	-152.1	-86.2	0	0	0	109.5	V481 A482 M490 T492 N508 A510	V481-Y519 WeakPolarHBondContact CA-O 3.45Å; A482-Y519 PolarHBondContact N-O 2.85Å; A482-Y519 PolarHBondContact O-N 3.47Å; M490-Y519 HydrophobicContact CB-CD2 3.81Å; M490-Y519 HydrophobicContact CB-CE2 4.11Å; M490-Y519 HydrophobicContact CB-CG 4.11Å; M490-Y519 HydrophobicContact CG-CD2 4.45Å; M490-Y519 HydrophobicContact SD-CG 4.32Å; T492-Y519 HydrophobicContact CG2-CD1 3.75Å; T492-Y519 HydrophobicContact CG2-CE1 3.51Å; N508-Y519 HydrophobicContact CB-CE1 3.93Å; A510-Y519 HydrophobicContact CB-CD2 3.78Å; A510-Y519 HydrophobicContact CB-CE2 4.17Å
520	T	95.3	Very high	90.6	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.012	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133	176.4	-56.7	0	0	0	0	109	C480 V481 N508 Y509 R511 V522	C480-T520 WeakPolarHBondContact O-CA 3.37Å; V481-T520 HydrophobicContact CG2-CG2 3.95Å; N508-T520 WeakPolarHBondContact CA-O 2.95Å; Y509-T520 HydrophobicContact CE1-CG2 3.83Å; Y509-T520 HydrophobicContact CE2-CG2 4.1Å; Y509-T520 PolarHBondContact N-O 2.92Å; Y509-T520 PolarHBondContact O-N 3.36Å; Y509-T520 WeakPolarHBondContact OH-CG2 3.43Å; R511-T520 PolarHBondContact NH1-OG1 3.1Å; R511-T520 VanDerWaalsContact NH1-OG1 3.14Å; T520-V522 HydrophobicContact CG2-CG2 4.27Å
521	T	96.7	Very high	90.8	Very high	1 Å²	1	59 Å²	59	1%	0.006	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	132.2	175.1	-175.4	0	0	0	0	109.2	C480 T492 W494 V506 E507 N508 C538	C480-T521 HydrophobicContact CB-CG2 3.71Å; C480-T521 PolarHBondContact N-O 3.19Å; C480-T521 PolarHBondContact O-N 3.2Å; T492-T521 HydrophobicContact CG2-CG2 4.1Å; W494-T521 HydrophobicContact CZ2-CG2 4Å; W494-T521 PolarHBondContact NE1-OG1 2.83Å; V506-T521 WeakPolarHBondContact CG1-OG1 3.43Å; E507-T521 CarbonylContact O-C 3.52Å; E507-T521 WeakPolarHBondContact O-CA 3.09Å; N508-T521 WeakPolarHBondContact OD1-CB 3.41Å; N508-T521 PolarHBondContact OD1-OG1 3.31Å; T521-C538 HydrophobicContact CG2-CB 4.33Å
522	V	97.3	Very high	91.1	Very high	14 Å²	14	55.9 Å²	55.9	9%	0.085	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	116.7	179.2	-175.3	0	0	0	0	107.9	T477 L478 V506 E507 Y509 T520	T477-V522 HydrophobicContact CG2-CG1 4.1Å; L478-V522 CarbonylContact O-C 3.23Å; L478-V522 WeakPolarHBondContact O-CA 3.24Å; V506-V522 CarbonylContact C-O 3.5Å; V506-V522 WeakPolarHBondContact CA-O 3.37Å; E507-V522 HydrophobicContact CB-CB 4.4Å; E507-V522 PolarHBondContact N-O 2.78Å; E507-V522 PolarHBondContact O-N 2.97Å; Y509-V522 HydrophobicContact CE1-CG2 4.43Å; T520-V522 HydrophobicContact CG2-CG2 4.27Å
523	L	97.6	Very high	91.6	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	121	170	170.9	63.1	0	0	0	108.5	T477 L478 W494 L501 A504 V506 L525 Y536	T477-L523 CarbonylContact C-O 3.59Å; T477-L523 VanDerWaalsContact CA-O 3.22Å; T477-L523 WeakPolarHBondContact CA-O 3.27Å; L478-L523 HydrophobicContact CB-CB 4.44Å; L478-L523 HydrophobicContact CD1-CD2 4.48Å; L478-L523 PolarHBondContact N-O 2.93Å; L478-L523 PolarHBondContact O-N 2.94Å; W494-L523 HydrophobicContact CB-CD2 4.18Å; W494-L523 HydrophobicContact CD2-CB 3.64Å; W494-L523 HydrophobicContact CD2-CD2 3.93Å; W494-L523 HydrophobicContact CD2-CG 4.37Å; W494-L523 HydrophobicContact CE3-CB 4.11Å; W494-L523 HydrophobicContact CE3-CD2 3.85Å; W494-L523 HydrophobicContact CG-CB 3.93Å; W494-L523 HydrophobicContact CG-CD2 4.08Å; W494-L523 HydrophobicContact CG-CG 4.43Å; W494-L523 HydrophobicContact CH2-CB 4.41Å; W494-L523 HydrophobicContact CZ2-CB 3.98Å; W494-L523 HydrophobicContact CZ3-CB 4.47Å; L501-L523 HydrophobicContact CD1-CD2 4.12Å; A504-L523 HydrophobicContact CB-CD1 3.62Å; V506-L523 HydrophobicContact CG2-CD1 4.09Å; L523-L525 HydrophobicContact CD1-CD2 4.22Å; L523-L525 HydrophobicContact CD2-CD2 4.16Å; L523-L525 HydrophobicContact CD2-CG 4.42Å; L523-L525 HydrophobicContact CG-CD2 4.09Å; L523-L525 HydrophobicContact CG-CG 4.21Å; L523-Y536 HydrophobicContact CD2-CD1 3.53Å; L523-Y536 HydrophobicContact CD2-CE1 3.63Å
524	H	96.4	Very high	92.2	Very high	51 Å²	51	47.5 Å²	47.5	24%	0.236	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	124.5	173.9	-63.2	-89.4	0	0	0	109.2	T477 E505 E507	T477-H524 VanDerWaalsContact CG2-ND1 3.33Å; T477-H524 WeakPolarHBondContact CG2-ND1 3.25Å; E505-H524 HydrophobicContact CB-CB 4.13Å; E505-H524 PolarHBondContact O-N 2.91Å; E507-H524 WeakPolarHBondContact CB-NE2 3.45Å; E507-H524 IonicContact OE2-CE1 2.73Å; E507-H524 IonicContact OE2-NE2 3.78Å; E507-H524 PolarHBondContact OE2-NE2 2.81Å; E507-H524 VanDerWaalsContact OE2-NE2 3.09Å
525	L	95.7	Very high	92.8	Very high	17 Å²	17	42.5 Å²	42.5	9%	0.089	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	105.9	174.6	-61	175.2	0	0	0	107.7	N475 M476 L523 V528 Y536 L554	N475-L525 CarbonylContact C-O 3.41Å; N475-L525 WeakPolarHBondContact CA-O 3.4Å; M476-L525 PolarHBondContact N-O 3Å; M476-L525 PolarHBondContact O-N 2.92Å; L523-L525 HydrophobicContact CD1-CD2 4.22Å; L523-L525 HydrophobicContact CD2-CD2 4.16Å; L523-L525 HydrophobicContact CD2-CG 4.42Å; L523-L525 HydrophobicContact CG-CD2 4.09Å; L523-L525 HydrophobicContact CG-CG 4.21Å; L525-V528 HydrophobicContact CB-CG1 3.55Å; L525-V528 HydrophobicContact CD1-CG1 4.32Å; L525-Y536 HydrophobicContact CD1-CE1 4.17Å; L525-Y536 HydrophobicContact CD2-CE1 4.3Å; L525-L554 HydrophobicContact CD1-CD2 3.43Å; L525-L554 VanDerWaalsContact CD1-CD2 3.43Å
526	L	94.5	Very high	93.8	Very high	89 Å²	89	39 Å²	39	47%	0.466	20%	0.201	S	C	.	.			trans	-93	137.4	-176.9	-55.4	-173.1	0	0	0	111.2	N475 E505 V528	N475-L526 HydrophobicContact CB-CD2 4.18Å; N475-L526 WeakPolarHBondContact OD1-CA 3.46Å; E505-L526 VanDerWaalsContact OE2-CD1 3.22Å; E505-L526 WeakPolarHBondContact OE2-CD1 3.48Å; L526-V528 VanDerWaalsContact C-N 3.34Å; L526-V528 PolarHBondContact O-N 2.89Å
527	N	94.3	Very high	94.5	Very high	109 Å²	109	36.7 Å²	36.7	58%	0.583	19%	0.19	S	C	*	.	S	Bend	trans	50.1	51.6	176.6	-177.4	67.2	0	0	0	112.3	G473 N474 N475	G473-N527 WeakPolarHBondContact CA-OD1 3.34Å; G473-N527 PolarHBondContact O-OD1 2.82Å; N474-N527 CarbonylContact O-C 3.57Å; N474-N527 VanDerWaalsContact O-CA 3.25Å; N474-N527 WeakPolarHBondContact O-CA 3.31Å; N474-N527 PolarHBondContact O-N 2.88Å; N474-N527 VanDerWaalsContact O-N 3.14Å; N475-N527 PolarHBondContact OD1-N 2.87Å
528	V	95.5	Very high	95.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.185	C	C	.	.			trans	-55.4	142.8	-170.4	-84.9	0	0	0	0	113	A470 R472 G473 N474 L525 L526 D532 I556	A470-V528 HydrophobicContact CB-CG2 3.79Å; R472-V528 CarbonylContact C-O 3.44Å; R472-V528 WeakPolarHBondContact CA-O 3.41Å; G473-V528 PolarHBondContact N-O 2.94Å; N474-V528 VanDerWaalsContact O-CG2 3.24Å; N474-V528 WeakPolarHBondContact O-CG2 3.44Å; N474-V528 PolarHBondContact O-N 2.82Å; L525-V528 HydrophobicContact CB-CG1 3.55Å; L525-V528 HydrophobicContact CD1-CG1 4.32Å; L526-V528 VanDerWaalsContact C-N 3.34Å; L526-V528 PolarHBondContact O-N 2.89Å; V528-D532 WeakPolarHBondContact CA-OD2 3.36Å; V528-D532 HydrophobicContact CB-CB 4.47Å; V528-D532 HydrophobicContact CG1-CB 4.09Å; V528-I556 HydrophobicContact CB-CD1 3.98Å; V528-I556 HydrophobicContact CG1-CD1 4.48Å; V528-I556 HydrophobicContact CG2-CD1 4.21Å
529	N	95.9	Very high	95.3	Very high	60 Å²	60	35.1 Å²	35.1	32%	0.321	18%	0.182	S	C	.	.			trans	-138.2	172.5	-177.2	83.4	88.9	0	0	0	110.4	T531 D532	N529-T531 PolarHBondContact ND2-OG1 3.33Å; N529-T531 VanDerWaalsContact ND2-OG1 3.12Å; N529-T531 PolarHBondContact O-N 2.88Å; N529-T531 WeakPolarHBondContact OD1-CG2 3.38Å; N529-T531 PolarHBondContact OD1-N 3.3Å; N529-T531 PolarHBondContact OD1-OG1 2.85Å; N529-D532 PolarHBondContact N-OD2 2.91Å; N529-D532 PolarHBondContact ND2-OD2 2.81Å; N529-D532 WeakPolarHBondContact O-CA 3.47Å; N529-D532 VanDerWaalsContact O-CB 3.29Å; N529-D532 WeakPolarHBondContact O-CB 3.24Å; N529-D532 PolarHBondContact O-N 2.95Å
530	F	95.1	Very high	95.3	Very high	78 Å²	78	33 Å²	33	34%	0.342	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-60.4	-17.7	-174.9	-58.3	-64.5	0	0	0	115.1	D532 E533 I556 E558 H586	F530-D532 VanDerWaalsContact C-N 3.25Å; F530-D532 PolarHBondContact O-N 2.99Å; F530-E533 WeakPolarHBondContact O-CB 3.3Å; F530-E533 PolarHBondContact O-N 2.79Å; F530-I556 HydrophobicContact CD1-CB 3.93Å; F530-I556 HydrophobicContact CD1-CG2 3.83Å; F530-I556 HydrophobicContact CE1-CB 4.33Å; F530-I556 HydrophobicContact CE1-CG2 3.97Å; F530-I556 WeakPolarHBondContact CE1-O 3.36Å; F530-E558 HydrophobicContact CZ-CB 4.05Å; F530-E558 WeakPolarHBondContact CZ-OE2 3.3Å; F530-H586 HydrophobicContact CE1-CB 3.83Å; F530-H586 AromaticContact CE1-CG 3.75Å; F530-H586 AromaticContact CE1-ND1 3.6Å; F530-H586 HydrophobicContact CZ-CB 3.8Å
531	T	94.4	Very high	95.1	Very high	101 Å²	101	34 Å²	34	62%	0.62	18%	0.181	S	C	*	.	G	3₁₀ helix	trans	-73.4	-19.1	171.8	68	0	0	0	0	113.3	K496 N529 E533	K496-T531 WeakPolarHBondContact CE-O 3.46Å; K496-T531 PolarHBondContact NZ-O 2.8Å; K496-T531 VanDerWaalsContact NZ-O 3.11Å; N529-T531 PolarHBondContact ND2-OG1 3.33Å; N529-T531 VanDerWaalsContact ND2-OG1 3.12Å; N529-T531 PolarHBondContact O-N 2.88Å; N529-T531 WeakPolarHBondContact OD1-CG2 3.38Å; N529-T531 PolarHBondContact OD1-N 3.3Å; N529-T531 PolarHBondContact OD1-OG1 2.85Å; T531-E533 VanDerWaalsContact C-N 3.31Å
532	D	94.9	Very high	94.9	Very high	32 Å²	32	34.2 Å²	34.2	17%	0.171	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-82.4	-8.8	175.5	-52.9	-52.8	0	0	0	111.9	K496 V528 N529 F530 G534 Y536	K496-D532 VanDerWaalsContact CE-C 3.49Å; K496-D532 WeakPolarHBondContact CE-O 3.36Å; V528-D532 WeakPolarHBondContact CA-OD2 3.36Å; V528-D532 HydrophobicContact CB-CB 4.47Å; V528-D532 HydrophobicContact CG1-CB 4.09Å; N529-D532 PolarHBondContact N-OD2 2.91Å; N529-D532 PolarHBondContact ND2-OD2 2.81Å; N529-D532 WeakPolarHBondContact O-CA 3.47Å; N529-D532 VanDerWaalsContact O-CB 3.29Å; N529-D532 WeakPolarHBondContact O-CB 3.24Å; N529-D532 PolarHBondContact O-N 2.95Å; F530-D532 VanDerWaalsContact C-N 3.25Å; F530-D532 PolarHBondContact O-N 2.99Å; D532-G534 PolarHBondContact O-N 3.27Å; D532-Y536 VanDerWaalsContact O-CE2 3.23Å; D532-Y536 WeakPolarHBondContact O-CE2 3.42Å; D532-Y536 PolarHBondContact O-OH 2.82Å
533	E	95.5	Very high	94.4	Very high	60 Å²	60	40.4 Å²	40.4	28%	0.28	21%	0.21	S	C	.	.			trans	-66.4	128.6	172.6	176.7	133.5	-162.8	0	0	110.8	K496 F530 T531 L554 T555 I556	K496-E533 WeakPolarHBondContact CE-O 3.28Å; K496-E533 PolarHBondContact NZ-O 2.85Å; F530-E533 WeakPolarHBondContact O-CB 3.3Å; F530-E533 PolarHBondContact O-N 2.79Å; T531-E533 VanDerWaalsContact C-N 3.31Å; E533-L554 VanDerWaalsContact CA-O 3.28Å; E533-L554 WeakPolarHBondContact CA-O 3.32Å; E533-L554 WeakPolarHBondContact CG-O 3.34Å; E533-T555 WeakPolarHBondContact OE1-CA 3.48Å; E533-T555 WeakPolarHBondContact OE1-CB 3.49Å; E533-T555 WeakPolarHBondContact OE1-CG2 3.23Å; E533-T555 PolarHBondContact OE1-OG1 3.34Å; E533-T555 VanDerWaalsContact OE1-OG1 3.1Å; E533-I556 HydrophobicContact CB-CG1 4.06Å; E533-I556 PolarHBondContact OE2-N 2.97Å
534	G	94.8	Very high	93.8	Very high	6 Å²	6	41.8 Å²	41.8	6%	0.062	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.1	-178.9	-178.9	0	0	0	0	0	115	D497 D532 Y536 L554	D497-G534 VanDerWaalsContact OD1-CA 3.25Å; D497-G534 WeakPolarHBondContact OD1-CA 3.47Å; D532-G534 PolarHBondContact O-N 3.27Å; G534-Y536 WeakPolarHBondContact O-CD2 3.24Å; G534-L554 PolarHBondContact N-O 3.09Å; G534-L554 VanDerWaalsContact N-O 3.1Å; G534-L554 PolarHBondContact O-N 2.74Å
535	L	94.1	Very high	93.4	Very high	54 Å²	54	39.4 Å²	39.4	28%	0.283	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	107.6	179.4	-73.3	170.5	0	0	0	111.3	K496 D497 R551 A552 M553	K496-L535 CarbonylContact C-O 3.59Å; K496-L535 WeakPolarHBondContact CA-O 3.41Å; D497-L535 PolarHBondContact N-O 2.78Å; D497-L535 PolarHBondContact OD1-N 2.74Å; L535-R551 HydrophobicContact CB-CB 4.48Å; L535-R551 HydrophobicContact CD2-CB 4.19Å; L535-A552 CarbonylContact C-O 3.54Å; L535-M553 HydrophobicContact CD2-CB 4Å; L535-M553 HydrophobicContact CD2-CE 3.78Å; L535-M553 HydrophobicContact CD2-SD 4.12Å; L535-M553 HydrophobicContact CG-CE 3.83Å; L535-M553 HydrophobicContact CG-SD 4.22Å
536	Y	95.9	Very high	93	Very high	3 Å²	3	39.2 Å²	39.2	1%	0.012	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	142.8	178.7	-73.3	-98.5	0	0	0	112.9	L478 R495 K496 L501 L523 L525 D532 G534 R551 A552 L554	L478-Y536 VanDerWaalsContact CD1-CB 3.44Å; L478-Y536 HydrophobicContact CD1-CD1 3.87Å; L478-Y536 HydrophobicContact CD1-CD2 3.98Å; L478-Y536 HydrophobicContact CD1-CG 3.49Å; L478-Y536 VanDerWaalsContact CD1-CG 3.49Å; R495-Y536 CarbonylContact O-C 3.49Å; R495-Y536 VanDerWaalsContact O-CA 3.24Å; R495-Y536 WeakPolarHBondContact O-CA 3.24Å; K496-Y536 HydrophobicContact CB-CD1 4.27Å; K496-Y536 HydrophobicContact CB-CE1 4.02Å; K496-Y536 HydrophobicContact CD-CE1 4.23Å; K496-Y536 HydrophobicContact CD-CE2 4.19Å; K496-Y536 WeakPolarHBondContact CD-OH 3.42Å; K496-Y536 WeakPolarHBondContact CE-OH 3.2Å; K496-Y536 HydrophobicContact CG-CD2 4.5Å; K496-Y536 HydrophobicContact CG-CE1 4.11Å; K496-Y536 HydrophobicContact CG-CE2 4.01Å; L501-Y536 HydrophobicContact CD1-CD1 4.29Å; L501-Y536 HydrophobicContact CD1-CE1 3.88Å; L523-Y536 HydrophobicContact CD2-CD1 3.53Å; L523-Y536 HydrophobicContact CD2-CE1 3.63Å; L525-Y536 HydrophobicContact CD1-CE1 4.17Å; L525-Y536 HydrophobicContact CD2-CE1 4.3Å; D532-Y536 VanDerWaalsContact O-CE2 3.23Å; D532-Y536 WeakPolarHBondContact O-CE2 3.42Å; D532-Y536 PolarHBondContact O-OH 2.82Å; G534-Y536 WeakPolarHBondContact O-CD2 3.24Å; Y536-R551 CarbonylContact O-C 3.27Å; Y536-R551 WeakPolarHBondContact O-CA 3.43Å; Y536-A552 PolarHBondContact N-O 3.29Å; Y536-A552 PolarHBondContact O-N 2.88Å; Y536-L554 HydrophobicContact CD2-CB 3.89Å; Y536-L554 HydrophobicContact CE2-CB 3.8Å; Y536-L554 HydrophobicContact CE2-CD2 3.86Å; Y536-L554 HydrophobicContact CE2-CG 4.41Å
537	Q	94.7	Very high	92.8	Very high	8 Å²	8	37.1 Å²	37.1	4%	0.037	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	134.5	179	-166	-173.8	46.9	0	0	110	D338 W494 R495 S549 R551	D338-Q537 PolarHBondContact OD1-NE2 2.01Å; D338-Q537 PolarHBondContact OD2-NE2 2.88Å; D338-Q537 PolarHBondContact OD2-OE1 2.87Å; W494-Q537 CarbonylContact C-O 3.49Å; R495-Q537 HydrophobicContact CB-CB 4.35Å; R495-Q537 PolarHBondContact N-O 2.86Å; R495-Q537 PolarHBondContact O-N 3.33Å; Q537-S549 VanDerWaalsContact CG-O 3.32Å; Q537-S549 WeakPolarHBondContact CG-O 3.36Å; Q537-S549 WeakPolarHBondContact CG-OG 3.36Å; Q537-S549 PolarHBondContact NE2-O 2.83Å; Q537-R551 HydrophobicContact CB-CG 4.38Å; Q537-R551 HydrophobicContact CG-CG 4.4Å
538	C	95.4	Very high	92.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	145.2	166.8	75	0	0	0	0	110.2	C480 W494 T521 S549	C480-C538 HydrophobicContact CB-CB 3.45Å; C480-C538 VanDerWaalsContact CB-CB 3.45Å; C480-C538 WeakPolarHBondContact CB-SG 3.33Å; C480-C538 WeakPolarHBondContact SG-CB 3.35Å; C480-C538 CovalentContact SG-SG 2.02Å; C480-C538 PolarHBondContact SG-SG 3.16Å; W494-C538 HydrophobicContact CD2-CB 4.15Å; W494-C538 HydrophobicContact CE3-CB 4.16Å; W494-C538 HydrophobicContact CH2-CB 4.04Å; W494-C538 HydrophobicContact CZ2-CB 4.02Å; W494-C538 HydrophobicContact CZ3-CB 4.11Å; T521-C538 HydrophobicContact CG2-CB 4.33Å; C538-S549 PolarHBondContact N-OG 2.97Å; C538-S549 PolarHBondContact O-N 3.48Å; C538-S549 WeakPolarHBondContact SG-CB 3.34Å
539	V	93.4	Very high	92.6	Very high	6 Å²	6	33.4 Å²	33.4	4%	0.036	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	126.6	170.2	-170.9	0	0	0	0	107.4	T492 A493 R495 N547 Y548	T492-V539 VanDerWaalsContact CA-O 3.32Å; T492-V539 WeakPolarHBondContact CA-O 3.27Å; A493-V539 HydrophobicContact CB-CB 4.48Å; A493-V539 PolarHBondContact N-O 3.27Å; A493-V539 PolarHBondContact O-N 3.2Å; R495-V539 HydrophobicContact CG-CG2 4.32Å; V539-N547 WeakPolarHBondContact CA-O 3Å; V539-Y548 HydrophobicContact CB-CD1 4.32Å; V539-Y548 HydrophobicContact CB-CE1 4.37Å; V539-Y548 HydrophobicContact CG1-CD1 3.91Å; V539-Y548 HydrophobicContact CG1-CE1 3.63Å; V539-Y548 HydrophobicContact CG1-CG 4.49Å; V539-Y548 HydrophobicContact CG2-CD1 3.57Å; V539-Y548 HydrophobicContact CG2-CE1 3.77Å
540	V	93.9	Very high	92.5	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.012	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	123.3	175.7	-170.3	0	0	0	0	109.3	P459 I461 A482 M490 T492 S546 N547	P459-V540 HydrophobicContact CB-CB 4.45Å; P459-V540 HydrophobicContact CB-CG1 4Å; P459-V540 HydrophobicContact CG-CG1 4.41Å; I461-V540 HydrophobicContact CD1-CG2 4.36Å; I461-V540 HydrophobicContact CG1-CG2 4.23Å; A482-V540 HydrophobicContact CB-CB 4.02Å; A482-V540 HydrophobicContact CB-CG1 3.86Å; A482-V540 HydrophobicContact CB-CG2 3.86Å; M490-V540 HydrophobicContact CB-CG1 4.36Å; M490-V540 HydrophobicContact SD-CG1 4.08Å; T492-V540 HydrophobicContact CG2-CG1 4.2Å; T492-V540 HydrophobicContact CG2-CG2 4.14Å; V540-S546 WeakPolarHBondContact O-CA 3.38Å; V540-N547 PolarHBondContact N-O 2.82Å; V540-N547 PolarHBondContact O-N 2.89Å
541	S	92.3	Very high	92.3	Very high	21 Å²	21	35.6 Å²	35.6	15%	0.147	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	140.3	-169.8	-58	0	0	0	0	112	M490 T491 G545 S546	M490-S541 CarbonylContact C-O 3.47Å; M490-S541 WeakPolarHBondContact CA-O 3.02Å; T491-S541 PolarHBondContact N-O 2.88Å; T491-S541 PolarHBondContact O-N 3.35Å; T491-S541 PolarHBondContact OG1-O 2.89Å; S541-G545 WeakPolarHBondContact CA-O 3.31Å; S541-S546 WeakPolarHBondContact OG-CB 3.35Å; S541-S546 PolarHBondContact OG-OG 2.94Å
542	N	90.6	Very high	92.4	Very high	7 Å²	7	30.8 Å²	30.8	4%	0.037	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	-166.6	164.3	74.2	9.2	0	0	0	110	P457 P459 P489 M490 F544 G545	P457-N542 PolarHBondContact O-ND2 2.79Å; P459-N542 WeakPolarHBondContact CD-OD1 3.37Å; P459-N542 HydrophobicContact CG-CB 4.04Å; P489-N542 WeakPolarHBondContact O-CB 3.01Å; M490-N542 HydrophobicContact CG-CB 4.43Å; N542-F544 PolarHBondContact O-N 2.99Å; N542-F544 WeakPolarHBondContact OD1-CA 3.47Å; N542-F544 WeakPolarHBondContact OD1-CB 3.36Å; N542-F544 PolarHBondContact OD1-N 2.8Å; N542-G545 PolarHBondContact N-O 2.95Å; N542-G545 PolarHBondContact O-N 2.98Å
543	H	86.8	Confident	92.5	Very high	144 Å²	144	32.7 Å²	32.7	67%	0.667	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-29.2	178.9	-169.7	74.4	0	0	0	113.4
544	F	86.2	Confident	92.5	Very high	30 Å²	30	29.9 Å²	29.9	13%	0.132	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	1.4	-179.1	-61.4	-75.1	0	0	0	115	M384 L407 H434 P457 K458 S486 S488 N542	M384-F544 HydrophobicContact CE-CB 4.49Å; M384-F544 HydrophobicContact CE-CD1 4.15Å; M384-F544 VanDerWaalsContact SD-O 3.4Å; L407-F544 HydrophobicContact CD2-CB 4.45Å; L407-F544 HydrophobicContact CD2-CD1 3.65Å; L407-F544 HydrophobicContact CD2-CE1 4.28Å; L407-F544 HydrophobicContact CD2-CG 4.41Å; H434-F544 HydrophobicContact CB-CE1 4.36Å; P457-F544 HydrophobicContact CB-CB 4.41Å; P457-F544 HydrophobicContact CB-CD1 4.25Å; P457-F544 HydrophobicContact CB-CD2 3.63Å; P457-F544 HydrophobicContact CB-CE1 4.38Å; P457-F544 HydrophobicContact CB-CE2 3.79Å; P457-F544 HydrophobicContact CB-CG 3.84Å; P457-F544 HydrophobicContact CB-CZ 4.15Å; P457-F544 HydrophobicContact CG-CD1 4.26Å; P457-F544 HydrophobicContact CG-CD2 4.45Å; P457-F544 HydrophobicContact CG-CG 4.19Å; P457-F544 WeakPolarHBondContact O-CD2 3.48Å; K458-F544 HydrophobicContact CB-CB 4.4Å; S486-F544 WeakPolarHBondContact OG-CE2 3.25Å; S488-F544 VanDerWaalsContact OG-CE2 3.3Å; S488-F544 WeakPolarHBondContact OG-CE2 3.43Å; N542-F544 PolarHBondContact O-N 2.99Å; N542-F544 WeakPolarHBondContact OD1-CA 3.47Å; N542-F544 WeakPolarHBondContact OD1-CB 3.36Å; N542-F544 PolarHBondContact OD1-N 2.8Å
545	G	86.8	Confident	92.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	134.1	-179.7	171.8	0	0	0	0	0	114.1	S541 N542	S541-G545 WeakPolarHBondContact CA-O 3.31Å; N542-G545 PolarHBondContact N-O 2.95Å; N542-G545 PolarHBondContact O-N 2.98Å
546	S	89	Confident	92.7	Very high	13 Å²	13	29 Å²	29	9%	0.091	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	141.6	176.8	-47.5	0	0	0	0	110.2	E337 K458 V540 S541	E337-S546 WeakPolarHBondContact OE2-CB 2.98Å; K458-S546 VanDerWaalsContact CE-C 3.47Å; K458-S546 WeakPolarHBondContact CE-O 3.44Å; K458-S546 PolarHBondContact NZ-O 2.77Å; V540-S546 WeakPolarHBondContact O-CA 3.38Å; S541-S546 WeakPolarHBondContact OG-CB 3.35Å; S541-S546 PolarHBondContact OG-OG 2.94Å
547	N	90.1	Very high	92.7	Very high	46 Å²	46	29.2 Å²	29.2	25%	0.246	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	151.9	162.5	-90.9	-19	0	0	0	109.8	K458 P459 I461 V539 V540	K458-N547 WeakPolarHBondContact CE-OD1 3.49Å; K458-N547 PolarHBondContact NZ-OD1 3.29Å; P459-N547 WeakPolarHBondContact O-CB 3.15Å; P459-N547 PolarHBondContact O-ND2 3.36Å; I461-N547 HydrophobicContact CD1-CB 4.3Å; V539-N547 WeakPolarHBondContact CA-O 3Å; V540-N547 PolarHBondContact N-O 2.82Å; V540-N547 PolarHBondContact O-N 2.89Å
548	Y	91.9	Very high	92.7	Very high	27 Å²	27	31.8 Å²	31.8	11%	0.106	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	140.5	-169.4	-57.4	-101	0	0	0	107.9	W334 E337 D338 I461 V539	W334-Y548 WeakPolarHBondContact CA-OH 3.41Å; W334-Y548 HydrophobicContact CB-CE1 3.57Å; W334-Y548 WeakPolarHBondContact CB-OH 3.22Å; E337-Y548 HydrophobicContact CB-CD2 4.37Å; E337-Y548 HydrophobicContact CB-CE2 3.46Å; E337-Y548 VanDerWaalsContact CB-CE2 3.46Å; E337-Y548 WeakPolarHBondContact O-CD2 3.42Å; E337-Y548 PolarHBondContact OE2-OH 3.26Å; D338-Y548 HydrophobicContact CB-CD1 4.24Å; D338-Y548 HydrophobicContact CB-CD2 4.39Å; D338-Y548 HydrophobicContact CB-CG 4.13Å; I461-Y548 VanDerWaalsContact CD1-C 3.43Å; V539-Y548 HydrophobicContact CB-CD1 4.32Å; V539-Y548 HydrophobicContact CB-CE1 4.37Å; V539-Y548 HydrophobicContact CG1-CD1 3.91Å; V539-Y548 HydrophobicContact CG1-CE1 3.63Å; V539-Y548 HydrophobicContact CG1-CG 4.49Å; V539-Y548 HydrophobicContact CG2-CD1 3.57Å; V539-Y548 HydrophobicContact CG2-CE1 3.77Å
549	S	94.1	Very high	92.6	Very high	4 Å²	4	37.2 Å²	37.2	3%	0.028	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-77.4	169.8	174.8	67.1	0	0	0	0	112.3	H464 P465 Q537 C538	H464-S549 WeakPolarHBondContact ND1-CA 3.39Å; H464-S549 WeakPolarHBondContact ND1-CB 3.44Å; P465-S549 WeakPolarHBondContact CD-OG 3.29Å; Q537-S549 VanDerWaalsContact CG-O 3.32Å; Q537-S549 WeakPolarHBondContact CG-O 3.36Å; Q537-S549 WeakPolarHBondContact CG-OG 3.36Å; Q537-S549 PolarHBondContact NE2-O 2.83Å; C538-S549 PolarHBondContact N-OG 2.97Å; C538-S549 PolarHBondContact O-N 3.48Å; C538-S549 WeakPolarHBondContact SG-CB 3.34Å
550	N	92.4	Very high	92.7	Very high	104 Å²	104	37.5 Å²	37.5	56%	0.556	19%	0.186	S	C	*	.	P	Polyproline II helix	trans	-51.7	148.4	153.6	-59.7	-12	0	0	0	109.6	H464	H464-N550 HydrophobicContact CB-CB 4.2Å; H464-N550 PolarHBondContact ND1-N 3.43Å
551	R	91.6	Very high	92.7	Very high	79 Å²	79	39.6 Å²	39.6	30%	0.298	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-82	128.5	172.3	-61.4	180	-180	176.6	-1.3	109.4	E313 L535 Y536 Q537	E313-R551 IonicContact OE2-CZ 2.73Å; E313-R551 IonicContact OE2-NH1 3.27Å; E313-R551 PolarHBondContact OE2-NH1 3.04Å; E313-R551 IonicContact OE2-NH2 2.84Å; E313-R551 PolarHBondContact OE2-NH2 3.44Å; E313-R551 VanDerWaalsContact OE2-NH2 3.1Å; L535-R551 HydrophobicContact CB-CB 4.48Å; L535-R551 HydrophobicContact CD2-CB 4.19Å; Y536-R551 CarbonylContact O-C 3.27Å; Y536-R551 WeakPolarHBondContact O-CA 3.43Å; Q537-R551 HydrophobicContact CB-CG 4.38Å; Q537-R551 HydrophobicContact CG-CG 4.4Å
552	A	96.3	Very high	92.8	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.008	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	124.4	174.4	0	0	0	0	0	109.2	P465 L535 Y536	P465-A552 HydrophobicContact CB-CB 3.82Å; P465-A552 HydrophobicContact CG-CB 3.94Å; L535-A552 CarbonylContact C-O 3.54Å; Y536-A552 PolarHBondContact N-O 3.29Å; Y536-A552 PolarHBondContact O-N 2.88Å
553	M	96.3	Very high	92.9	Very high	71 Å²	71	45.9 Å²	45.9	35%	0.35	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	130.2	171.1	-177.7	63.5	86	0	0	109.3	T467 S468 L535	T467-M553 CarbonylContact C-O 3.53Å; T467-M553 VanDerWaalsContact CA-O 3.28Å; T467-M553 WeakPolarHBondContact CA-O 3.37Å; T467-M553 HydrophobicContact CG2-CB 4Å; T467-M553 WeakPolarHBondContact CG2-O 3.34Å; T467-M553 PolarHBondContact OG1-N 2.98Å; S468-M553 PolarHBondContact N-O 2.85Å; L535-M553 HydrophobicContact CD2-CB 4Å; L535-M553 HydrophobicContact CD2-CE 3.78Å; L535-M553 HydrophobicContact CD2-SD 4.12Å; L535-M553 HydrophobicContact CG-CE 3.83Å; L535-M553 HydrophobicContact CG-SD 4.22Å
554	L	96.8	Very high	93	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	115.5	165.2	174.2	52.1	0	0	0	108.6	S468 A470 M476 L525 E533 G534 Y536 I556	S468-L554 WeakPolarHBondContact O-CA 3.34Å; A470-L554 HydrophobicContact CB-CD1 3.96Å; M476-L554 HydrophobicContact CE-CD1 4.28Å; M476-L554 HydrophobicContact SD-CD1 3.4Å; M476-L554 WeakPolarHBondContact SD-CD1 3.4Å; M476-L554 HydrophobicContact SD-CD2 4.18Å; M476-L554 HydrophobicContact SD-CG 4.43Å; L525-L554 HydrophobicContact CD1-CD2 3.43Å; L525-L554 VanDerWaalsContact CD1-CD2 3.43Å; E533-L554 VanDerWaalsContact CA-O 3.28Å; E533-L554 WeakPolarHBondContact CA-O 3.32Å; E533-L554 WeakPolarHBondContact CG-O 3.34Å; G534-L554 PolarHBondContact N-O 3.09Å; G534-L554 VanDerWaalsContact N-O 3.1Å; G534-L554 PolarHBondContact O-N 2.74Å; Y536-L554 HydrophobicContact CD2-CB 3.89Å; Y536-L554 HydrophobicContact CE2-CB 3.8Å; Y536-L554 HydrophobicContact CE2-CD2 3.86Å; Y536-L554 HydrophobicContact CE2-CG 4.41Å; L554-I556 HydrophobicContact CD1-CD1 3.86Å; L554-I556 HydrophobicContact CD2-CD1 4.15Å; L554-I556 HydrophobicContact CG-CD1 3.84Å
555	T	96	Very high	93.4	Very high	41 Å²	41	44.6 Å²	44.6	25%	0.252	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	136.1	172.4	-70.2	0	0	0	0	110.7	S468 V469 A470 E533	S468-T555 PolarHBondContact O-N 2.81Å; S468-T555 VanDerWaalsContact O-N 3.09Å; V469-T555 WeakPolarHBondContact CA-O 3.45Å; A470-T555 PolarHBondContact N-O 2.85Å; E533-T555 WeakPolarHBondContact OE1-CA 3.48Å; E533-T555 WeakPolarHBondContact OE1-CB 3.49Å; E533-T555 WeakPolarHBondContact OE1-CG2 3.23Å; E533-T555 PolarHBondContact OE1-OG1 3.34Å; E533-T555 VanDerWaalsContact OE1-OG1 3.1Å
556	I	96.5	Very high	93.7	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	115.4	-177.6	-55.4	-59.3	0	0	0	109.9	A470 R472 V528 F530 E533 L554 H586	A470-I556 HydrophobicContact CB-CD1 3.88Å; R472-I556 HydrophobicContact CB-CG2 4.07Å; V528-I556 HydrophobicContact CB-CD1 3.98Å; V528-I556 HydrophobicContact CG1-CD1 4.48Å; V528-I556 HydrophobicContact CG2-CD1 4.21Å; F530-I556 HydrophobicContact CD1-CB 3.93Å; F530-I556 HydrophobicContact CD1-CG2 3.83Å; F530-I556 HydrophobicContact CE1-CB 4.33Å; F530-I556 HydrophobicContact CE1-CG2 3.97Å; F530-I556 WeakPolarHBondContact CE1-O 3.36Å; E533-I556 HydrophobicContact CB-CG1 4.06Å; E533-I556 PolarHBondContact OE2-N 2.97Å; L554-I556 HydrophobicContact CD1-CD1 3.86Å; L554-I556 HydrophobicContact CD2-CD1 4.15Å; L554-I556 HydrophobicContact CG-CD1 3.84Å; I556-H586 PolarHBondContact O-ND1 2.92Å
557	N	95.6	Very high	93.9	Very high	9 Å²	9	51 Å²	51	5%	0.048	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	152.1	173.7	-65.9	-7.4	0	0	0	110.8	V469 A470 L471 R472 H586 A639	V469-N557 HydrophobicContact CG1-CB 4.26Å; V469-N557 VanDerWaalsContact CG1-ND2 3.32Å; V469-N557 WeakPolarHBondContact CG1-ND2 3.49Å; A470-N557 PolarHBondContact O-N 3.3Å; L471-N557 CarbonylContact C-O 3.55Å; L471-N557 WeakPolarHBondContact CA-O 3.49Å; L471-N557 HydrophobicContact CD2-CB 4.37Å; R472-N557 PolarHBondContact N-O 2.98Å; N557-H586 CarbonylContact C-O 3.09Å; N557-H586 VanDerWaalsContact CA-O 3.24Å; N557-H586 WeakPolarHBondContact CA-O 3.46Å; N557-H586 WeakPolarHBondContact CB-O 3.23Å; N557-A639 HydrophobicContact CB-CB 3.67Å
558	E	95	Very high	94.2	Very high	61 Å²	61	54.4 Å²	54.4	29%	0.285	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	121.3	174.2	178.6	157.3	-145	0	0	108	R472 F530 H586 N637	R472-E558 HydrophobicContact CB-CB 4.36Å; R472-E558 WeakPolarHBondContact CD-OE1 3.31Å; R472-E558 IonicContact CZ-OE1 2.97Å; R472-E558 IonicContact CZ-OE2 2.71Å; R472-E558 IonicContact NE-OE1 3.76Å; R472-E558 IonicContact NH1-OE1 2.7Å; R472-E558 PolarHBondContact NH1-OE1 2.8Å; R472-E558 IonicContact NH1-OE2 3.89Å; R472-E558 PolarHBondContact NH1-OE2 2.72Å; F530-E558 HydrophobicContact CZ-CB 4.05Å; F530-E558 WeakPolarHBondContact CZ-OE2 3.3Å; E558-H586 HydrophobicContact CB-CB 3.9Å; E558-H586 PolarHBondContact N-O 3.45Å; E558-H586 PolarHBondContact O-N 2.8Å; E558-H586 VanDerWaalsContact O-N 3.09Å; E558-N637 PolarHBondContact O-ND2 2.86Å
559	M	93.6	Very high	94.4	Very high	114 Å²	114	55.3 Å²	55.3	56%	0.562	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.4	144.4	177.1	-82.8	-163.4	-63.5	0	0	109.9	L471 A639	L471-M559 HydrophobicContact CD1-CG 4.34Å; L471-M559 HydrophobicContact CD1-SD 4.46Å; L471-M559 HydrophobicContact CD2-CG 4.21Å; M559-A639 HydrophobicContact CB-CB 4.41Å; M559-A639 HydrophobicContact CG-CB 3.86Å
560	P	94.7	Very high	94.4	Very high	13 Å²	13	59.3 Å²	59.3	8%	0.084	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	150.1	-172.9	18.6	-12.2	0	0	0	112.1	E584 P589 N637 L642	P560-E584 CarbonylContact C-O 3.27Å; P560-E584 WeakPolarHBondContact CA-O 3.42Å; P560-E584 WeakPolarHBondContact CB-O 3.39Å; P560-P589 HydrophobicContact CB-CB 3.7Å; P560-P589 HydrophobicContact CB-CG 3.9Å; P560-P589 HydrophobicContact CG-CB 4.23Å; P560-N637 WeakPolarHBondContact CD-OD1 3.05Å; P560-L642 VanDerWaalsContact C-CD2 3.49Å; P560-L642 HydrophobicContact CB-CD2 3.48Å; P560-L642 VanDerWaalsContact CB-CD2 3.48Å; P560-L642 HydrophobicContact CG-CD2 3.53Å; P560-L642 WeakPolarHBondContact O-CD1 3.22Å; P560-L642 VanDerWaalsContact O-CD2 3.24Å; P560-L642 WeakPolarHBondContact O-CD2 3.44Å
561	S	94.5	Very high	94.5	Very high	46 Å²	46	55.2 Å²	55.2	32%	0.322	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	133.8	-170.8	147.5	0	0	0	0	108.2	L563 A583 E584	S561-L563 PolarHBondContact O-N 2.92Å; S561-A583 CarbonylContact O-C 3.58Å; S561-A583 WeakPolarHBondContact O-CA 3.35Å; S561-A583 VanDerWaalsContact O-CB 3.3Å; S561-A583 WeakPolarHBondContact O-CB 3.45Å; S561-E584 PolarHBondContact N-O 2.79Å; S561-E584 PolarHBondContact O-N 2.85Å; S561-E584 PolarHBondContact OG-OE1 2.89Å
562	F	93.8	Very high	94.5	Very high	53 Å²	53	57.8 Å²	57.8	23%	0.232	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	113.8	179.6	-78.6	-53.2	0	0	0	111.5	T565 C581 A583 A635 L642 A644	F562-T565 HydrophobicContact CB-CG2 3.73Å; F562-T565 HydrophobicContact CD1-CG2 4.2Å; F562-T565 HydrophobicContact CD2-CG2 3.52Å; F562-T565 HydrophobicContact CE2-CG2 4.15Å; F562-T565 HydrophobicContact CG-CG2 3.57Å; F562-C581 VanDerWaalsContact CE1-SG 3.58Å; F562-A583 HydrophobicContact CD1-CB 4.23Å; F562-A635 HydrophobicContact CE1-CB 4.03Å; F562-L642 HydrophobicContact CB-CD1 4.35Å; F562-L642 HydrophobicContact CD1-CD1 4.22Å; F562-L642 HydrophobicContact CD1-CG 4.49Å; F562-L642 HydrophobicContact CD2-CD1 3.29Å; F562-L642 HydrophobicContact CD2-CG 3.92Å; F562-L642 HydrophobicContact CE1-CD1 4.37Å; F562-L642 HydrophobicContact CE1-CG 4.17Å; F562-L642 HydrophobicContact CE2-CB 4.21Å; F562-L642 HydrophobicContact CE2-CD1 3.49Å; F562-L642 VanDerWaalsContact CE2-CD1 3.49Å; F562-L642 HydrophobicContact CE2-CG 3.56Å; F562-L642 HydrophobicContact CG-CD1 3.68Å; F562-L642 HydrophobicContact CG-CG 4.36Å; F562-L642 HydrophobicContact CZ-CD1 4.04Å; F562-L642 HydrophobicContact CZ-CG 3.7Å; F562-A644 HydrophobicContact CD2-CB 4.21Å; F562-A644 HydrophobicContact CE2-CB 3.51Å; F562-A644 HydrophobicContact CZ-CB 3.72Å
563	L	91.9	Very high	94.3	Very high	106 Å²	106	60 Å²	60	56%	0.555	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	-35.3	163.9	-66.8	176.4	0	0	0	111.3	S561 A582 E584	S561-L563 PolarHBondContact O-N 2.92Å; L563-A582 HydrophobicContact CB-CB 3.89Å; L563-A582 PolarHBondContact N-O 3.03Å; L563-E584 HydrophobicContact CD1-CB 4.11Å; L563-E584 HydrophobicContact CD2-CG 4.25Å; L563-E584 HydrophobicContact CG-CB 4.18Å; L563-E584 HydrophobicContact CG-CG 4.22Å
564	K	90.9	Very high	93.9	Very high	87 Å²	87	59.1 Å²	59.1	38%	0.378	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	137.7	174.5	-58.8	178.9	-177.8	179.4	0	110.1	E580 C581 A582	K564-E580 HydrophobicContact CD-CB 4.02Å; K564-E580 WeakPolarHBondContact CD-OE2 3.47Å; K564-E580 WeakPolarHBondContact CE-OE2 3.15Å; K564-E580 IonicContact NZ-OE2 2.64Å; K564-E580 PolarHBondContact NZ-OE2 3.39Å; K564-C581 WeakPolarHBondContact O-CA 3.4Å; K564-A582 HydrophobicContact CB-CB 3.78Å; K564-A582 HydrophobicContact CD-CB 4.02Å; K564-A582 HydrophobicContact CG-CB 3.85Å; K564-A582 PolarHBondContact N-O 3.31Å; K564-A582 PolarHBondContact O-N 3.46Å
565	T	93.3	Very high	93.7	Very high	60 Å²	60	64.1 Å²	64.1	37%	0.368	34%	0.342	S	S	.	.			trans	-110.5	151.4	169.7	50.1	0	0	0	0	110.7	F562 E580 A644	F562-T565 HydrophobicContact CB-CG2 3.73Å; F562-T565 HydrophobicContact CD1-CG2 4.2Å; F562-T565 HydrophobicContact CD2-CG2 3.52Å; F562-T565 HydrophobicContact CE2-CG2 4.15Å; F562-T565 HydrophobicContact CG-CG2 3.57Å; T565-E580 CarbonylContact C-O 3.55Å; T565-E580 VanDerWaalsContact C-O 3.23Å; T565-A644 HydrophobicContact CG2-CB 3.67Å
566	P	93.2	Very high	93.6	Very high	7 Å²	7	65.9 Å²	65.9	5%	0.045	35%	0.353	C	S	.	.			trans	-64.3	147.4	172.3	28.3	-35.5	0	0	0	110.7	L579 E580 W593 C633 A644 A646	P566-L579 HydrophobicContact CB-CB 4.44Å; P566-E580 VanDerWaalsContact CA-O 3.28Å; P566-E580 WeakPolarHBondContact CA-O 3.46Å; P566-E580 VanDerWaalsContact N-O 3.08Å; P566-W593 HydrophobicContact CB-CH2 3.85Å; P566-W593 HydrophobicContact CB-CZ3 3.97Å; P566-W593 HydrophobicContact CG-CH2 4.23Å; P566-W593 HydrophobicContact CG-CZ3 4.16Å; P566-C633 HydrophobicContact CG-CB 4.15Å; P566-A644 HydrophobicContact CG-CB 4.37Å; P566-A646 HydrophobicContact CB-CB 3.66Å; P566-A646 HydrophobicContact CG-CB 4.2Å
567	M	93.8	Very high	93.4	Very high	140 Å²	140	66 Å²	66	69%	0.69	35%	0.354	S	S	*	.			trans	-122.2	148.8	178.4	-62.3	-174.8	-177.9	0	0	110.6	L569 A646	M567-L569 PolarHBondContact O-N 3.09Å; M567-A646 VanDerWaalsContact C-CB 3.44Å; M567-A646 WeakPolarHBondContact O-CB 3.46Å
568	D	96.6	Very high	93.2	Very high	118 Å²	118	71.7 Å²	71.7	63%	0.631	38%	0.375	S	S	*	.			trans	-52.8	128.4	177.3	-71.8	-21.1	0	0	0	111.4	T647	D568-T647 WeakPolarHBondContact CA-O 3.41Å; D568-T647 WeakPolarHBondContact OD1-CB 3.34Å; D568-T647 PolarHBondContact OD1-N 3.06Å; D568-T647 PolarHBondContact OD1-OG1 2.87Å
569	L	95.4	Very high	93.1	Very high	46 Å²	46	69 Å²	69	24%	0.241	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	121.4	-174	179.8	59.6	0	0	0	110.7	M567 A577 L579 T647 L648 T649	M567-L569 PolarHBondContact O-N 3.09Å; L569-A577 HydrophobicContact CD2-CB 3.74Å; L569-L579 HydrophobicContact CB-CD2 4.21Å; L569-L579 HydrophobicContact CD2-CD2 4.42Å; L569-T647 PolarHBondContact N-O 3.29Å; L569-L648 HydrophobicContact CB-CD1 4.16Å; L569-L648 HydrophobicContact CD2-CD1 4.1Å; L569-L648 HydrophobicContact CG-CD1 4.1Å; L569-L648 WeakPolarHBondContact O-CA 3.45Å; L569-T649 PolarHBondContact O-N 2.89Å
570	T	94.4	Very high	92.9	Very high	88 Å²	88	66.4 Å²	66.4	54%	0.54	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	119.1	171	-61	0	0	0	0	110	T649 L651	T570-T649 WeakPolarHBondContact CA-O 3.35Å; T570-T649 HydrophobicContact CG2-CG2 4.22Å; T570-L651 HydrophobicContact CG2-CD1 3.56Å; T570-L651 HydrophobicContact CG2-CD2 4.01Å; T570-L651 HydrophobicContact CG2-CG 3.69Å
571	I	93.7	Very high	92.7	Very high	19 Å²	19	65.8 Å²	65.8	10%	0.097	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	156.6	-172.1	-160.7	170.7	0	0	0	112.4	M575 T576 A577 V623 L648 T649 V650 L651	I571-M575 HydrophobicContact CD1-CB 3.74Å; I571-M575 HydrophobicContact CG1-CB 3.87Å; I571-M575 HydrophobicContact CG1-SD 4.31Å; I571-T576 VanDerWaalsContact CD1-C 3.41Å; I571-T576 WeakPolarHBondContact CD1-O 3.35Å; I571-A577 HydrophobicContact CD1-CB 4.31Å; I571-A577 HydrophobicContact CG2-CB 4.5Å; I571-V623 HydrophobicContact CG2-CB 4.4Å; I571-V623 HydrophobicContact CG2-CG1 4.08Å; I571-V623 HydrophobicContact CG2-CG2 4.37Å; I571-L648 HydrophobicContact CG2-CD1 3.93Å; I571-T649 PolarHBondContact N-O 3.33Å; I571-V650 CarbonylContact O-C 3.59Å; I571-V650 WeakPolarHBondContact O-CA 3.3Å; I571-L651 PolarHBondContact O-N 2.83Å
572	R	91.7	Very high	92.5	Very high	132 Å²	132	63.6 Å²	63.6	50%	0.498	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	149	175.2	-62.6	-179.4	-179.7	-155.4	-5.1	112	M575 L651 V730	R572-M575 HydrophobicContact CB-CG 4.29Å; R572-M575 HydrophobicContact CB-SD 3.95Å; R572-M575 WeakPolarHBondContact O-CB 3.48Å; R572-M575 PolarHBondContact O-N 2.95Å; R572-L651 CarbonylContact C-O 3.1Å; R572-L651 VanDerWaalsContact CA-O 3.25Å; R572-L651 WeakPolarHBondContact CA-O 3.26Å; R572-L651 HydrophobicContact CG-CB 4.41Å; R572-V730 HydrophobicContact CG-CG1 4.22Å
573	T	91.7	Very high	92.4	Very high	49 Å²	49	61.9 Å²	61.9	30%	0.301	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	141.7	174.1	50.9	0	0	0	0	112.1	M575 V623 T625 V650 L651 E652	T573-M575 VanDerWaalsContact C-N 3.26Å; T573-M575 PolarHBondContact O-N 2.93Å; T573-V623 CarbonylContact C-O 3.57Å; T573-V623 VanDerWaalsContact CA-O 3.26Å; T573-V623 WeakPolarHBondContact CA-O 3.33Å; T573-T625 HydrophobicContact CG2-CG2 4.21Å; T573-V650 HydrophobicContact CG2-CG1 3.63Å; T573-L651 PolarHBondContact N-O 3.18Å; T573-E652 HydrophobicContact CG2-CB 3.69Å; T573-E652 HydrophobicContact CG2-CG 3.94Å
574	G	88.8	Confident	92.5	Very high	52 Å²	52	61.6 Å²	61.6	54%	0.536	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	-10	179.9	0	0	0	0	0	115.4	V623	G574-V623 PolarHBondContact N-O 2.93Å
575	M	92.4	Very high	92.6	Very high	105 Å²	105	58.3 Å²	58.3	52%	0.517	31%	0.312	S	S	.	.	S	Bend	trans	-81.4	-179.7	170.2	-57.4	-169.7	73.2	0	0	111.5	I571 R572 T573 K622 V623	I571-M575 HydrophobicContact CD1-CB 3.74Å; I571-M575 HydrophobicContact CG1-CB 3.87Å; I571-M575 HydrophobicContact CG1-SD 4.31Å; R572-M575 HydrophobicContact CB-CG 4.29Å; R572-M575 HydrophobicContact CB-SD 3.95Å; R572-M575 WeakPolarHBondContact O-CB 3.48Å; R572-M575 PolarHBondContact O-N 2.95Å; T573-M575 VanDerWaalsContact C-N 3.26Å; T573-M575 PolarHBondContact O-N 2.93Å; M575-K622 CarbonylContact O-C 3.52Å; M575-K622 WeakPolarHBondContact O-CA 3.32Å; M575-K622 PolarHBondContact O-N 2.78Å; M575-V623 WeakPolarHBondContact O-CG2 3.45Å; M575-V623 PolarHBondContact O-N 2.97Å
576	T	93.3	Very high	92.6	Very high	78 Å²	78	59 Å²	59	48%	0.479	31%	0.311	S	S	.	.			trans	-107	120.1	176.7	-59.8	0	0	0	0	110.4	I571 F619 I620	I571-T576 VanDerWaalsContact CD1-C 3.41Å; I571-T576 WeakPolarHBondContact CD1-O 3.35Å; T576-F619 HydrophobicContact CG2-CB 4.23Å; T576-F619 HydrophobicContact CG2-CD2 4.18Å; T576-I620 CarbonylContact C-O 3.56Å; T576-I620 VanDerWaalsContact CA-O 3.26Å; T576-I620 WeakPolarHBondContact CA-O 3.48Å
577	A	92.9	Very high	92.6	Very high	3 Å²	3	61.3 Å²	61.3	3%	0.025	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	143.9	170.5	0	0	0	0	0	110.3	L569 I571 F619 I620 V623 L648	L569-A577 HydrophobicContact CD2-CB 3.74Å; I571-A577 HydrophobicContact CD1-CB 4.31Å; I571-A577 HydrophobicContact CG2-CB 4.5Å; A577-F619 CarbonylContact O-C 3.39Å; A577-F619 WeakPolarHBondContact O-CA 3.28Å; A577-F619 WeakPolarHBondContact O-CB 3.37Å; A577-I620 HydrophobicContact CB-CB 4.47Å; A577-I620 PolarHBondContact N-O 3.26Å; A577-I620 PolarHBondContact O-N 3.27Å; A577-V623 HydrophobicContact CB-CG2 3.58Å; A577-L648 HydrophobicContact CB-CD1 3.95Å; A577-L648 HydrophobicContact CB-CD2 4.21Å
578	R	91.8	Very high	92.5	Very high	128 Å²	128	59.6 Å²	59.6	48%	0.483	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	121.6	178.2	178.8	-176.3	172.1	107.4	-7.7	108.4	E580 I617 F618	R578-E580 IonicContact CZ-OE1 3.83Å; R578-E580 IonicContact NE-OE1 3.58Å; R578-E580 PolarHBondContact NE-OE1 3.43Å; R578-E580 IonicContact NH2-OE1 3.16Å; R578-E580 PolarHBondContact NH2-OE1 3Å; R578-I617 HydrophobicContact CG-CG2 3.78Å; R578-I617 VanDerWaalsContact CZ-CD1 3.48Å; R578-F618 WeakPolarHBondContact CA-O 3.32Å
579	L	91.9	Very high	92.3	Very high	5 Å²	5	55 Å²	55	3%	0.026	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	133.6	171.2	-60.2	174.5	0	0	0	107.3	P566 L569 W593 F618 Y631 A646	P566-L579 HydrophobicContact CB-CB 4.44Å; L569-L579 HydrophobicContact CB-CD2 4.21Å; L569-L579 HydrophobicContact CD2-CD2 4.42Å; L579-W593 HydrophobicContact CB-CH2 3.61Å; L579-W593 HydrophobicContact CB-CZ2 4.42Å; L579-W593 HydrophobicContact CB-CZ3 4.03Å; L579-W593 HydrophobicContact CD1-CH2 4.46Å; L579-W593 HydrophobicContact CD1-CZ3 4.02Å; L579-F618 HydrophobicContact CB-CB 4.44Å; L579-F618 HydrophobicContact CB-CD1 4.34Å; L579-F618 HydrophobicContact CD1-CD1 4.14Å; L579-F618 HydrophobicContact CD1-CE1 4.49Å; L579-F618 HydrophobicContact CG-CD1 4.48Å; L579-F618 PolarHBondContact N-O 2.84Å; L579-F618 PolarHBondContact O-N 2.81Å; L579-Y631 HydrophobicContact CD1-CD1 4.01Å; L579-Y631 HydrophobicContact CD1-CD2 4.26Å; L579-Y631 HydrophobicContact CD1-CG 3.69Å; L579-A646 HydrophobicContact CD2-CB 4.47Å
580	E	90.4	Very high	92.1	Very high	59 Å²	59	60.5 Å²	60.5	28%	0.276	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	137.5	177.9	-53.6	-163.3	171.5	0	0	109	K564 T565 P566 R578 D616 I617	K564-E580 HydrophobicContact CD-CB 4.02Å; K564-E580 WeakPolarHBondContact CD-OE2 3.47Å; K564-E580 WeakPolarHBondContact CE-OE2 3.15Å; K564-E580 IonicContact NZ-OE2 2.64Å; K564-E580 PolarHBondContact NZ-OE2 3.39Å; T565-E580 CarbonylContact C-O 3.55Å; T565-E580 VanDerWaalsContact C-O 3.23Å; P566-E580 VanDerWaalsContact CA-O 3.28Å; P566-E580 WeakPolarHBondContact CA-O 3.46Å; P566-E580 VanDerWaalsContact N-O 3.08Å; R578-E580 IonicContact CZ-OE1 3.83Å; R578-E580 IonicContact NE-OE1 3.58Å; R578-E580 PolarHBondContact NE-OE1 3.43Å; R578-E580 IonicContact NH2-OE1 3.16Å; R578-E580 PolarHBondContact NH2-OE1 3Å; E580-D616 WeakPolarHBondContact CA-O 3.32Å; E580-I617 HydrophobicContact CG-CG1 4.28Å
581	C	90.6	Very high	91.9	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.315	C	S	.	.			trans	-150.5	114	171.5	-172.2	0	0	0	0	109.3	F562 K564 I591 W593 D616 C633	F562-C581 VanDerWaalsContact CE1-SG 3.58Å; K564-C581 WeakPolarHBondContact O-CA 3.4Å; C581-I591 HydrophobicContact CB-CG2 4.46Å; C581-W593 HydrophobicContact CB-CH2 3.7Å; C581-W593 HydrophobicContact CB-CZ2 3.33Å; C581-D616 PolarHBondContact N-O 3.37Å; C581-D616 WeakPolarHBondContact O-CB 3.04Å; C581-C633 HydrophobicContact CB-CB 3.61Å; C581-C633 WeakPolarHBondContact CB-SG 3.47Å; C581-C633 WeakPolarHBondContact SG-CB 3.48Å; C581-C633 CovalentContact SG-SG 2.01Å; C581-C633 PolarHBondContact SG-SG 2.78Å
582	A	90.4	Very high	91.7	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.008	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	136.6	-175.3	0	0	0	0	0	108.5	L563 K564 D616	L563-A582 HydrophobicContact CB-CB 3.89Å; L563-A582 PolarHBondContact N-O 3.03Å; K564-A582 HydrophobicContact CB-CB 3.78Å; K564-A582 HydrophobicContact CD-CB 4.02Å; K564-A582 HydrophobicContact CG-CB 3.85Å; K564-A582 PolarHBondContact N-O 3.31Å; K564-A582 PolarHBondContact O-N 3.46Å; A582-D616 HydrophobicContact CB-CB 3.66Å; A582-D616 WeakPolarHBondContact CB-OD2 3.34Å
583	A	92	Very high	91.7	Very high	17 Å²	17	55.2 Å²	55.2	14%	0.14	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	143.5	175.4	0	0	0	0	0	112.1	S561 F562 P589 I591 A635	S561-A583 CarbonylContact O-C 3.58Å; S561-A583 WeakPolarHBondContact O-CA 3.35Å; S561-A583 VanDerWaalsContact O-CB 3.3Å; S561-A583 WeakPolarHBondContact O-CB 3.45Å; F562-A583 HydrophobicContact CD1-CB 4.23Å; A583-P589 HydrophobicContact CB-CB 4.42Å; A583-P589 HydrophobicContact CB-CG 3.69Å; A583-P589 VanDerWaalsContact O-CG 3.29Å; A583-P589 WeakPolarHBondContact O-CG 3.41Å; A583-I591 HydrophobicContact CB-CD1 4Å; A583-A635 HydrophobicContact CB-CB 3.45Å; A583-A635 VanDerWaalsContact CB-CB 3.45Å
584	E	93.4	Very high	91.7	Very high	100 Å²	100	56.5 Å²	56.5	47%	0.467	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	167.4	168.9	65.7	-172.7	175.2	0	0	110.1	P560 S561 L563	P560-E584 CarbonylContact C-O 3.27Å; P560-E584 WeakPolarHBondContact CA-O 3.42Å; P560-E584 WeakPolarHBondContact CB-O 3.39Å; S561-E584 PolarHBondContact N-O 2.79Å; S561-E584 PolarHBondContact O-N 2.85Å; S561-E584 PolarHBondContact OG-OE1 2.89Å; L563-E584 HydrophobicContact CD1-CB 4.11Å; L563-E584 HydrophobicContact CD2-CG 4.25Å; L563-E584 HydrophobicContact CG-CB 4.18Å; L563-E584 HydrophobicContact CG-CG 4.22Å
585	G	92.8	Very high	91.9	Very high	18 Å²	18	55 Å²	55	19%	0.186	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	154.1	169.6	178.9	0	0	0	0	0	111.6	P587 S588	G585-P587 CarbonylContact C-O 3.48Å; G585-P587 CarbonylContact O-C 3.37Å; G585-S588 WeakPolarHBondContact O-CA 3.4Å; G585-S588 PolarHBondContact O-N 3Å
586	H	93.4	Very high	92	Very high	73 Å²	73	54.5 Å²	54.5	34%	0.338	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	123	177.9	-169	-105.7	0	0	0	111.4	F530 I556 N557 E558 N637	F530-H586 HydrophobicContact CE1-CB 3.83Å; F530-H586 AromaticContact CE1-CG 3.75Å; F530-H586 AromaticContact CE1-ND1 3.6Å; F530-H586 HydrophobicContact CZ-CB 3.8Å; I556-H586 PolarHBondContact O-ND1 2.92Å; N557-H586 CarbonylContact C-O 3.09Å; N557-H586 VanDerWaalsContact CA-O 3.24Å; N557-H586 WeakPolarHBondContact CA-O 3.46Å; N557-H586 WeakPolarHBondContact CB-O 3.23Å; E558-H586 HydrophobicContact CB-CB 3.9Å; E558-H586 PolarHBondContact N-O 3.45Å; E558-H586 PolarHBondContact O-N 2.8Å; E558-H586 VanDerWaalsContact O-N 3.09Å; H586-N637 PolarHBondContact O-ND2 2.81Å
587	P	94.4	Very high	91.7	Very high	57 Å²	57	53.6 Å²	53.6	37%	0.37	30%	0.3	S	S	.	.	S	Bend	cis	-57	162.5	-13	-23.5	35.1	0	0	0	112.4	G585 N637	G585-P587 CarbonylContact C-O 3.48Å; G585-P587 CarbonylContact O-C 3.37Å; P587-N637 WeakPolarHBondContact O-CB 3.41Å; P587-N637 PolarHBondContact O-ND2 3.22Å
588	S	91.6	Very high	91.5	Very high	104 Å²	104	54.9 Å²	54.9	73%	0.727	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-54.4	130.4	-178.6	-52.2	0	0	0	0	111.7	G585	G585-S588 WeakPolarHBondContact O-CA 3.4Å; G585-S588 PolarHBondContact O-N 3Å
589	P	92	Very high	91.2	Very high	20 Å²	20	54.2 Å²	54.2	13%	0.13	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-73.2	143.9	-175.8	28.3	-34.1	0	0	0	113.1	P560 A583 A635 Q636 N637	P560-P589 HydrophobicContact CB-CB 3.7Å; P560-P589 HydrophobicContact CB-CG 3.9Å; P560-P589 HydrophobicContact CG-CB 4.23Å; A583-P589 HydrophobicContact CB-CB 4.42Å; A583-P589 HydrophobicContact CB-CG 3.69Å; A583-P589 VanDerWaalsContact O-CG 3.29Å; A583-P589 WeakPolarHBondContact O-CG 3.41Å; P589-A635 HydrophobicContact CB-CB 4.21Å; P589-Q636 CarbonylContact C-O 3.56Å; P589-Q636 VanDerWaalsContact CA-O 3.32Å; P589-Q636 WeakPolarHBondContact CA-O 3.21Å; P589-N637 HydrophobicContact CB-CB 4.41Å
590	Q	91.4	Very high	90.9	Very high	162 Å²	162	59 Å²	59	76%	0.757	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	133.9	168.7	-63.4	-176.8	0.2	0	0	109.7	A635 Q636	Q590-A635 WeakPolarHBondContact O-CA 3.24Å; Q590-Q636 PolarHBondContact N-O 2.83Å; Q590-Q636 PolarHBondContact O-N 3.38Å
591	I	89.8	Confident	90.9	Very high	51 Å²	51	56.8 Å²	56.8	26%	0.262	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	120.7	177.7	-58.1	-56.9	0	0	0	110.1	C581 A583 C633 A635	C581-I591 HydrophobicContact CB-CG2 4.46Å; A583-I591 HydrophobicContact CB-CD1 4Å; I591-C633 VanDerWaalsContact CG2-SG 3.6Å; I591-A635 HydrophobicContact CD1-CB 3.61Å
592	A	90	Very high	90.8	Very high	55 Å²	55	58 Å²	58	46%	0.455	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	142.9	173.9	0	0	0	0	0	110.8	C633 T634	A592-C633 CarbonylContact O-C 3.59Å; A592-C633 WeakPolarHBondContact O-CA 3.19Å; A592-T634 PolarHBondContact N-O 2.87Å; A592-T634 PolarHBondContact O-N 2.84Å
593	W	91	Very high	90.6	Very high	22 Å²	22	58 Å²	58	8%	0.083	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	145.5	177.4	-69.1	86.2	0	0	0	111.7	P566 L579 C581 F601 F618 S632 C633	P566-W593 HydrophobicContact CB-CH2 3.85Å; P566-W593 HydrophobicContact CB-CZ3 3.97Å; P566-W593 HydrophobicContact CG-CH2 4.23Å; P566-W593 HydrophobicContact CG-CZ3 4.16Å; L579-W593 HydrophobicContact CB-CH2 3.61Å; L579-W593 HydrophobicContact CB-CZ2 4.42Å; L579-W593 HydrophobicContact CB-CZ3 4.03Å; L579-W593 HydrophobicContact CD1-CH2 4.46Å; L579-W593 HydrophobicContact CD1-CZ3 4.02Å; C581-W593 HydrophobicContact CB-CH2 3.7Å; C581-W593 HydrophobicContact CB-CZ2 3.33Å; W593-F601 HydrophobicContact CB-CZ 4.11Å; W593-F601 WeakPolarHBondContact O-CZ 3.06Å; W593-F618 HydrophobicContact CB-CD2 4.13Å; W593-F618 HydrophobicContact CB-CE2 4.22Å; W593-F618 AromaticContact CD1-CD2 3.87Å; W593-F618 HydrophobicContact CD2-CB 4.03Å; W593-F618 AromaticContact CD2-CD2 3.93Å; W593-F618 HydrophobicContact CD2-CD2 3.93Å; W593-F618 HydrophobicContact CD2-CG 4.06Å; W593-F618 VanDerWaalsContact CE2-CB 3.49Å; W593-F618 HydrophobicContact CE3-CG 4.47Å; W593-F618 HydrophobicContact CG-CB 4.49Å; W593-F618 AromaticContact CG-CD2 3.71Å; W593-F618 HydrophobicContact CG-CD2 3.71Å; W593-F618 HydrophobicContact CG-CE2 4.28Å; W593-F618 HydrophobicContact CG-CG 4.32Å; W593-F618 HydrophobicContact CH2-CB 4.15Å; W593-F618 HydrophobicContact CZ2-CB 3.55Å; W593-F618 HydrophobicContact CZ2-CG 4.4Å; W593-S632 CarbonylContact C-O 3.46Å; W593-S632 WeakPolarHBondContact CA-O 3.49Å; W593-C633 HydrophobicContact CD2-CB 4.14Å; W593-C633 HydrophobicContact CE3-CB 3.91Å; W593-C633 HydrophobicContact CH2-CB 3.93Å; W593-C633 HydrophobicContact CZ2-CB 4.12Å; W593-C633 HydrophobicContact CZ3-CB 3.8Å
594	Q	92.5	Very high	90.4	Very high	76 Å²	76	59.3 Å²	59.3	36%	0.355	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	150.6	172.1	-67	177.6	-11.3	0	0	110.1	G598 Y631 S632	Q594-G598 CarbonylContact C-O 3.57Å; Q594-G598 VanDerWaalsContact CA-O 3.26Å; Q594-G598 WeakPolarHBondContact CA-O 2.85Å; Q594-G598 WeakPolarHBondContact CB-O 3.48Å; Q594-Y631 CarbonylContact O-C 3.58Å; Q594-Y631 WeakPolarHBondContact O-CA 3.38Å; Q594-S632 PolarHBondContact N-O 2.76Å; Q594-S632 PolarHBondContact O-N 2.75Å
595	K	93.1	Very high	90	Very high	20 Å²	20	64.1 Å²	64.1	9%	0.087	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	125.8	171.9	-177.3	-175.9	-172.9	-67.6	0	109.1	G597 G598 F601 D627 M628 V630 Y631	K595-G597 PolarHBondContact O-N 3.32Å; K595-G597 VanDerWaalsContact O-N 3.12Å; K595-G598 PolarHBondContact N-O 2.96Å; K595-G598 PolarHBondContact O-N 3Å; K595-F601 HydrophobicContact CB-CD1 3.78Å; K595-F601 HydrophobicContact CB-CE1 3.61Å; K595-F601 HydrophobicContact CB-CZ 4.26Å; K595-F601 HydrophobicContact CD-CD1 4.4Å; K595-D627 VanDerWaalsContact CE-O 3.3Å; K595-D627 WeakPolarHBondContact CE-O 3.39Å; K595-M628 WeakPolarHBondContact CE-O 3.39Å; K595-M628 PolarHBondContact NZ-O 2.92Å; K595-V630 CarbonylContact C-O 3.48Å; K595-V630 WeakPolarHBondContact CA-O 3.37Å; K595-Y631 HydrophobicContact CB-CE1 4.33Å; K595-Y631 HydrophobicContact CD-CE1 4.46Å; K595-Y631 HydrophobicContact CD-CE2 4.36Å; K595-Y631 HydrophobicContact CG-CE1 4.38Å; K595-Y631 HydrophobicContact CG-CE2 4.23Å
596	D	93	Very high	89.7	Confident	95 Å²	95	67.7 Å²	67.7	51%	0.508	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	51	34.8	179.3	-55.3	-50.6	0	0	0	113.4	G598 G629 V630	D596-G598 VanDerWaalsContact C-N 3.33Å; D596-G629 VanDerWaalsContact OD1-CA 3.3Å; D596-G629 WeakPolarHBondContact OD1-CA 3.38Å; D596-V630 PolarHBondContact N-O 3.01Å; D596-V630 PolarHBondContact OD1-N 2.84Å
597	G	87.6	Confident	89.3	Confident	60 Å²	60	74.9 Å²	74.9	62%	0.619	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.8	4.1	-177	0	0	0	0	0	115.6	K595	K595-G597 PolarHBondContact O-N 3.32Å; K595-G597 VanDerWaalsContact O-N 3.12Å
598	G	89.1	Confident	89.1	Confident	30 Å²	30	73.1 Å²	73.1	31%	0.309	39%	0.393	S	S	.	.	B	Isolated β-bridge	trans	-122.8	-179.4	178.1	0	0	0	0	0	113.9	Q594 K595 D596	Q594-G598 CarbonylContact C-O 3.57Å; Q594-G598 VanDerWaalsContact CA-O 3.26Å; Q594-G598 WeakPolarHBondContact CA-O 2.85Å; Q594-G598 WeakPolarHBondContact CB-O 3.48Å; K595-G598 PolarHBondContact N-O 2.96Å; K595-G598 PolarHBondContact O-N 3Å; D596-G598 VanDerWaalsContact C-N 3.33Å
599	T	85.3	Confident	88.9	Confident	114 Å²	114	70.2 Å²	70.2	70%	0.699	37%	0.369	S	S	*	.	S	Bend	trans	-108.1	6.7	178.2	52.8	0	0	0	0	113.4	F601	T599-F601 VanDerWaalsContact O-CD2 3.23Å; T599-F601 WeakPolarHBondContact O-CD2 3.43Å; T599-F601 PolarHBondContact O-N 3.29Å
600	D	86	Confident	88.4	Confident	104 Å²	104	73.2 Å²	73.2	56%	0.556	38%	0.381	S	S	*	.			trans	-82.9	112.7	173.1	-173	20.3	0	0	0	110.5
601	F	90.3	Very high	87.5	Confident	13 Å²	13	69 Å²	69	6%	0.057	37%	0.366	C	S	.	.			trans	-112.7	112.1	176	-64.2	-91.5	0	0	0	108.8	W593 K595 T599 A603 A604 R605 M609 F618 Y631	W593-F601 HydrophobicContact CB-CZ 4.11Å; W593-F601 WeakPolarHBondContact O-CZ 3.06Å; K595-F601 HydrophobicContact CB-CD1 3.78Å; K595-F601 HydrophobicContact CB-CE1 3.61Å; K595-F601 HydrophobicContact CB-CZ 4.26Å; K595-F601 HydrophobicContact CD-CD1 4.4Å; T599-F601 VanDerWaalsContact O-CD2 3.23Å; T599-F601 WeakPolarHBondContact O-CD2 3.43Å; T599-F601 PolarHBondContact O-N 3.29Å; F601-A603 PolarHBondContact O-N 2.03Å; F601-A604 HydrophobicContact CB-CB 3.79Å; F601-A604 WeakPolarHBondContact O-CB 3.44Å; F601-A604 PolarHBondContact O-N 2.9Å; F601-R605 PolarHBondContact O-N 3.39Å; F601-M609 HydrophobicContact CB-SD 3.57Å; F601-M609 VanDerWaalsContact CB-SD 3.57Å; F601-M609 HydrophobicContact CD1-CE 4.45Å; F601-M609 HydrophobicContact CD1-SD 3.68Å; F601-M609 HydrophobicContact CD2-CE 3.95Å; F601-M609 HydrophobicContact CD2-SD 3.88Å; F601-M609 HydrophobicContact CE1-SD 4.28Å; F601-M609 HydrophobicContact CE2-CE 4.1Å; F601-M609 HydrophobicContact CE2-SD 4.46Å; F601-M609 HydrophobicContact CG-CE 4.13Å; F601-M609 HydrophobicContact CG-SD 3.45Å; F601-M609 WeakPolarHBondContact CG-SD 3.29Å; F601-M609 HydrophobicContact CZ-CE 4.4Å; F601-F618 HydrophobicContact CD1-CE2 4.48Å; F601-F618 HydrophobicContact CD1-CZ 4.12Å; F601-F618 HydrophobicContact CE1-CE2 4.08Å; F601-F618 AromaticContact CE1-CZ 3.97Å; F601-F618 HydrophobicContact CE1-CZ 3.97Å; F601-Y631 AromaticContact CD1-CE1 3.92Å; F601-Y631 HydrophobicContact CD1-CE1 3.92Å; F601-Y631 HydrophobicContact CE1-CD1 4.08Å; F601-Y631 AromaticContact CE1-CE1 3.74Å; F601-Y631 HydrophobicContact CE1-CE1 3.74Å
602	P	88.4	Confident	86.4	Confident	26 Å²	26	70.7 Å²	70.7	17%	0.169	37%	0.374	C	S	.	.	H	α-helix	trans	-53.3	-40.1	175.4	-29.5	37.1	0	0	0	112.6	A604 R605 E606 E626	P602-A604 VanDerWaalsContact C-N 3.32Å; P602-A604 PolarHBondContact O-N 3.4Å; P602-R605 PolarHBondContact O-N 3.02Å; P602-E606 PolarHBondContact O-N 3.12Å; P602-E626 HydrophobicContact CB-CB 4.4Å; P602-E626 HydrophobicContact CB-CG 3.91Å
603	A	86.6	Confident	84.7	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-60.4	-30	172.3	0	0	0	0	0	115.2	F601 R607 R608 M609 I620 D627	F601-A603 PolarHBondContact O-N 2.03Å; A603-R607 PolarHBondContact O-N 2.65Å; A603-R608 HydrophobicContact CB-CB 4.16Å; A603-R608 WeakPolarHBondContact O-CA 3.02Å; A603-R608 WeakPolarHBondContact O-CB 3.4Å; A603-R608 PolarHBondContact O-N 3.47Å; A603-M609 HydrophobicContact CB-CB 3.86Å; A603-M609 PolarHBondContact O-N 3.45Å; A603-M609 VanDerWaalsContact O-N 3.11Å; A603-I620 HydrophobicContact CB-CB 4.4Å; A603-I620 HydrophobicContact CB-CD1 4.06Å; A603-I620 HydrophobicContact CB-CG1 3.96Å; A603-I620 HydrophobicContact CB-CG2 3.62Å; A603-D627 PolarHBondContact N-OD1 3.45Å
604	A	85.8	Confident	83.1	Confident	45 Å²	45	80.1 Å²	80.1	37%	0.372	43%	0.425	S	S	.	.	H	α-helix	trans	-72.4	-41.2	177.8	0	0	0	0	0	111.7	F601 P602 E606 R607 M609	F601-A604 HydrophobicContact CB-CB 3.79Å; F601-A604 WeakPolarHBondContact O-CB 3.44Å; F601-A604 PolarHBondContact O-N 2.9Å; P602-A604 VanDerWaalsContact C-N 3.32Å; P602-A604 PolarHBondContact O-N 3.4Å; A604-E606 PolarHBondContact O-N 3.07Å; A604-R607 PolarHBondContact O-N 3.13Å; A604-M609 HydrophobicContact CB-CB 4.26Å; A604-M609 HydrophobicContact CB-SD 3.97Å
605	R	85.6	Confident	81.5	Confident	202 Å²	202	80.1 Å²	80.1	76%	0.762	43%	0.427	S	S	*	.	H	α-helix	trans	-56.6	-34	175.6	-67.4	175.1	56.7	-174.4	-5.4	112.4	F601 P602	F601-R605 PolarHBondContact O-N 3.39Å; P602-R605 PolarHBondContact O-N 3.02Å
606	E	86	Confident	80.4	Confident	92 Å²	92	82.3 Å²	82.3	43%	0.43	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	7.2	178.6	-60.3	-166.1	145	0	0	114.3	P602 A604 R608 K624	P602-E606 PolarHBondContact O-N 3.12Å; A604-E606 PolarHBondContact O-N 3.07Å; E606-R608 HydrophobicContact CB-CG 4.03Å; E606-R608 PolarHBondContact O-N 3.09Å; E606-R608 IonicContact OE2-CZ 2.7Å; E606-R608 IonicContact OE2-NE 3.16Å; E606-R608 PolarHBondContact OE2-NE 3.13Å; E606-R608 IonicContact OE2-NH2 3.7Å; E606-R608 PolarHBondContact OE2-NH2 2.97Å; E606-K624 IonicContact OE1-NZ 2.6Å; E606-K624 PolarHBondContact OE1-NZ 3.37Å; E606-K624 WeakPolarHBondContact OE2-CE 3.44Å; E606-K624 IonicContact OE2-NZ 3.38Å; E606-K624 PolarHBondContact OE2-NZ 3.13Å
607	R	85.2	Confident	79.6	Confident	224 Å²	224	78.3 Å²	78.3	85%	0.845	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	33.6	-176.4	-53.2	-178.5	-179.1	-174.1	-1.3	113.6	A603 A604	A603-R607 PolarHBondContact O-N 2.65Å; A604-R607 PolarHBondContact O-N 3.13Å
608	R	90.6	Very high	79.5	Confident	21 Å²	21	75.6 Å²	75.6	8%	0.079	39%	0.39	C	S	.	.			trans	-95.9	-20.8	174.8	-67.6	-170.9	-62.6	98.8	-1.6	113	A603 E606 H610 I620 A621 K622 E626 D627	A603-R608 HydrophobicContact CB-CB 4.16Å; A603-R608 WeakPolarHBondContact O-CA 3.02Å; A603-R608 WeakPolarHBondContact O-CB 3.4Å; A603-R608 PolarHBondContact O-N 3.47Å; E606-R608 HydrophobicContact CB-CG 4.03Å; E606-R608 PolarHBondContact O-N 3.09Å; E606-R608 IonicContact OE2-CZ 2.7Å; E606-R608 IonicContact OE2-NE 3.16Å; E606-R608 PolarHBondContact OE2-NE 3.13Å; E606-R608 IonicContact OE2-NH2 3.7Å; E606-R608 PolarHBondContact OE2-NH2 2.97Å; R608-H610 PolarHBondContact O-CD2 2.88Å; R608-I620 VanDerWaalsContact NH1-CG2 3.33Å; R608-I620 CarbonylContact O-C 3.56Å; R608-I620 WeakPolarHBondContact O-CA 3.11Å; R608-A621 WeakPolarHBondContact CB-O 3.25Å; R608-A621 WeakPolarHBondContact CD-O 3.42Å; R608-A621 PolarHBondContact NH1-O 2.88Å; R608-A621 PolarHBondContact O-N 2.71Å; R608-K622 PolarHBondContact NH1-O 3.05Å; R608-E626 IonicContact NH2-OE1 3.29Å; R608-D627 IonicContact CZ-OD1 2.85Å; R608-D627 IonicContact CZ-OD2 3.66Å; R608-D627 IonicContact NH1-OD1 2.69Å; R608-D627 IonicContact NH1-OD2 2.67Å; R608-D627 PolarHBondContact NH1-OD2 2.75Å; R608-D627 IonicContact NH2-OD1 3.65Å; R608-D627 PolarHBondContact NH2-OD1 2.79Å; R608-D627 IonicContact NH2-OD2 3.36Å; R608-D627 PolarHBondContact NH2-OD2 2.9Å
609	M	87.5	Confident	79.5	Confident	42 Å²	42	76.7 Å²	76.7	21%	0.207	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	134.9	174.8	172.1	173.1	146.8	0	0	110.5	F601 A603 A604 V611 F618 F619	F601-M609 HydrophobicContact CB-SD 3.57Å; F601-M609 VanDerWaalsContact CB-SD 3.57Å; F601-M609 HydrophobicContact CD1-CE 4.45Å; F601-M609 HydrophobicContact CD1-SD 3.68Å; F601-M609 HydrophobicContact CD2-CE 3.95Å; F601-M609 HydrophobicContact CD2-SD 3.88Å; F601-M609 HydrophobicContact CE1-SD 4.28Å; F601-M609 HydrophobicContact CE2-CE 4.1Å; F601-M609 HydrophobicContact CE2-SD 4.46Å; F601-M609 HydrophobicContact CG-CE 4.13Å; F601-M609 HydrophobicContact CG-SD 3.45Å; F601-M609 WeakPolarHBondContact CG-SD 3.29Å; F601-M609 HydrophobicContact CZ-CE 4.4Å; A603-M609 HydrophobicContact CB-CB 3.86Å; A603-M609 PolarHBondContact O-N 3.45Å; A603-M609 VanDerWaalsContact O-N 3.11Å; A604-M609 HydrophobicContact CB-CB 4.26Å; A604-M609 HydrophobicContact CB-SD 3.97Å; M609-V611 HydrophobicContact CE-CG2 3.97Å; M609-F618 HydrophobicContact CE-CD2 4.49Å; M609-F618 HydrophobicContact CE-CE2 3.63Å; M609-F618 HydrophobicContact CE-CZ 4.41Å; M609-F618 HydrophobicContact CG-CE2 3.86Å; M609-F618 HydrophobicContact CG-CZ 4Å; M609-F618 HydrophobicContact SD-CE2 3.6Å; M609-F618 HydrophobicContact SD-CZ 3.78Å; M609-F619 WeakPolarHBondContact CA-O 3.41Å
610	H	81.8	Confident	79.8	Confident	84 Å²	84	71.3 Å²	71.3	39%	0.389	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	135.7	174.2	-58.5	-84.5	0	0	0	109.8	R608 F619	R608-H610 PolarHBondContact O-CD2 2.88Å; H610-F619 HydrophobicContact CB-CD1 4.07Å; H610-F619 HydrophobicContact CB-CD2 3.98Å; H610-F619 HydrophobicContact CB-CE1 3.64Å; H610-F619 HydrophobicContact CB-CE2 3.55Å; H610-F619 HydrophobicContact CB-CG 4.24Å; H610-F619 HydrophobicContact CB-CZ 3.37Å; H610-F619 AromaticContact CD2-CD2 3.85Å; H610-F619 AromaticContact CD2-CE2 3.31Å; H610-F619 WeakPolarHBondContact CD2-CE2 3.33Å; H610-F619 AromaticContact CD2-CZ 3.95Å; H610-F619 AromaticContact CG-CE2 3.59Å; H610-F619 AromaticContact CG-CZ 3.73Å; H610-F619 PolarHBondContact N-O 3.15Å; H610-F619 PolarHBondContact O-N 2.82Å
611	V	72.6	Confident	80.1	Confident	73 Å²	73	67.5 Å²	67.5	44%	0.442	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	118.9	168.8	-173.9	0	0	0	0	105.3	M609 F618	M609-V611 HydrophobicContact CE-CG2 3.97Å; V611-F618 HydrophobicContact CG2-CD2 3.95Å; V611-F618 HydrophobicContact CG2-CE2 4.42Å
612	M	65.6	Low	80.1	Confident	86 Å²	86	74 Å²	74	42%	0.424	37%	0.365	S	S	.	.			trans	-88.7	123.5	175.2	-74	179.7	58.6	0	0	108.5	D614 D615 F619	M612-D614 PolarHBondContact O-N 3.14Å; M612-D615 HydrophobicContact CB-CB 3.67Å; M612-D615 HydrophobicContact CE-CB 4.07Å; M612-D615 VanDerWaalsContact CE-OD2 3.24Å; M612-D615 WeakPolarHBondContact CE-OD2 3.41Å; M612-F619 HydrophobicContact CG-CE1 4.09Å; M612-F619 HydrophobicContact SD-CE1 3.9Å
613	P	55.2	Low	80.4	Confident	122 Å²	122	72.9 Å²	72.9	79%	0.792	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-32.2	-173.6	-27.5	35.8	0	0	0	114.7
614	D	58.1	Low	80.7	Confident	154 Å²	154	76.3 Å²	76.3	82%	0.824	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	-0.4	-167.6	-45.6	-54.6	0	0	0	114	M612	M612-D614 PolarHBondContact O-N 3.14Å
615	D	57.1	Low	80.8	Confident	76 Å²	76	77.3 Å²	77.3	41%	0.406	37%	0.373	S	S	.	.	S	Bend	trans	-122.3	1.2	-155.2	-132.1	25.9	0	0	0	114.2	M612 I617	M612-D615 HydrophobicContact CB-CB 3.67Å; M612-D615 HydrophobicContact CE-CB 4.07Å; M612-D615 VanDerWaalsContact CE-OD2 3.24Å; M612-D615 WeakPolarHBondContact CE-OD2 3.41Å; D615-I617 HydrophobicContact CB-CD1 4.09Å; D615-I617 WeakPolarHBondContact O-CD1 3.24Å; D615-I617 WeakPolarHBondContact O-CG1 3.48Å; D615-I617 PolarHBondContact O-N 3.03Å
616	D	71	Confident	81.1	Confident	65 Å²	65	72 Å²	72	35%	0.348	36%	0.357	S	S	.	.			trans	56.6	18	-179.3	-63.1	-39.8	0	0	0	115.4	E580 C581 A582	E580-D616 WeakPolarHBondContact CA-O 3.32Å; C581-D616 PolarHBondContact N-O 3.37Å; C581-D616 WeakPolarHBondContact O-CB 3.04Å; A582-D616 HydrophobicContact CB-CB 3.66Å; A582-D616 WeakPolarHBondContact CB-OD2 3.34Å
617	I	77.1	Confident	81.4	Confident	11 Å²	11	67.6 Å²	67.6	6%	0.056	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	125.9	-169.1	-62.7	143.4	0	0	0	111.6	R578 E580 D615 F619	R578-I617 HydrophobicContact CG-CG2 3.78Å; R578-I617 VanDerWaalsContact CZ-CD1 3.48Å; E580-I617 HydrophobicContact CG-CG1 4.28Å; D615-I617 HydrophobicContact CB-CD1 4.09Å; D615-I617 WeakPolarHBondContact O-CD1 3.24Å; D615-I617 WeakPolarHBondContact O-CG1 3.48Å; D615-I617 PolarHBondContact O-N 3.03Å; I617-F619 HydrophobicContact CG2-CD1 4.22Å
618	F	84.4	Confident	81.8	Confident	3 Å²	3	60.6 Å²	60.6	1%	0.013	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	127.4	167.6	176.8	-84.6	0	0	0	109.3	R578 L579 W593 F601 M609 V611 I620 Y631	R578-F618 WeakPolarHBondContact CA-O 3.32Å; L579-F618 HydrophobicContact CB-CB 4.44Å; L579-F618 HydrophobicContact CB-CD1 4.34Å; L579-F618 HydrophobicContact CD1-CD1 4.14Å; L579-F618 HydrophobicContact CD1-CE1 4.49Å; L579-F618 HydrophobicContact CG-CD1 4.48Å; L579-F618 PolarHBondContact N-O 2.84Å; L579-F618 PolarHBondContact O-N 2.81Å; W593-F618 HydrophobicContact CB-CD2 4.13Å; W593-F618 HydrophobicContact CB-CE2 4.22Å; W593-F618 AromaticContact CD1-CD2 3.87Å; W593-F618 HydrophobicContact CD2-CB 4.03Å; W593-F618 AromaticContact CD2-CD2 3.93Å; W593-F618 HydrophobicContact CD2-CD2 3.93Å; W593-F618 HydrophobicContact CD2-CG 4.06Å; W593-F618 VanDerWaalsContact CE2-CB 3.49Å; W593-F618 HydrophobicContact CE3-CG 4.47Å; W593-F618 HydrophobicContact CG-CB 4.49Å; W593-F618 AromaticContact CG-CD2 3.71Å; W593-F618 HydrophobicContact CG-CD2 3.71Å; W593-F618 HydrophobicContact CG-CE2 4.28Å; W593-F618 HydrophobicContact CG-CG 4.32Å; W593-F618 HydrophobicContact CH2-CB 4.15Å; W593-F618 HydrophobicContact CZ2-CB 3.55Å; W593-F618 HydrophobicContact CZ2-CG 4.4Å; F601-F618 HydrophobicContact CD1-CE2 4.48Å; F601-F618 HydrophobicContact CD1-CZ 4.12Å; F601-F618 HydrophobicContact CE1-CE2 4.08Å; F601-F618 AromaticContact CE1-CZ 3.97Å; F601-F618 HydrophobicContact CE1-CZ 3.97Å; M609-F618 HydrophobicContact CE-CD2 4.49Å; M609-F618 HydrophobicContact CE-CE2 3.63Å; M609-F618 HydrophobicContact CE-CZ 4.41Å; M609-F618 HydrophobicContact CG-CE2 3.86Å; M609-F618 HydrophobicContact CG-CZ 4Å; M609-F618 HydrophobicContact SD-CE2 3.6Å; M609-F618 HydrophobicContact SD-CZ 3.78Å; V611-F618 HydrophobicContact CG2-CD2 3.95Å; V611-F618 HydrophobicContact CG2-CE2 4.42Å; F618-I620 HydrophobicContact CE1-CD1 3.68Å; F618-I620 HydrophobicContact CE1-CG1 3.66Å; F618-I620 HydrophobicContact CZ-CD1 4Å; F618-I620 HydrophobicContact CZ-CG1 4.01Å; F618-Y631 AromaticContact CE1-CD1 3.79Å; F618-Y631 HydrophobicContact CE1-CD1 3.79Å; F618-Y631 AromaticContact CE1-CE1 3.55Å; F618-Y631 HydrophobicContact CE1-CE1 3.55Å; F618-Y631 AromaticContact CZ-CD1 3.94Å; F618-Y631 HydrophobicContact CZ-CD1 3.94Å; F618-Y631 AromaticContact CZ-CE1 3.55Å; F618-Y631 HydrophobicContact CZ-CE1 3.55Å
619	F	88.8	Confident	81.9	Confident	53 Å²	53	60.1 Å²	60.1	23%	0.232	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	145	174.4	65.6	-89.2	0	0	0	114.4	T576 A577 M609 H610 M612 I617	T576-F619 HydrophobicContact CG2-CB 4.23Å; T576-F619 HydrophobicContact CG2-CD2 4.18Å; A577-F619 CarbonylContact O-C 3.39Å; A577-F619 WeakPolarHBondContact O-CA 3.28Å; A577-F619 WeakPolarHBondContact O-CB 3.37Å; M609-F619 WeakPolarHBondContact CA-O 3.41Å; H610-F619 HydrophobicContact CB-CD1 4.07Å; H610-F619 HydrophobicContact CB-CD2 3.98Å; H610-F619 HydrophobicContact CB-CE1 3.64Å; H610-F619 HydrophobicContact CB-CE2 3.55Å; H610-F619 HydrophobicContact CB-CG 4.24Å; H610-F619 HydrophobicContact CB-CZ 3.37Å; H610-F619 AromaticContact CD2-CD2 3.85Å; H610-F619 AromaticContact CD2-CE2 3.31Å; H610-F619 WeakPolarHBondContact CD2-CE2 3.33Å; H610-F619 AromaticContact CD2-CZ 3.95Å; H610-F619 AromaticContact CG-CE2 3.59Å; H610-F619 AromaticContact CG-CZ 3.73Å; H610-F619 PolarHBondContact N-O 3.15Å; H610-F619 PolarHBondContact O-N 2.82Å; M612-F619 HydrophobicContact CG-CE1 4.09Å; M612-F619 HydrophobicContact SD-CE1 3.9Å; I617-F619 HydrophobicContact CG2-CD1 4.22Å
620	I	92.6	Very high	82.4	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	111.3	174.4	-64.6	172.7	0	0	0	107.7	T576 A577 A603 R608 F618 V623 D627 Y631 L648	T576-I620 CarbonylContact C-O 3.56Å; T576-I620 VanDerWaalsContact CA-O 3.26Å; T576-I620 WeakPolarHBondContact CA-O 3.48Å; A577-I620 HydrophobicContact CB-CB 4.47Å; A577-I620 PolarHBondContact N-O 3.26Å; A577-I620 PolarHBondContact O-N 3.27Å; A603-I620 HydrophobicContact CB-CB 4.4Å; A603-I620 HydrophobicContact CB-CD1 4.06Å; A603-I620 HydrophobicContact CB-CG1 3.96Å; A603-I620 HydrophobicContact CB-CG2 3.62Å; R608-I620 VanDerWaalsContact NH1-CG2 3.33Å; R608-I620 CarbonylContact O-C 3.56Å; R608-I620 WeakPolarHBondContact O-CA 3.11Å; F618-I620 HydrophobicContact CE1-CD1 3.68Å; F618-I620 HydrophobicContact CE1-CG1 3.66Å; F618-I620 HydrophobicContact CZ-CD1 4Å; F618-I620 HydrophobicContact CZ-CG1 4.01Å; I620-V623 HydrophobicContact CB-CG2 4.2Å; I620-V623 HydrophobicContact CG2-CG2 3.91Å; I620-V623 VanDerWaalsContact O-CG2 3.29Å; I620-V623 WeakPolarHBondContact O-CG2 3.22Å; I620-D627 HydrophobicContact CD1-CB 4.37Å; I620-Y631 HydrophobicContact CD1-CE1 4.01Å; I620-Y631 WeakPolarHBondContact CD1-OH 3.41Å; I620-L648 HydrophobicContact CD1-CD2 4.27Å
621	A	91.3	Very high	83	Confident	25 Å²	25	56.7 Å²	56.7	21%	0.207	30%	0.303	C	S	.	.	S	Bend	trans	-74.6	148.7	172.4	0	0	0	0	0	111.2	R608 V623	R608-A621 WeakPolarHBondContact CB-O 3.25Å; R608-A621 WeakPolarHBondContact CD-O 3.42Å; R608-A621 PolarHBondContact NH1-O 2.88Å; R608-A621 PolarHBondContact O-N 2.71Å; A621-V623 VanDerWaalsContact C-N 3.35Å; A621-V623 PolarHBondContact O-N 2.86Å
622	K	91.6	Very high	84	Confident	150 Å²	150	54 Å²	54	65%	0.652	29%	0.288	S	S	*	.	S	Bend	trans	47.7	54.2	175.9	-60.4	177.9	-178.5	174.4	0	112.6	M575 R608	M575-K622 CarbonylContact O-C 3.52Å; M575-K622 WeakPolarHBondContact O-CA 3.32Å; M575-K622 PolarHBondContact O-N 2.78Å; R608-K622 PolarHBondContact NH1-O 3.05Å
623	V	93.9	Very high	85.3	Confident	1 Å²	1	50 Å²	50	1%	0.006	27%	0.268	C	S	.	.			trans	-52.6	136.7	-175	179.8	0	0	0	0	111.4	I571 T573 G574 M575 A577 I620 A621 D627 V650	I571-V623 HydrophobicContact CG2-CB 4.4Å; I571-V623 HydrophobicContact CG2-CG1 4.08Å; I571-V623 HydrophobicContact CG2-CG2 4.37Å; T573-V623 CarbonylContact C-O 3.57Å; T573-V623 VanDerWaalsContact CA-O 3.26Å; T573-V623 WeakPolarHBondContact CA-O 3.33Å; G574-V623 PolarHBondContact N-O 2.93Å; M575-V623 WeakPolarHBondContact O-CG2 3.45Å; M575-V623 PolarHBondContact O-N 2.97Å; A577-V623 HydrophobicContact CB-CG2 3.58Å; I620-V623 HydrophobicContact CB-CG2 4.2Å; I620-V623 HydrophobicContact CG2-CG2 3.91Å; I620-V623 VanDerWaalsContact O-CG2 3.29Å; I620-V623 WeakPolarHBondContact O-CG2 3.22Å; A621-V623 VanDerWaalsContact C-N 3.35Å; A621-V623 PolarHBondContact O-N 2.86Å; V623-D627 WeakPolarHBondContact CA-OD2 3.46Å; V623-D627 HydrophobicContact CG1-CB 4.19Å; V623-V650 HydrophobicContact CG1-CB 4.28Å; V623-V650 HydrophobicContact CG1-CG1 3.82Å; V623-V650 HydrophobicContact CG1-CG2 3.42Å; V623-V650 VanDerWaalsContact CG1-CG2 3.42Å
624	K	92.4	Very high	87.1	Confident	73 Å²	73	45.5 Å²	45.5	32%	0.317	24%	0.239	S	C	.	.			trans	-116.8	165.7	176.2	-67.6	178.3	176.6	-175.7	0	111	E606 E626 D627	E606-K624 IonicContact OE1-NZ 2.6Å; E606-K624 PolarHBondContact OE1-NZ 3.37Å; E606-K624 WeakPolarHBondContact OE2-CE 3.44Å; E606-K624 IonicContact OE2-NZ 3.38Å; E606-K624 PolarHBondContact OE2-NZ 3.13Å; K624-E626 HydrophobicContact CB-CG 3.89Å; K624-E626 HydrophobicContact CD-CG 4.15Å; K624-E626 WeakPolarHBondContact CD-OE1 3.48Å; K624-E626 IonicContact NZ-OE1 3.58Å; K624-E626 PolarHBondContact NZ-OE1 3Å; K624-E626 PolarHBondContact O-N 2.03Å; K624-D627 PolarHBondContact N-OD2 2.83Å; K624-D627 WeakPolarHBondContact O-CB 3.45Å; K624-D627 PolarHBondContact O-N 2.84Å
625	T	89.5	Confident	88.8	Confident	65 Å²	65	38.2 Å²	38.2	40%	0.399	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-61.9	-28.1	177.8	43.8	0	0	0	0	113.7	T573 D627 M628 V650 E652	T573-T625 HydrophobicContact CG2-CG2 4.21Å; T625-D627 VanDerWaalsContact C-N 3.28Å; T625-D627 PolarHBondContact O-N 2.98Å; T625-M628 WeakPolarHBondContact O-CB 3.34Å; T625-M628 PolarHBondContact O-N 2.8Å; T625-V650 HydrophobicContact CG2-CG1 4.44Å; T625-E652 HydrophobicContact CG2-CB 4.16Å
626	E	90.6	Very high	90.5	Very high	90 Å²	90	40.1 Å²	40.1	42%	0.421	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-68.8	-19.9	172.8	63.9	-171.2	168.3	0	0	114.3	P602 R608 K624 M628	P602-E626 HydrophobicContact CB-CB 4.4Å; P602-E626 HydrophobicContact CB-CG 3.91Å; R608-E626 IonicContact NH2-OE1 3.29Å; K624-E626 HydrophobicContact CB-CG 3.89Å; K624-E626 HydrophobicContact CD-CG 4.15Å; K624-E626 WeakPolarHBondContact CD-OE1 3.48Å; K624-E626 IonicContact NZ-OE1 3.58Å; K624-E626 PolarHBondContact NZ-OE1 3Å; K624-E626 PolarHBondContact O-N 2.03Å; E626-M628 PolarHBondContact O-N 2.64Å
627	D	92.9	Very high	91.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-78.5	-8	175.1	-53.6	-41.2	0	0	0	112	K595 A603 R608 I620 V623 K624 T625 Y631 L648	K595-D627 VanDerWaalsContact CE-O 3.3Å; K595-D627 WeakPolarHBondContact CE-O 3.39Å; A603-D627 PolarHBondContact N-OD1 3.45Å; R608-D627 IonicContact CZ-OD1 2.85Å; R608-D627 IonicContact CZ-OD2 3.66Å; R608-D627 IonicContact NH1-OD1 2.69Å; R608-D627 IonicContact NH1-OD2 2.67Å; R608-D627 PolarHBondContact NH1-OD2 2.75Å; R608-D627 IonicContact NH2-OD1 3.65Å; R608-D627 PolarHBondContact NH2-OD1 2.79Å; R608-D627 IonicContact NH2-OD2 3.36Å; R608-D627 PolarHBondContact NH2-OD2 2.9Å; I620-D627 HydrophobicContact CD1-CB 4.37Å; V623-D627 WeakPolarHBondContact CA-OD2 3.46Å; V623-D627 HydrophobicContact CG1-CB 4.19Å; K624-D627 PolarHBondContact N-OD2 2.83Å; K624-D627 WeakPolarHBondContact O-CB 3.45Å; K624-D627 PolarHBondContact O-N 2.84Å; T625-D627 VanDerWaalsContact C-N 3.28Å; T625-D627 PolarHBondContact O-N 2.98Å; D627-Y631 WeakPolarHBondContact O-CE2 3.29Å; D627-Y631 PolarHBondContact O-OH 2.79Å; D627-L648 HydrophobicContact CB-CD2 4.42Å
628	M	93.1	Very high	92.4	Very high	77 Å²	77	41.2 Å²	41.2	38%	0.379	22%	0.223	S	C	.	.			trans	-60.6	136.6	175.5	-177.2	-176.7	-71.3	0	0	111	K595 T625 E626 L648 T649 V650	K595-M628 WeakPolarHBondContact CE-O 3.39Å; K595-M628 PolarHBondContact NZ-O 2.92Å; T625-M628 WeakPolarHBondContact O-CB 3.34Å; T625-M628 PolarHBondContact O-N 2.8Å; E626-M628 PolarHBondContact O-N 2.64Å; M628-L648 WeakPolarHBondContact CA-O 3.22Å; M628-L648 VanDerWaalsContact CG-O 3.31Å; M628-L648 WeakPolarHBondContact CG-O 3.38Å; M628-T649 HydrophobicContact CE-CG2 4.34Å; M628-V650 HydrophobicContact CB-CG2 4.29Å; M628-V650 HydrophobicContact CE-CB 4.41Å; M628-V650 WeakPolarHBondContact CE-O 3.49Å
629	G	93.6	Very high	92.7	Very high	11 Å²	11	42 Å²	42	11%	0.113	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.9	-177.7	179.2	0	0	0	0	0	113.2	D596 L648	D596-G629 VanDerWaalsContact OD1-CA 3.3Å; D596-G629 WeakPolarHBondContact OD1-CA 3.38Å; G629-L648 PolarHBondContact N-O 2.81Å; G629-L648 PolarHBondContact O-N 2.72Å
630	V	96.4	Very high	93	Very high	55 Å²	55	40.6 Å²	40.6	33%	0.333	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	122.9	171.8	-178.4	0	0	0	0	109.1	K595 D596 N645 A646	K595-V630 CarbonylContact C-O 3.48Å; K595-V630 WeakPolarHBondContact CA-O 3.37Å; D596-V630 PolarHBondContact N-O 3.01Å; D596-V630 PolarHBondContact OD1-N 2.84Å; V630-N645 HydrophobicContact CG1-CB 4.1Å; V630-A646 CarbonylContact C-O 3.52Å; V630-A646 WeakPolarHBondContact CA-O 3.24Å
631	Y	94.4	Very high	93	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	115.8	177	-75.1	-100.4	0	0	0	109.2	L579 Q594 K595 F601 F618 I620 D627 N645 A646 L648	L579-Y631 HydrophobicContact CD1-CD1 4.01Å; L579-Y631 HydrophobicContact CD1-CD2 4.26Å; L579-Y631 HydrophobicContact CD1-CG 3.69Å; Q594-Y631 CarbonylContact O-C 3.58Å; Q594-Y631 WeakPolarHBondContact O-CA 3.38Å; K595-Y631 HydrophobicContact CB-CE1 4.33Å; K595-Y631 HydrophobicContact CD-CE1 4.46Å; K595-Y631 HydrophobicContact CD-CE2 4.36Å; K595-Y631 HydrophobicContact CG-CE1 4.38Å; K595-Y631 HydrophobicContact CG-CE2 4.23Å; F601-Y631 AromaticContact CD1-CE1 3.92Å; F601-Y631 HydrophobicContact CD1-CE1 3.92Å; F601-Y631 HydrophobicContact CE1-CD1 4.08Å; F601-Y631 AromaticContact CE1-CE1 3.74Å; F601-Y631 HydrophobicContact CE1-CE1 3.74Å; F618-Y631 AromaticContact CE1-CD1 3.79Å; F618-Y631 HydrophobicContact CE1-CD1 3.79Å; F618-Y631 AromaticContact CE1-CE1 3.55Å; F618-Y631 HydrophobicContact CE1-CE1 3.55Å; F618-Y631 AromaticContact CZ-CD1 3.94Å; F618-Y631 HydrophobicContact CZ-CD1 3.94Å; F618-Y631 AromaticContact CZ-CE1 3.55Å; F618-Y631 HydrophobicContact CZ-CE1 3.55Å; I620-Y631 HydrophobicContact CD1-CE1 4.01Å; I620-Y631 WeakPolarHBondContact CD1-OH 3.41Å; D627-Y631 WeakPolarHBondContact O-CE2 3.29Å; D627-Y631 PolarHBondContact O-OH 2.79Å; Y631-N645 CarbonylContact O-C 3.52Å; Y631-N645 WeakPolarHBondContact O-CA 3.36Å; Y631-A646 PolarHBondContact N-O 2.86Å; Y631-A646 PolarHBondContact O-N 3.01Å; Y631-L648 HydrophobicContact CD2-CB 3.82Å; Y631-L648 HydrophobicContact CE2-CB 3.66Å; Y631-L648 HydrophobicContact CE2-CD2 3.82Å; Y631-L648 HydrophobicContact CE2-CG 4.37Å
632	S	94.3	Very high	93.1	Very high	17 Å²	17	45.2 Å²	45.2	12%	0.119	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	126.1	172.5	-66.2	0	0	0	0	109.4	W593 Q594 A644 N645	W593-S632 CarbonylContact C-O 3.46Å; W593-S632 WeakPolarHBondContact CA-O 3.49Å; Q594-S632 PolarHBondContact N-O 2.76Å; Q594-S632 PolarHBondContact O-N 2.75Å; S632-A644 WeakPolarHBondContact CA-O 3.48Å; S632-N645 VanDerWaalsContact CB-OD1 3.31Å; S632-N645 WeakPolarHBondContact CB-OD1 3.31Å; S632-N645 PolarHBondContact OG-OD1 2.82Å
633	C	92.6	Very high	93.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	132.2	162.9	175.7	0	0	0	0	109	P566 C581 I591 A592 W593 S643 A644	P566-C633 HydrophobicContact CG-CB 4.15Å; C581-C633 HydrophobicContact CB-CB 3.61Å; C581-C633 WeakPolarHBondContact CB-SG 3.47Å; C581-C633 WeakPolarHBondContact SG-CB 3.48Å; C581-C633 CovalentContact SG-SG 2.01Å; C581-C633 PolarHBondContact SG-SG 2.78Å; I591-C633 VanDerWaalsContact CG2-SG 3.6Å; A592-C633 CarbonylContact O-C 3.59Å; A592-C633 WeakPolarHBondContact O-CA 3.19Å; W593-C633 HydrophobicContact CD2-CB 4.14Å; W593-C633 HydrophobicContact CE3-CB 3.91Å; W593-C633 HydrophobicContact CH2-CB 3.93Å; W593-C633 HydrophobicContact CZ2-CB 4.12Å; W593-C633 HydrophobicContact CZ3-CB 3.8Å; C633-S643 CarbonylContact O-C 3.11Å; C633-S643 WeakPolarHBondContact O-CA 3.21Å; C633-S643 WeakPolarHBondContact O-CB 3.47Å; C633-A644 PolarHBondContact N-O 2.87Å; C633-A644 PolarHBondContact O-N 2.89Å
634	T	93.4	Very high	93.3	Very high	29 Å²	29	42.6 Å²	42.6	18%	0.178	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	123.1	172.1	-59.6	0	0	0	0	108.8	A592 L642	A592-T634 PolarHBondContact N-O 2.87Å; A592-T634 PolarHBondContact O-N 2.84Å; T634-L642 CarbonylContact C-O 3.51Å; T634-L642 WeakPolarHBondContact CA-O 3.47Å
635	A	93.7	Very high	93.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	130.3	169.4	0	0	0	0	0	108.9	F562 A583 P589 Q590 I591 S641 L642	F562-A635 HydrophobicContact CE1-CB 4.03Å; A583-A635 HydrophobicContact CB-CB 3.45Å; A583-A635 VanDerWaalsContact CB-CB 3.45Å; P589-A635 HydrophobicContact CB-CB 4.21Å; Q590-A635 WeakPolarHBondContact O-CA 3.24Å; I591-A635 HydrophobicContact CD1-CB 3.61Å; A635-S641 CarbonylContact O-C 3.5Å; A635-S641 WeakPolarHBondContact O-CA 3.23Å; A635-L642 HydrophobicContact CB-CD2 3.64Å; A635-L642 HydrophobicContact CB-CG 4.36Å; A635-L642 PolarHBondContact N-O 3.37Å; A635-L642 PolarHBondContact O-N 2.79Å
636	Q	93.9	Very high	93.8	Very high	116 Å²	116	40.8 Å²	40.8	54%	0.542	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	134.4	-174.3	-177.6	171.7	22.2	0	0	112.5	P589 Q590 G640	P589-Q636 CarbonylContact C-O 3.56Å; P589-Q636 VanDerWaalsContact CA-O 3.32Å; P589-Q636 WeakPolarHBondContact CA-O 3.21Å; Q590-Q636 PolarHBondContact N-O 2.83Å; Q590-Q636 PolarHBondContact O-N 3.38Å; Q636-G640 WeakPolarHBondContact CA-O 3.22Å
637	N	94.2	Very high	94.1	Very high	19 Å²	19	39.1 Å²	39.1	10%	0.102	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	-171.4	167.6	72.7	6.1	0	0	0	110.7	E558 P560 H586 P587 P589 A639 G640	E558-N637 PolarHBondContact O-ND2 2.86Å; P560-N637 WeakPolarHBondContact CD-OD1 3.05Å; H586-N637 PolarHBondContact O-ND2 2.81Å; P587-N637 WeakPolarHBondContact O-CB 3.41Å; P587-N637 PolarHBondContact O-ND2 3.22Å; P589-N637 HydrophobicContact CB-CB 4.41Å; N637-A639 VanDerWaalsContact C-N 3.25Å; N637-A639 PolarHBondContact O-N 2.82Å; N637-A639 WeakPolarHBondContact OD1-CA 3.48Å; N637-A639 WeakPolarHBondContact OD1-CB 3.31Å; N637-A639 PolarHBondContact OD1-N 3.37Å; N637-G640 PolarHBondContact N-O 2.76Å; N637-G640 PolarHBondContact O-N 2.8Å; N637-G640 VanDerWaalsContact O-O 3.09Å; N637-G640 PolarHBondContact OD1-N 2.02Å; N637-G640 VanDerWaalsContact OD1-N 3.16Å; N637-G640 PolarHBondContact OD1-O 2.92Å
638	A	93.2	Very high	94.2	Very high	80 Å²	80	39.2 Å²	39.2	66%	0.661	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-15.1	179.8	0	0	0	0	0	114.6
639	A	91.4	Very high	94.3	Very high	19 Å²	19	37.7 Å²	37.7	16%	0.157	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-24	172.7	0	0	0	0	0	113.4	L471 N557 M559 N637	L471-A639 HydrophobicContact CD2-CB 3.36Å; N557-A639 HydrophobicContact CB-CB 3.67Å; M559-A639 HydrophobicContact CB-CB 4.41Å; M559-A639 HydrophobicContact CG-CB 3.86Å; N637-A639 VanDerWaalsContact C-N 3.25Å; N637-A639 PolarHBondContact O-N 2.82Å; N637-A639 WeakPolarHBondContact OD1-CA 3.48Å; N637-A639 WeakPolarHBondContact OD1-CB 3.31Å; N637-A639 PolarHBondContact OD1-N 3.37Å
640	G	93.1	Very high	94.3	Very high	25 Å²	25	37.2 Å²	37.2	26%	0.258	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	160.1	-162.9	178.8	0	0	0	0	0	113.8	Q636 N637	Q636-G640 WeakPolarHBondContact CA-O 3.22Å; N637-G640 PolarHBondContact N-O 2.76Å; N637-G640 PolarHBondContact O-N 2.8Å; N637-G640 VanDerWaalsContact O-O 3.09Å; N637-G640 PolarHBondContact OD1-N 2.02Å; N637-G640 VanDerWaalsContact OD1-N 3.16Å; N637-G640 PolarHBondContact OD1-O 2.92Å
641	S	94	Very high	94.1	Very high	80 Å²	80	36.3 Å²	36.3	56%	0.559	23%	0.231	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-143.2	143	179.3	61	0	0	0	0	111.8	A635	A635-S641 CarbonylContact O-C 3.5Å; A635-S641 WeakPolarHBondContact O-CA 3.23Å
642	L	94	Very high	93.9	Very high	42 Å²	42	38.8 Å²	38.8	22%	0.22	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	152	169.5	71	168.7	0	0	0	110.5	P560 F562 T634 A635	P560-L642 VanDerWaalsContact C-CD2 3.49Å; P560-L642 HydrophobicContact CB-CD2 3.48Å; P560-L642 VanDerWaalsContact CB-CD2 3.48Å; P560-L642 HydrophobicContact CG-CD2 3.53Å; P560-L642 WeakPolarHBondContact O-CD1 3.22Å; P560-L642 VanDerWaalsContact O-CD2 3.24Å; P560-L642 WeakPolarHBondContact O-CD2 3.44Å; F562-L642 HydrophobicContact CB-CD1 4.35Å; F562-L642 HydrophobicContact CD1-CD1 4.22Å; F562-L642 HydrophobicContact CD1-CG 4.49Å; F562-L642 HydrophobicContact CD2-CD1 3.29Å; F562-L642 HydrophobicContact CD2-CG 3.92Å; F562-L642 HydrophobicContact CE1-CD1 4.37Å; F562-L642 HydrophobicContact CE1-CG 4.17Å; F562-L642 HydrophobicContact CE2-CB 4.21Å; F562-L642 HydrophobicContact CE2-CD1 3.49Å; F562-L642 VanDerWaalsContact CE2-CD1 3.49Å; F562-L642 HydrophobicContact CE2-CG 3.56Å; F562-L642 HydrophobicContact CG-CD1 3.68Å; F562-L642 HydrophobicContact CG-CG 4.36Å; F562-L642 HydrophobicContact CZ-CD1 4.04Å; F562-L642 HydrophobicContact CZ-CG 3.7Å; T634-L642 CarbonylContact C-O 3.51Å; T634-L642 WeakPolarHBondContact CA-O 3.47Å; A635-L642 HydrophobicContact CB-CD2 3.64Å; A635-L642 HydrophobicContact CB-CG 4.36Å; A635-L642 PolarHBondContact N-O 3.37Å; A635-L642 PolarHBondContact O-N 2.79Å
643	S	94.8	Very high	93.6	Very high	80 Å²	80	41.2 Å²	41.2	56%	0.559	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.3	150	-179.7	59.7	0	0	0	0	113.1	C633	C633-S643 CarbonylContact O-C 3.11Å; C633-S643 WeakPolarHBondContact O-CA 3.21Å; C633-S643 WeakPolarHBondContact O-CB 3.47Å
644	A	95	Very high	93.6	Very high	17 Å²	17	41.5 Å²	41.5	14%	0.14	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	145.2	178.3	0	0	0	0	0	110.6	F562 T565 P566 S632 C633	F562-A644 HydrophobicContact CD2-CB 4.21Å; F562-A644 HydrophobicContact CE2-CB 3.51Å; F562-A644 HydrophobicContact CZ-CB 3.72Å; T565-A644 HydrophobicContact CG2-CB 3.67Å; P566-A644 HydrophobicContact CG-CB 4.37Å; S632-A644 WeakPolarHBondContact CA-O 3.48Å; C633-A644 PolarHBondContact N-O 2.87Å; C633-A644 PolarHBondContact O-N 2.89Å
645	N	96	Very high	93.4	Very high	98 Å²	98	41.5 Å²	41.5	52%	0.524	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	147	-169.2	-61.2	-13.2	0	0	0	111.8	V630 Y631 S632	V630-N645 HydrophobicContact CG1-CB 4.1Å; Y631-N645 CarbonylContact O-C 3.52Å; Y631-N645 WeakPolarHBondContact O-CA 3.36Å; S632-N645 VanDerWaalsContact CB-OD1 3.31Å; S632-N645 WeakPolarHBondContact CB-OD1 3.31Å; S632-N645 PolarHBondContact OG-OD1 2.82Å
646	A	95.8	Very high	93.2	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.008	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	151.3	169.6	0	0	0	0	0	112.2	P566 M567 L579 V630 Y631	P566-A646 HydrophobicContact CB-CB 3.66Å; P566-A646 HydrophobicContact CG-CB 4.2Å; M567-A646 VanDerWaalsContact C-CB 3.44Å; M567-A646 WeakPolarHBondContact O-CB 3.46Å; L579-A646 HydrophobicContact CD2-CB 4.47Å; V630-A646 CarbonylContact C-O 3.52Å; V630-A646 WeakPolarHBondContact CA-O 3.24Å; Y631-A646 PolarHBondContact N-O 2.86Å; Y631-A646 PolarHBondContact O-N 3.01Å
647	T	96.8	Very high	92.9	Very high	56 Å²	56	42 Å²	42	34%	0.344	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	121.1	-179.1	-45	0	0	0	0	110.5	D568 L569	D568-T647 WeakPolarHBondContact CA-O 3.41Å; D568-T647 WeakPolarHBondContact OD1-CB 3.34Å; D568-T647 PolarHBondContact OD1-N 3.06Å; D568-T647 PolarHBondContact OD1-OG1 2.87Å; L569-T647 PolarHBondContact N-O 3.29Å
648	L	95.4	Very high	92.5	Very high	1 Å²	1	49 Å²	49	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	112.3	170.6	179	58	0	0	0	109.8	L569 I571 A577 I620 D627 M628 G629 Y631 V650	L569-L648 HydrophobicContact CB-CD1 4.16Å; L569-L648 HydrophobicContact CD2-CD1 4.1Å; L569-L648 HydrophobicContact CG-CD1 4.1Å; L569-L648 WeakPolarHBondContact O-CA 3.45Å; I571-L648 HydrophobicContact CG2-CD1 3.93Å; A577-L648 HydrophobicContact CB-CD1 3.95Å; A577-L648 HydrophobicContact CB-CD2 4.21Å; I620-L648 HydrophobicContact CD1-CD2 4.27Å; D627-L648 HydrophobicContact CB-CD2 4.42Å; M628-L648 WeakPolarHBondContact CA-O 3.22Å; M628-L648 VanDerWaalsContact CG-O 3.31Å; M628-L648 WeakPolarHBondContact CG-O 3.38Å; G629-L648 PolarHBondContact N-O 2.81Å; G629-L648 PolarHBondContact O-N 2.72Å; Y631-L648 HydrophobicContact CD2-CB 3.82Å; Y631-L648 HydrophobicContact CE2-CB 3.66Å; Y631-L648 HydrophobicContact CE2-CD2 3.82Å; Y631-L648 HydrophobicContact CE2-CG 4.37Å; L648-V650 HydrophobicContact CG-CG2 4.2Å
649	T	94.3	Very high	92.2	Very high	46 Å²	46	52.2 Å²	52.2	28%	0.282	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.2	175.9	-61.6	0	0	0	0	110.6	L569 T570 I571 M628 L651	L569-T649 PolarHBondContact O-N 2.89Å; T570-T649 WeakPolarHBondContact CA-O 3.35Å; T570-T649 HydrophobicContact CG2-CG2 4.22Å; I571-T649 PolarHBondContact N-O 3.33Å; M628-T649 HydrophobicContact CE-CG2 4.34Å; T649-L651 HydrophobicContact CG2-CD2 4.27Å
650	V	94	Very high	92.1	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	123.8	-176.5	-171	0	0	0	0	111.5	I571 T573 V623 T625 M628 L648 S680	I571-V650 CarbonylContact O-C 3.59Å; I571-V650 WeakPolarHBondContact O-CA 3.3Å; T573-V650 HydrophobicContact CG2-CG1 3.63Å; V623-V650 HydrophobicContact CG1-CB 4.28Å; V623-V650 HydrophobicContact CG1-CG1 3.82Å; V623-V650 HydrophobicContact CG1-CG2 3.42Å; V623-V650 VanDerWaalsContact CG1-CG2 3.42Å; T625-V650 HydrophobicContact CG2-CG1 4.44Å; M628-V650 HydrophobicContact CB-CG2 4.29Å; M628-V650 HydrophobicContact CE-CB 4.41Å; M628-V650 WeakPolarHBondContact CE-O 3.49Å; L648-V650 HydrophobicContact CG-CG2 4.2Å; V650-S680 WeakPolarHBondContact O-CB 3.34Å; V650-S680 PolarHBondContact O-OG 3.35Å
651	L	91.9	Very high	92	Very high	36 Å²	36	57.6 Å²	57.6	19%	0.188	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	126.4	-178.7	-54.6	-176.7	0	0	0	111	T570 I571 R572 T573 T649 S680 V730	T570-L651 HydrophobicContact CG2-CD1 3.56Å; T570-L651 HydrophobicContact CG2-CD2 4.01Å; T570-L651 HydrophobicContact CG2-CG 3.69Å; I571-L651 PolarHBondContact O-N 2.83Å; R572-L651 CarbonylContact C-O 3.1Å; R572-L651 VanDerWaalsContact CA-O 3.25Å; R572-L651 WeakPolarHBondContact CA-O 3.26Å; R572-L651 HydrophobicContact CG-CB 4.41Å; T573-L651 PolarHBondContact N-O 3.18Å; T649-L651 HydrophobicContact CG2-CD2 4.27Å; L651-S680 CarbonylContact C-O 3.46Å; L651-S680 VanDerWaalsContact CA-O 3.28Å; L651-S680 WeakPolarHBondContact CA-O 2.96Å; L651-V730 HydrophobicContact CB-CG2 3.8Å; L651-V730 HydrophobicContact CD1-CG2 4.46Å
652	E	90.5	Very high	91.9	Very high	52 Å²	52	58.4 Å²	58.4	24%	0.243	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	134.5	-179.2	-172.5	-166.1	166.2	0	0	109.5	T573 T625 S655 S680 N728	T573-E652 HydrophobicContact CG2-CB 3.69Å; T573-E652 HydrophobicContact CG2-CG 3.94Å; T625-E652 HydrophobicContact CG2-CB 4.16Å; E652-S655 PolarHBondContact OE1-OG 3.19Å; E652-S680 PolarHBondContact N-O 2.87Å; E652-S680 PolarHBondContact O-N 3.07Å; E652-S680 VanDerWaalsContact O-N 3.09Å; E652-S680 VanDerWaalsContact O-O 3.13Å; E652-N728 PolarHBondContact O-ND2 2.84Å
653	T	88.7	Confident	91.8	Very high	69 Å²	69	61.2 Å²	61.2	42%	0.423	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	152	175.7	49.3	0	0	0	0	111.8	S655 V730	T653-S655 PolarHBondContact O-N 3.08Å; T653-V730 HydrophobicContact CG2-CB 4.08Å; T653-V730 HydrophobicContact CG2-CG1 3.62Å
654	P	90.6	Very high	91.6	Very high	5 Å²	5	62.1 Å²	62.1	3%	0.032	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	128.3	-178.3	-23.5	35.3	0	0	0	112.1	G678 P683 M726 N728 G731 K733	P654-G678 WeakPolarHBondContact CA-O 3.35Å; P654-P683 HydrophobicContact CB-CB 3.99Å; P654-P683 HydrophobicContact CB-CG 4.29Å; P654-P683 HydrophobicContact CG-CB 4.06Å; P654-M726 HydrophobicContact CB-CB 4.16Å; P654-M726 HydrophobicContact CB-CG 3.64Å; P654-M726 HydrophobicContact CB-SD 3.66Å; P654-N728 WeakPolarHBondContact CD-OD1 3.47Å; P654-N728 HydrophobicContact CG-CB 4.24Å; P654-G731 WeakPolarHBondContact CG-O 3.46Å; P654-K733 HydrophobicContact CB-CB 4.28Å; P654-K733 WeakPolarHBondContact O-CB 3.42Å; P654-K733 VanDerWaalsContact O-CD 3.22Å; P654-K733 WeakPolarHBondContact O-CD 3.39Å
655	S	89.3	Confident	91.3	Very high	30 Å²	30	62 Å²	62	21%	0.21	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	154.6	-175.8	60	0	0	0	0	110.6	E652 T653 A677 G678 M726	E652-S655 PolarHBondContact OE1-OG 3.19Å; T653-S655 PolarHBondContact O-N 3.08Å; S655-A677 WeakPolarHBondContact O-CA 3.32Å; S655-G678 PolarHBondContact N-O 3.43Å; S655-G678 PolarHBondContact O-N 2.64Å; S655-M726 VanDerWaalsContact O-SD 3.34Å
656	F	90.2	Very high	90.8	Very high	40 Å²	40	58.3 Å²	58.3	18%	0.175	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	124.1	170.2	-67	-73.4	0	0	0	107	R658 L660 M726 K733	F656-R658 VanDerWaalsContact C-N 3.26Å; F656-R658 WeakPolarHBondContact CB-O 3.44Å; F656-L660 HydrophobicContact CD1-CD1 4.19Å; F656-L660 HydrophobicContact CD1-CD2 3.76Å; F656-L660 HydrophobicContact CD1-CG 4Å; F656-L660 HydrophobicContact CE1-CD1 3.68Å; F656-L660 HydrophobicContact CE1-CD2 3.88Å; F656-L660 HydrophobicContact CE1-CG 4Å; F656-L660 HydrophobicContact CE2-CD1 4.48Å; F656-L660 HydrophobicContact CG-CG 4.5Å; F656-L660 HydrophobicContact CZ-CD1 3.89Å; F656-M726 HydrophobicContact CD1-CE 3.38Å; F656-M726 HydrophobicContact CD1-SD 4.45Å; F656-M726 HydrophobicContact CE1-CE 3.28Å; F656-M726 HydrophobicContact CE1-SD 4.34Å; F656-M726 HydrophobicContact CG-CE 4.14Å; F656-M726 HydrophobicContact CZ-CE 3.96Å; F656-K733 HydrophobicContact CD2-CD 3.89Å; F656-K733 HydrophobicContact CD2-CG 4.42Å; F656-K733 HydrophobicContact CE2-CD 3.83Å; F656-K733 HydrophobicContact CE2-CG 3.84Å
657	V	87.9	Confident	90.3	Very high	86 Å²	86	65.7 Å²	65.7	52%	0.521	33%	0.331	S	S	.	.	S	Bend	trans	-72.9	-25.2	-179.5	-178.8	0	0	0	0	111.3	I676	V657-I676 HydrophobicContact CB-CB 4.2Å; V657-I676 HydrophobicContact CB-CG2 3.74Å; V657-I676 HydrophobicContact CG1-CG2 4.27Å; V657-I676 HydrophobicContact CG2-CG2 3.86Å; V657-I676 PolarHBondContact N-O 2.88Å
658	R	85.9	Confident	89.7	Confident	165 Å²	165	64.9 Å²	64.9	62%	0.623	33%	0.334	S	S	*	.	S	Bend	trans	-138.4	153.1	171.5	-63.3	-177.1	-176.6	139.3	3	108.5	F656	F656-R658 VanDerWaalsContact C-N 3.26Å; F656-R658 WeakPolarHBondContact CB-O 3.44Å
659	D	86.3	Confident	89.3	Confident	149 Å²	149	69.9 Å²	69.9	80%	0.797	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-59.1	148.3	172.1	-68	-48.2	0	0	0	111.1	E661	D659-E661 PolarHBondContact O-N 3.45Å
660	L	90.4	Very high	89.2	Confident	37 Å²	37	71.1 Å²	71.1	19%	0.194	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-79.4	118	179	-63.3	-177.1	0	0	0	108.9	F656 Q674 C675 I737	F656-L660 HydrophobicContact CD1-CD1 4.19Å; F656-L660 HydrophobicContact CD1-CD2 3.76Å; F656-L660 HydrophobicContact CD1-CG 4Å; F656-L660 HydrophobicContact CE1-CD1 3.68Å; F656-L660 HydrophobicContact CE1-CD2 3.88Å; F656-L660 HydrophobicContact CE1-CG 4Å; F656-L660 HydrophobicContact CE2-CD1 4.48Å; F656-L660 HydrophobicContact CG-CG 4.5Å; F656-L660 HydrophobicContact CZ-CD1 3.89Å; L660-Q674 VanDerWaalsContact CD2-O 3.3Å; L660-Q674 WeakPolarHBondContact CD2-O 3.39Å; L660-C675 HydrophobicContact CD2-CB 4.38Å; L660-I737 HydrophobicContact CB-CG1 3.87Å; L660-I737 HydrophobicContact CD1-CG1 4.35Å; L660-I737 HydrophobicContact CD2-CD1 4.26Å; L660-I737 HydrophobicContact CD2-CG1 4.38Å; L660-I737 HydrophobicContact CG-CG1 4.43Å
661	E	91.2	Very high	89	Confident	119 Å²	119	71.2 Å²	71.2	56%	0.556	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-96.6	125.7	-178.4	-66.3	176.9	171.8	0	0	111.2	D659 R663 I737	D659-E661 PolarHBondContact O-N 3.45Å; E661-R663 IonicContact OE2-CZ 3.03Å; E661-R663 IonicContact OE2-NE 2.75Å; E661-R663 IonicContact OE2-NH2 2.69Å; E661-R663 PolarHBondContact OE2-NH2 3.09Å; E661-I737 VanDerWaalsContact O-CG2 3.31Å; E661-I737 WeakPolarHBondContact O-CG2 3.41Å
662	D	91.4	Very high	89.1	Confident	98 Å²	98	72 Å²	72	52%	0.524	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-59.8	144.6	167.5	-70.7	-16.9	0	0	0	111	Y738	D662-Y738 WeakPolarHBondContact CA-O 3.3Å; D662-Y738 WeakPolarHBondContact OD1-CD2 3.21Å; D662-Y738 PolarHBondContact OD1-N 3.41Å
663	R	91.9	Very high	89.2	Confident	100 Å²	100	69.5 Å²	69.5	38%	0.377	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	133.7	-174.2	-71.7	-70.5	168.1	163.1	-6.5	111.5	E661 L673 Y738 L739 S740	E661-R663 IonicContact OE2-CZ 3.03Å; E661-R663 IonicContact OE2-NE 2.75Å; E661-R663 IonicContact OE2-NH2 2.69Å; E661-R663 PolarHBondContact OE2-NH2 3.09Å; R663-L673 HydrophobicContact CB-CD2 4.14Å; R663-L673 HydrophobicContact CG-CD2 4.32Å; R663-Y738 PolarHBondContact N-O 3.14Å; R663-L739 HydrophobicContact CB-CD1 4.17Å; R663-L739 CarbonylContact O-C 3.56Å; R663-L739 WeakPolarHBondContact O-CA 3.44Å; R663-S740 PolarHBondContact O-N 2.66Å
664	T	89.3	Confident	89.4	Confident	99 Å²	99	70 Å²	70	61%	0.607	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.7	171.6	-56.6	0	0	0	0	107.5	S740	T664-S740 WeakPolarHBondContact CA-O 3.4Å; T664-S740 WeakPolarHBondContact CG2-OG 3.13Å; T664-S740 PolarHBondContact OG1-OG 3.01Å
665	V	89	Confident	89.4	Confident	14 Å²	14	69.8 Å²	69.8	9%	0.085	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	149.4	177.8	-63.2	0	0	0	0	109.7	E669 A671 A714 L739 S740 V741 S742	V665-E669 HydrophobicContact CB-CB 4.34Å; V665-A671 HydrophobicContact CG1-CB 3.95Å; V665-A671 HydrophobicContact CG2-CB 4.28Å; V665-A714 HydrophobicContact CG2-CB 3.68Å; V665-L739 HydrophobicContact CG1-CD1 4.5Å; V665-L739 HydrophobicContact CG2-CD1 4.06Å; V665-S740 PolarHBondContact N-O 3.34Å; V665-V741 HydrophobicContact CG2-CG2 4.01Å; V665-V741 CarbonylContact O-C 3.45Å; V665-V741 WeakPolarHBondContact O-CA 3.41Å; V665-S742 PolarHBondContact O-N 2.89Å; V665-S742 PolarHBondContact O-OG 3.26Å
666	A	85.4	Confident	89.4	Confident	22 Å²	22	70.5 Å²	70.5	18%	0.182	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	149.7	169.5	0	0	0	0	0	110.2	G668 E669 S742	A666-G668 PolarHBondContact O-N 2.03Å; A666-G668 VanDerWaalsContact O-N 3.16Å; A666-E669 HydrophobicContact CB-CG 4.04Å; A666-E669 WeakPolarHBondContact CB-OE2 3.39Å; A666-E669 PolarHBondContact N-OE2 3.14Å; A666-E669 WeakPolarHBondContact O-CB 3.43Å; A666-E669 PolarHBondContact O-N 2.89Å; A666-S742 WeakPolarHBondContact CA-OG 3.44Å
667	R	86	Confident	89.3	Confident	155 Å²	155	69.2 Å²	69.2	59%	0.585	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	122.2	174.8	-179.6	179.3	175.2	164.8	-0.5	110.8	A714 V741 S742	R667-A714 WeakPolarHBondContact CA-O 3.45Å; R667-V741 HydrophobicContact CB-CG1 4.03Å; R667-S742 PolarHBondContact N-O 3.07Å
668	G	83.3	Confident	89.3	Confident	39 Å²	39	65.9 Å²	65.9	40%	0.402	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.2	-8.8	-178.3	0	0	0	0	0	115.2	A666 D713 A714	A666-G668 PolarHBondContact O-N 2.03Å; A666-G668 VanDerWaalsContact O-N 3.16Å; G668-D713 WeakPolarHBondContact CA-OD1 3.38Å; G668-A714 PolarHBondContact N-O 2.87Å
669	E	88.3	Confident	89.4	Confident	107 Å²	107	58.9 Å²	58.9	50%	0.5	32%	0.316	S	S	.	.	S	Bend	trans	-79.9	169	173.5	-65.3	-175.5	145	0	0	112.1	V665 A666 D713 A714	V665-E669 HydrophobicContact CB-CB 4.34Å; A666-E669 HydrophobicContact CB-CG 4.04Å; A666-E669 WeakPolarHBondContact CB-OE2 3.39Å; A666-E669 PolarHBondContact N-OE2 3.14Å; A666-E669 WeakPolarHBondContact O-CB 3.43Å; A666-E669 PolarHBondContact O-N 2.89Å; E669-D713 PolarHBondContact O-N 2.96Å; E669-A714 VanDerWaalsContact O-CB 3.31Å; E669-A714 WeakPolarHBondContact O-CB 3.34Å; E669-A714 PolarHBondContact O-N 2.79Å
670	T	91.4	Very high	89.5	Confident	72 Å²	72	52.9 Å²	52.9	44%	0.442	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-93.2	119.6	175.2	-61.4	0	0	0	0	110.5	V672 I710 I711 V712	T670-V672 HydrophobicContact CG2-CG2 4.45Å; T670-I710 HydrophobicContact CG2-CG2 3.55Å; T670-I711 CarbonylContact C-O 3.45Å; T670-I711 VanDerWaalsContact CA-O 3.3Å; T670-I711 WeakPolarHBondContact CA-O 3.34Å; T670-V712 HydrophobicContact CG2-CG2 4.14Å
671	A	91.2	Very high	89.4	Confident	1 Å²	1	54 Å²	54	1%	0.008	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	139.4	171	0	0	0	0	0	110.8	V665 I710 I711 L739	V665-A671 HydrophobicContact CG1-CB 3.95Å; V665-A671 HydrophobicContact CG2-CB 4.28Å; A671-I710 CarbonylContact O-C 3.38Å; A671-I710 WeakPolarHBondContact O-CA 3.33Å; A671-I711 HydrophobicContact CB-CB 4.31Å; A671-I711 PolarHBondContact N-O 2.89Å; A671-I711 PolarHBondContact O-N 3.44Å; A671-L739 HydrophobicContact CB-CD1 3.83Å; A671-L739 HydrophobicContact CB-CD2 3.93Å
672	V	93	Very high	89.2	Confident	52 Å²	52	52.4 Å²	52.4	32%	0.315	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	107.7	172.9	-177.3	0	0	0	0	108.5	T670 Q674 L708 I710	T670-V672 HydrophobicContact CG2-CG2 4.45Å; V672-Q674 HydrophobicContact CG1-CG 4.28Å; V672-L708 HydrophobicContact CG1-CD2 4.41Å; V672-I710 HydrophobicContact CG1-CG1 4.29Å; V672-I710 HydrophobicContact CG2-CG1 4.29Å; V672-I710 HydrophobicContact CG2-CG2 4.37Å
673	L	93.1	Very high	89.1	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	123	177.5	-47.5	-174.9	0	0	0	108.5	R663 W687 L709 I711 Y722 I737 L739	R663-L673 HydrophobicContact CB-CD2 4.14Å; R663-L673 HydrophobicContact CG-CD2 4.32Å; L673-W687 HydrophobicContact CB-CH2 3.89Å; L673-W687 HydrophobicContact CB-CZ3 4.15Å; L673-L709 HydrophobicContact CB-CB 4.35Å; L673-L709 HydrophobicContact CD1-CD2 4.36Å; L673-L709 PolarHBondContact N-O 3.12Å; L673-L709 PolarHBondContact O-N 3.07Å; L673-I711 HydrophobicContact CD1-CD1 4.46Å; L673-Y722 HydrophobicContact CD1-CD1 3.66Å; L673-Y722 HydrophobicContact CD1-CD2 3.55Å; L673-Y722 HydrophobicContact CD1-CE1 4.11Å; L673-Y722 HydrophobicContact CD1-CE2 4.04Å; L673-Y722 HydrophobicContact CD1-CG 3.35Å; L673-I737 HydrophobicContact CB-CD1 3.93Å; L673-I737 HydrophobicContact CD2-CG2 3.94Å; L673-L739 HydrophobicContact CD2-CB 4.37Å; L673-L739 HydrophobicContact CD2-CD1 4.28Å; L673-L739 HydrophobicContact CD2-CD2 4.47Å
674	Q	92.3	Very high	89.1	Confident	80 Å²	80	53.7 Å²	53.7	37%	0.374	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	122.4	-173.4	-52.3	-163.2	0.6	0	0	111.2	L660 V672 L708	L660-Q674 VanDerWaalsContact CD2-O 3.3Å; L660-Q674 WeakPolarHBondContact CD2-O 3.39Å; V672-Q674 HydrophobicContact CG1-CG 4.28Å; Q674-L708 HydrophobicContact CB-CD2 4.04Å; Q674-L708 HydrophobicContact CG-CD2 3.71Å
675	C	90.7	Very high	89.2	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.278	C	S	.	.			trans	-127.3	73.8	172.7	-177.4	0	0	0	0	109.1	L660 A677 L685 W687 Q707 C724	L660-C675 HydrophobicContact CD2-CB 4.38Å; C675-A677 PolarHBondContact O-N 2.96Å; C675-L685 HydrophobicContact CB-CD2 4.21Å; C675-L685 VanDerWaalsContact O-CD2 3.31Å; C675-L685 WeakPolarHBondContact O-CD2 3.39Å; C675-W687 HydrophobicContact CB-CH2 3.62Å; C675-W687 HydrophobicContact CB-CZ2 3.3Å; C675-Q707 CarbonylContact C-O 3.57Å; C675-Q707 PolarHBondContact N-O 2.67Å; C675-Q707 WeakPolarHBondContact O-CA 3.3Å; C675-Q707 WeakPolarHBondContact O-CB 3.41Å; C675-C724 HydrophobicContact CB-CB 3.69Å; C675-C724 WeakPolarHBondContact CB-SG 3.37Å; C675-C724 WeakPolarHBondContact SG-CB 3.31Å; C675-C724 CovalentContact SG-SG 2.03Å; C675-C724 PolarHBondContact SG-SG 2.95Å
676	I	90.3	Very high	89.3	Confident	44 Å²	44	53.9 Å²	53.9	23%	0.226	30%	0.299	C	S	.	.			trans	-76.8	118	-179.8	-54	179.2	0	0	0	108.8	V657	V657-I676 HydrophobicContact CB-CB 4.2Å; V657-I676 HydrophobicContact CB-CG2 3.74Å; V657-I676 HydrophobicContact CG1-CG2 4.27Å; V657-I676 HydrophobicContact CG2-CG2 3.86Å; V657-I676 PolarHBondContact N-O 2.88Å
677	A	88.1	Confident	89.7	Confident	14 Å²	14	53.1 Å²	53.1	12%	0.116	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	128	-169.9	0	0	0	0	0	112.3	S655 C675 P683 L685 M726	S655-A677 WeakPolarHBondContact O-CA 3.32Å; C675-A677 PolarHBondContact O-N 2.96Å; A677-P683 HydrophobicContact CB-CG 3.68Å; A677-L685 HydrophobicContact CB-CD1 3.74Å; A677-L685 HydrophobicContact CB-CD2 4.29Å; A677-L685 HydrophobicContact CB-CG 4.31Å; A677-M726 HydrophobicContact CB-CB 4.49Å; A677-M726 HydrophobicContact CB-CE 3.46Å; A677-M726 VanDerWaalsContact CB-CE 3.46Å; A677-M726 HydrophobicContact CB-SD 4.11Å
678	G	87.8	Confident	90.1	Very high	16 Å²	16	46.8 Å²	46.8	17%	0.165	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	170.1	169.5	0	0	0	0	0	111.6	P654 S655 P683	P654-G678 WeakPolarHBondContact CA-O 3.35Å; S655-G678 PolarHBondContact N-O 3.43Å; S655-G678 PolarHBondContact O-N 2.64Å; G678-P683 WeakPolarHBondContact O-CG 3.35Å
679	G	87	Confident	90.5	Very high	18 Å²	18	46.8 Å²	46.8	19%	0.186	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	129.4	157.2	-179.7	0	0	0	0	0	113.4	P681 A682	G679-P681 CarbonylContact C-O 3.6Å; G679-P681 CarbonylContact O-C 3.57Å; G679-A682 WeakPolarHBondContact O-CA 3.47Å; G679-A682 PolarHBondContact O-N 3.36Å
680	S	88.2	Confident	90.5	Very high	23 Å²	23	45.9 Å²	45.9	16%	0.161	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	117.1	-176.2	177	0	0	0	0	109.5	V650 L651 E652	V650-S680 WeakPolarHBondContact O-CB 3.34Å; V650-S680 PolarHBondContact O-OG 3.35Å; L651-S680 CarbonylContact C-O 3.46Å; L651-S680 VanDerWaalsContact CA-O 3.28Å; L651-S680 WeakPolarHBondContact CA-O 2.96Å; E652-S680 PolarHBondContact N-O 2.87Å; E652-S680 PolarHBondContact O-N 3.07Å; E652-S680 VanDerWaalsContact O-N 3.09Å; E652-S680 VanDerWaalsContact O-O 3.13Å
681	P	88.3	Confident	90.1	Very high	60 Å²	60	47.7 Å²	47.7	39%	0.39	27%	0.265	S	S	.	.	S	Bend	cis	-64.1	159.5	-4.5	-17.8	33.2	0	0	0	111.9	G679 N728 T729	G679-P681 CarbonylContact C-O 3.6Å; G679-P681 CarbonylContact O-C 3.57Å; P681-N728 WeakPolarHBondContact O-CB 3.3Å; P681-N728 PolarHBondContact O-ND2 3.47Å; P681-T729 WeakPolarHBondContact CD-OG1 3.44Å
682	A	87.3	Confident	89.9	Confident	86 Å²	86	48.9 Å²	48.9	71%	0.711	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-52.9	126.7	-179.8	0	0	0	0	0	111.4	G679	G679-A682 WeakPolarHBondContact O-CA 3.47Å; G679-A682 PolarHBondContact O-N 3.36Å
683	P	89.6	Confident	89.7	Confident	17 Å²	17	51.5 Å²	51.5	11%	0.11	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-74.1	150.5	-174.4	30.7	-36.7	0	0	0	112.7	P654 A677 G678 L685 M726 S727 N728	P654-P683 HydrophobicContact CB-CB 3.99Å; P654-P683 HydrophobicContact CB-CG 4.29Å; P654-P683 HydrophobicContact CG-CB 4.06Å; A677-P683 HydrophobicContact CB-CG 3.68Å; G678-P683 WeakPolarHBondContact O-CG 3.35Å; P683-L685 WeakPolarHBondContact O-CD1 3.08Å; P683-M726 HydrophobicContact CB-CB 4.16Å; P683-M726 HydrophobicContact CG-CB 4.44Å; P683-S727 CarbonylContact C-O 3.59Å; P683-S727 VanDerWaalsContact CA-O 3.29Å; P683-S727 WeakPolarHBondContact CA-O 3.44Å; P683-N728 HydrophobicContact CB-CB 4.24Å
684	R	90.8	Very high	89.5	Confident	208 Å²	208	52.5 Å²	52.5	79%	0.785	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	136.7	168.3	-61.8	-176.5	-178.5	-134	0.1	109.3	M726 S727	R684-M726 WeakPolarHBondContact O-CA 3.46Å; R684-S727 PolarHBondContact N-O 2.85Å; R684-S727 PolarHBondContact O-N 2.92Å
685	L	92.3	Very high	89.2	Confident	17 Å²	17	55.7 Å²	55.7	9%	0.089	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	142	179.5	-74.3	77.4	0	0	0	112.1	C675 A677 P683 N706 Q707 I725 M726	C675-L685 HydrophobicContact CB-CD2 4.21Å; C675-L685 VanDerWaalsContact O-CD2 3.31Å; C675-L685 WeakPolarHBondContact O-CD2 3.39Å; A677-L685 HydrophobicContact CB-CD1 3.74Å; A677-L685 HydrophobicContact CB-CD2 4.29Å; A677-L685 HydrophobicContact CB-CG 4.31Å; P683-L685 WeakPolarHBondContact O-CD1 3.08Å; L685-N706 HydrophobicContact CB-CB 4.18Å; L685-N706 WeakPolarHBondContact CD2-O 3.39Å; L685-Q707 HydrophobicContact CD1-CG 4.12Å; L685-Q707 HydrophobicContact CD2-CB 4.23Å; L685-Q707 HydrophobicContact CD2-CG 3.72Å; L685-I725 CarbonylContact C-O 3.56Å; L685-I725 WeakPolarHBondContact CA-O 3.38Å; L685-M726 HydrophobicContact CG-CB 4.34Å
686	N	91.4	Very high	88.9	Confident	99 Å²	99	60.4 Å²	60.4	53%	0.529	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	139	171.6	-173.8	21.2	0	0	0	109.7	I725	N686-I725 PolarHBondContact N-O 3.13Å; N686-I725 PolarHBondContact O-N 2.83Å
687	W	93.2	Very high	88.8	Confident	6 Å²	6	61.6 Å²	61.6	2%	0.023	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	143.9	-178.4	-72.1	83.8	0	0	0	111.5	L673 C675 L694 F702 N706 L709 C724 I737	L673-W687 HydrophobicContact CB-CH2 3.89Å; L673-W687 HydrophobicContact CB-CZ3 4.15Å; C675-W687 HydrophobicContact CB-CH2 3.62Å; C675-W687 HydrophobicContact CB-CZ2 3.3Å; W687-L694 HydrophobicContact CB-CD2 3.82Å; W687-L694 WeakPolarHBondContact O-CB 3.36Å; W687-F702 HydrophobicContact CB-CE1 4.27Å; W687-F702 HydrophobicContact CB-CZ 4.38Å; W687-F702 AromaticContact CD1-CE1 3.43Å; W687-F702 VanDerWaalsContact CD1-CE1 3.43Å; W687-F702 AromaticContact CG-CE1 3.94Å; W687-F702 HydrophobicContact CG-CE1 3.94Å; W687-F702 AromaticContact NE1-CE1 3.95Å; W687-N706 PolarHBondContact NE1-O 2.84Å; W687-L709 HydrophobicContact CB-CD2 4.47Å; W687-L709 HydrophobicContact CD2-CB 4.22Å; W687-L709 HydrophobicContact CD2-CD2 4.05Å; W687-L709 HydrophobicContact CE3-CB 4.49Å; W687-L709 HydrophobicContact CE3-CD2 3.95Å; W687-L709 HydrophobicContact CG-CD2 4.33Å; W687-L709 HydrophobicContact CH2-CB 4.28Å; W687-L709 HydrophobicContact CZ2-CB 4Å; W687-L709 HydrophobicContact CZ3-CD2 4.44Å; W687-C724 HydrophobicContact CD2-CB 4.17Å; W687-C724 HydrophobicContact CE3-CB 4.03Å; W687-C724 HydrophobicContact CH2-CB 4.2Å; W687-C724 HydrophobicContact CZ2-CB 4.31Å; W687-C724 HydrophobicContact CZ3-CB 4.04Å; W687-I737 HydrophobicContact CH2-CD1 3.84Å; W687-I737 HydrophobicContact CZ3-CD1 4.05Å
688	T	93.6	Very high	88.7	Confident	23 Å²	23	69.9 Å²	69.9	14%	0.141	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	150.9	179.6	40.9	0	0	0	0	109.1	G692 Y722 T723 I725	T688-G692 CarbonylContact C-O 3.39Å; T688-G692 WeakPolarHBondContact CA-O 3.37Å; T688-G692 WeakPolarHBondContact CB-O 3.41Å; T688-G692 WeakPolarHBondContact CG2-O 3.48Å; T688-Y722 CarbonylContact O-C 3.52Å; T688-Y722 WeakPolarHBondContact O-CA 3.46Å; T688-T723 PolarHBondContact N-O 3.27Å; T688-T723 PolarHBondContact O-N 3.4Å; T688-T723 VanDerWaalsContact OG1-CB 3.3Å; T688-T723 WeakPolarHBondContact OG1-CB 3.45Å; T688-T723 PolarHBondContact OG1-O 3.46Å; T688-I725 HydrophobicContact CG2-CD1 4.38Å
689	K	92.8	Very high	88.7	Confident	38 Å²	38	72.7 Å²	72.7	17%	0.165	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	131.7	179.5	-174.1	-177.5	-170.2	-76.8	0	109.3	D691 G692 L694 A717 D718 A719 K721 Y722	K689-D691 PolarHBondContact O-N 3.09Å; K689-G692 PolarHBondContact N-O 2.92Å; K689-G692 PolarHBondContact O-N 2.86Å; K689-L694 HydrophobicContact CB-CD1 3.92Å; K689-A717 PolarHBondContact NZ-O 3.16Å; K689-A717 VanDerWaalsContact NZ-O 3.13Å; K689-D718 VanDerWaalsContact CE-O 3.23Å; K689-D718 WeakPolarHBondContact CE-O 3.44Å; K689-A719 PolarHBondContact NZ-O 2.82Å; K689-K721 WeakPolarHBondContact CA-O 3.33Å; K689-Y722 HydrophobicContact CB-CD1 4.43Å; K689-Y722 HydrophobicContact CB-CE1 4.3Å; K689-Y722 HydrophobicContact CD-CE1 4.05Å; K689-Y722 HydrophobicContact CD-CE2 4.15Å; K689-Y722 WeakPolarHBondContact CD-OH 3.24Å; K689-Y722 WeakPolarHBondContact CE-OH 3.22Å; K689-Y722 HydrophobicContact CG-CD1 4.48Å; K689-Y722 HydrophobicContact CG-CE1 4.16Å; K689-Y722 HydrophobicContact CG-CE2 4.23Å
690	D	89.1	Confident	89	Confident	88 Å²	88	72.8 Å²	72.8	47%	0.471	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	42.3	179.4	-55.1	-45.2	0	0	0	112.1	G692 G720 K721	D690-G692 PolarHBondContact O-N 2.84Å; D690-G692 VanDerWaalsContact O-N 3.1Å; D690-G720 WeakPolarHBondContact OD1-CA 3.45Å; D690-K721 PolarHBondContact N-O 3.12Å; D690-K721 PolarHBondContact OD1-N 3.13Å
691	D	83.1	Confident	89.1	Confident	111 Å²	111	76.8 Å²	76.8	59%	0.594	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	10.1	-176.2	-57.6	-42	0	0	0	116	K689 K721	K689-D691 PolarHBondContact O-N 3.09Å; D691-K721 IonicContact OD1-NZ 3.12Å; D691-K721 PolarHBondContact OD1-NZ 2.92Å; D691-K721 IonicContact OD2-NZ 3.84Å; D691-K721 PolarHBondContact OD2-NZ 2.52Å
692	G	86.9	Confident	89.3	Confident	26 Å²	26	77.5 Å²	77.5	27%	0.268	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	177	169.2	0	0	0	0	0	114.2	T688 K689 D690	T688-G692 CarbonylContact C-O 3.39Å; T688-G692 WeakPolarHBondContact CA-O 3.37Å; T688-G692 WeakPolarHBondContact CB-O 3.41Å; T688-G692 WeakPolarHBondContact CG2-O 3.48Å; K689-G692 PolarHBondContact N-O 2.92Å; K689-G692 PolarHBondContact O-N 2.86Å; D690-G692 PolarHBondContact O-N 2.84Å; D690-G692 VanDerWaalsContact O-N 3.1Å
693	P	86.9	Confident	89.3	Confident	106 Å²	106	75.1 Å²	75.1	69%	0.688	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.8	137.4	175.7	27.7	-34.4	0	0	0	110.9	M695	P693-M695 PolarHBondContact O-N 3.11Å; P693-M695 VanDerWaalsContact O-N 3.13Å
694	L	89.5	Confident	89.2	Confident	22 Å²	22	77.2 Å²	77.2	12%	0.115	40%	0.399	C	S	.	.			trans	-68.4	111.4	175.5	176.5	63.9	0	0	0	109.9	W687 K689 L696 F702 L709 Y722	W687-L694 HydrophobicContact CB-CD2 3.82Å; W687-L694 WeakPolarHBondContact O-CB 3.36Å; K689-L694 HydrophobicContact CB-CD1 3.92Å; L694-L696 HydrophobicContact CD2-CD2 3.82Å; L694-L696 HydrophobicContact CG-CD2 4.03Å; L694-L696 PolarHBondContact O-N 2.74Å; L694-L696 VanDerWaalsContact O-N 3.12Å; L694-F702 HydrophobicContact CD2-CE1 4.49Å; L694-F702 HydrophobicContact CD2-CZ 3.92Å; L694-L709 HydrophobicContact CD2-CD1 4.16Å; L694-L709 HydrophobicContact CD2-CD2 3.59Å; L694-Y722 HydrophobicContact CD1-CD1 4.28Å; L694-Y722 HydrophobicContact CD1-CE1 3.7Å
695	M	85.9	Confident	89	Confident	147 Å²	147	71.2 Å²	71.2	72%	0.724	40%	0.395	S	S	*	.			trans	-77.3	96.1	176.8	-64.5	-58.9	-65	0	0	110.1	P693	P693-M695 PolarHBondContact O-N 3.11Å; P693-M695 VanDerWaalsContact O-N 3.13Å
696	L	85.4	Confident	88.9	Confident	100 Å²	100	73.7 Å²	73.7	52%	0.524	41%	0.408	S	S	.	.			trans	-69.8	139.2	179.3	-62.4	169.7	0	0	0	111.4	L694 H700 F702	L694-L696 HydrophobicContact CD2-CD2 3.82Å; L694-L696 HydrophobicContact CG-CD2 4.03Å; L694-L696 PolarHBondContact O-N 2.74Å; L694-L696 VanDerWaalsContact O-N 3.12Å; L696-H700 HydrophobicContact CD2-CB 3.83Å; L696-F702 HydrophobicContact CD1-CE2 3.93Å; L696-F702 HydrophobicContact CD2-CE2 3.69Å; L696-F702 HydrophobicContact CD2-CZ 3.98Å; L696-F702 HydrophobicContact CG-CE2 4.45Å
697	T	87.3	Confident	88.8	Confident	69 Å²	69	71.2 Å²	71.2	42%	0.423	39%	0.393	S	S	.	.			trans	-128.9	171.1	173.3	63.5	0	0	0	0	108.9	R699 H700	T697-R699 PolarHBondContact O-N 2.83Å; T697-R699 PolarHBondContact OG1-N 3.01Å; T697-H700 PolarHBondContact O-N 2.78Å; T697-H700 PolarHBondContact OG1-ND1 3.24Å
698	E	86.3	Confident	88.7	Confident	187 Å²	187	72.9 Å²	72.9	87%	0.874	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-12.9	175.5	-61.3	-178.7	172	0	0	114.1	F701	E698-F701 WeakPolarHBondContact O-CE2 3.44Å; E698-F701 WeakPolarHBondContact O-CZ 3.46Å
699	R	88.6	Confident	88.7	Confident	75 Å²	75	71.8 Å²	71.8	28%	0.283	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-12.3	174.1	-62.5	-172.3	-57.9	106.7	4.9	114.2	T697 I711 V712 D713 D718	T697-R699 PolarHBondContact O-N 2.83Å; T697-R699 PolarHBondContact OG1-N 3.01Å; R699-I711 WeakPolarHBondContact O-CA 3.4Å; R699-V712 WeakPolarHBondContact CB-O 3.45Å; R699-V712 WeakPolarHBondContact CD-O 3.47Å; R699-V712 PolarHBondContact NH1-O 3.02Å; R699-V712 VanDerWaalsContact NH1-O 3.13Å; R699-V712 PolarHBondContact O-N 3.3Å; R699-D713 PolarHBondContact NH1-O 3.28Å; R699-D718 IonicContact CZ-OD1 2.78Å; R699-D718 IonicContact CZ-OD2 3.11Å; R699-D718 IonicContact NH1-OD1 3.49Å; R699-D718 IonicContact NH1-OD2 3.89Å; R699-D718 PolarHBondContact NH1-OD2 3.37Å; R699-D718 IonicContact NH2-OD1 3.64Å; R699-D718 PolarHBondContact NH2-OD1 3.11Å; R699-D718 IonicContact NH2-OD2 2.74Å; R699-D718 PolarHBondContact NH2-OD2 2.81Å; R699-D718 VanDerWaalsContact NH2-OD2 3.11Å
700	H	92.1	Very high	88.7	Confident	20 Å²	20	72 Å²	72	9%	0.093	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	123	-176.6	-72	82.8	0	0	0	111.3	L696 T697 I710 D718	L696-H700 HydrophobicContact CD2-CB 3.83Å; T697-H700 PolarHBondContact O-N 2.78Å; T697-H700 PolarHBondContact OG1-ND1 3.24Å; H700-I710 CarbonylContact C-O 3.54Å; H700-I710 WeakPolarHBondContact CA-O 3.49Å; H700-D718 IonicContact CE1-OD1 3.68Å
701	F	91.5	Very high	88.9	Confident	108 Å²	108	67.8 Å²	67.8	47%	0.474	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	141	179.4	-56.3	-89.8	0	0	0	111.4	E698 I710 V712	E698-F701 WeakPolarHBondContact O-CE2 3.44Å; E698-F701 WeakPolarHBondContact O-CZ 3.46Å; F701-I710 HydrophobicContact CB-CB 4.28Å; F701-I710 PolarHBondContact N-O 3.32Å; F701-I710 PolarHBondContact O-N 2.88Å; F701-V712 HydrophobicContact CD2-CG2 4.02Å; F701-V712 HydrophobicContact CE2-CG2 3.82Å
702	F	91.7	Very high	89.2	Confident	74 Å²	74	65.2 Å²	65.2	33%	0.325	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	136.5	169.1	-69.2	-66.8	0	0	0	110.9	W687 L694 L696 N706 L708 L709	W687-F702 HydrophobicContact CB-CE1 4.27Å; W687-F702 HydrophobicContact CB-CZ 4.38Å; W687-F702 AromaticContact CD1-CE1 3.43Å; W687-F702 VanDerWaalsContact CD1-CE1 3.43Å; W687-F702 AromaticContact CG-CE1 3.94Å; W687-F702 HydrophobicContact CG-CE1 3.94Å; W687-F702 AromaticContact NE1-CE1 3.95Å; L694-F702 HydrophobicContact CD2-CE1 4.49Å; L694-F702 HydrophobicContact CD2-CZ 3.92Å; L696-F702 HydrophobicContact CD1-CE2 3.93Å; L696-F702 HydrophobicContact CD2-CE2 3.69Å; L696-F702 HydrophobicContact CD2-CZ 3.98Å; L696-F702 HydrophobicContact CG-CE2 4.45Å; F702-N706 WeakPolarHBondContact CB-OD1 3.05Å; F702-N706 HydrophobicContact CD1-CB 4.15Å; F702-N706 HydrophobicContact CG-CB 4.42Å; F702-L708 WeakPolarHBondContact CA-O 3.47Å; F702-L709 HydrophobicContact CD1-CB 4.38Å; F702-L709 HydrophobicContact CD1-CD1 4.09Å; F702-L709 HydrophobicContact CE1-CB 4.18Å; F702-L709 HydrophobicContact CE1-CD1 3.7Å; F702-L709 HydrophobicContact CE1-CG 4.36Å; F702-L709 HydrophobicContact CZ-CD1 4.17Å
703	A	87.8	Confident	89.3	Confident	36 Å²	36	68.6 Å²	68.6	30%	0.298	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	166.1	171.6	0	0	0	0	0	111.1	A705 N706 Q707 L708 I710	A703-A705 PolarHBondContact O-N 2.87Å; A703-N706 PolarHBondContact O-N 2.97Å; A703-Q707 PolarHBondContact O-N 3.31Å; A703-L708 HydrophobicContact CB-CB 4.11Å; A703-L708 HydrophobicContact CB-CD1 4.2Å; A703-L708 PolarHBondContact N-O 2.97Å; A703-L708 PolarHBondContact O-N 2.83Å; A703-L708 VanDerWaalsContact O-N 3.07Å; A703-I710 HydrophobicContact CB-CD1 4.18Å
704	A	87.2	Confident	89.3	Confident	61 Å²	61	63.5 Å²	63.5	50%	0.504	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	58.2	-179.7	0	0	0	0	0	113.6	N706 Q707 L708	A704-N706 VanDerWaalsContact C-N 3.33Å; A704-N706 PolarHBondContact O-N 3.21Å; A704-Q707 HydrophobicContact CB-CB 4.37Å; A704-Q707 WeakPolarHBondContact O-CB 3.47Å; A704-Q707 VanDerWaalsContact O-CG 3.24Å; A704-Q707 WeakPolarHBondContact O-CG 3.35Å; A704-Q707 PolarHBondContact O-N 3.01Å; A704-L708 HydrophobicContact CB-CD1 4.23Å; A704-L708 HydrophobicContact CB-CG 4.27Å
705	A	85.5	Confident	89.2	Confident	83 Å²	83	63.2 Å²	63.2	69%	0.686	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	46.9	-178.7	0	0	0	0	0	113.7	A703 Q707	A703-A705 PolarHBondContact O-N 2.87Å; A705-Q707 PolarHBondContact O-N 2.83Å
706	N	90.1	Very high	89	Confident	68 Å²	68	60.5 Å²	60.5	36%	0.364	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	65	13.4	-176.9	-52.9	-7.9	0	0	0	115.1	L685 W687 F702 A703 A704 L708	L685-N706 HydrophobicContact CB-CB 4.18Å; L685-N706 WeakPolarHBondContact CD2-O 3.39Å; W687-N706 PolarHBondContact NE1-O 2.84Å; F702-N706 WeakPolarHBondContact CB-OD1 3.05Å; F702-N706 HydrophobicContact CD1-CB 4.15Å; F702-N706 HydrophobicContact CG-CB 4.42Å; A703-N706 PolarHBondContact O-N 2.97Å; A704-N706 VanDerWaalsContact C-N 3.33Å; A704-N706 PolarHBondContact O-N 3.21Å; N706-L708 VanDerWaalsContact C-N 3.3Å
707	Q	89.6	Confident	89	Confident	47 Å²	47	59.8 Å²	59.8	22%	0.22	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-17.3	173.5	-62.9	-176.9	33.2	0	0	113.3	C675 L685 A703 A704 A705	C675-Q707 CarbonylContact C-O 3.57Å; C675-Q707 PolarHBondContact N-O 2.67Å; C675-Q707 WeakPolarHBondContact O-CA 3.3Å; C675-Q707 WeakPolarHBondContact O-CB 3.41Å; L685-Q707 HydrophobicContact CD1-CG 4.12Å; L685-Q707 HydrophobicContact CD2-CB 4.23Å; L685-Q707 HydrophobicContact CD2-CG 3.72Å; A703-Q707 PolarHBondContact O-N 3.31Å; A704-Q707 HydrophobicContact CB-CB 4.37Å; A704-Q707 WeakPolarHBondContact O-CB 3.47Å; A704-Q707 VanDerWaalsContact O-CG 3.24Å; A704-Q707 WeakPolarHBondContact O-CG 3.35Å; A704-Q707 PolarHBondContact O-N 3.01Å; A705-Q707 PolarHBondContact O-N 2.83Å
708	L	91.8	Very high	89	Confident	42 Å²	42	57 Å²	57	22%	0.22	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.9	173.8	-58.2	175.9	0	0	0	109.5	V672 Q674 F702 A703 A704 N706	V672-L708 HydrophobicContact CG1-CD2 4.41Å; Q674-L708 HydrophobicContact CB-CD2 4.04Å; Q674-L708 HydrophobicContact CG-CD2 3.71Å; F702-L708 WeakPolarHBondContact CA-O 3.47Å; A703-L708 HydrophobicContact CB-CB 4.11Å; A703-L708 HydrophobicContact CB-CD1 4.2Å; A703-L708 PolarHBondContact N-O 2.97Å; A703-L708 PolarHBondContact O-N 2.83Å; A703-L708 VanDerWaalsContact O-N 3.07Å; A704-L708 HydrophobicContact CB-CD1 4.23Å; A704-L708 HydrophobicContact CB-CG 4.27Å; N706-L708 VanDerWaalsContact C-N 3.3Å
709	L	93.3	Very high	89.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	113.3	167.9	173.9	56.2	0	0	0	108.7	L673 W687 L694 F702 I711 Y722	L673-L709 HydrophobicContact CB-CB 4.35Å; L673-L709 HydrophobicContact CD1-CD2 4.36Å; L673-L709 PolarHBondContact N-O 3.12Å; L673-L709 PolarHBondContact O-N 3.07Å; W687-L709 HydrophobicContact CB-CD2 4.47Å; W687-L709 HydrophobicContact CD2-CB 4.22Å; W687-L709 HydrophobicContact CD2-CD2 4.05Å; W687-L709 HydrophobicContact CE3-CB 4.49Å; W687-L709 HydrophobicContact CE3-CD2 3.95Å; W687-L709 HydrophobicContact CG-CD2 4.33Å; W687-L709 HydrophobicContact CH2-CB 4.28Å; W687-L709 HydrophobicContact CZ2-CB 4Å; W687-L709 HydrophobicContact CZ3-CD2 4.44Å; L694-L709 HydrophobicContact CD2-CD1 4.16Å; L694-L709 HydrophobicContact CD2-CD2 3.59Å; F702-L709 HydrophobicContact CD1-CB 4.38Å; F702-L709 HydrophobicContact CD1-CD1 4.09Å; F702-L709 HydrophobicContact CE1-CB 4.18Å; F702-L709 HydrophobicContact CE1-CD1 3.7Å; F702-L709 HydrophobicContact CE1-CG 4.36Å; F702-L709 HydrophobicContact CZ-CD1 4.17Å; L709-I711 HydrophobicContact CG-CG1 4.41Å; L709-Y722 HydrophobicContact CD2-CD1 3.61Å; L709-Y722 HydrophobicContact CD2-CE1 3.78Å
710	I	92.9	Very high	89.2	Confident	41 Å²	41	47 Å²	47	21%	0.21	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	130.2	-176.7	-55.7	172.3	0	0	0	108.1	T670 A671 V672 H700 F701 A703 V712	T670-I710 HydrophobicContact CG2-CG2 3.55Å; A671-I710 CarbonylContact O-C 3.38Å; A671-I710 WeakPolarHBondContact O-CA 3.33Å; V672-I710 HydrophobicContact CG1-CG1 4.29Å; V672-I710 HydrophobicContact CG2-CG1 4.29Å; V672-I710 HydrophobicContact CG2-CG2 4.37Å; H700-I710 CarbonylContact C-O 3.54Å; H700-I710 WeakPolarHBondContact CA-O 3.49Å; F701-I710 HydrophobicContact CB-CB 4.28Å; F701-I710 PolarHBondContact N-O 3.32Å; F701-I710 PolarHBondContact O-N 2.88Å; A703-I710 HydrophobicContact CB-CD1 4.18Å; I710-V712 HydrophobicContact CG2-CG2 4.37Å
711	I	93.5	Very high	89.3	Confident	0 Å²	0	48 Å²	48	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	107.8	179.8	-46.6	-179.8	0	0	0	107.9	T670 A671 L673 R699 L709 D718 Y722 L739	T670-I711 CarbonylContact C-O 3.45Å; T670-I711 VanDerWaalsContact CA-O 3.3Å; T670-I711 WeakPolarHBondContact CA-O 3.34Å; A671-I711 HydrophobicContact CB-CB 4.31Å; A671-I711 PolarHBondContact N-O 2.89Å; A671-I711 PolarHBondContact O-N 3.44Å; L673-I711 HydrophobicContact CD1-CD1 4.46Å; R699-I711 WeakPolarHBondContact O-CA 3.4Å; L709-I711 HydrophobicContact CG-CG1 4.41Å; I711-D718 HydrophobicContact CG2-CB 4.3Å; I711-Y722 HydrophobicContact CD1-CE1 3.91Å; I711-Y722 HydrophobicContact CD1-CE2 4.42Å; I711-Y722 VanDerWaalsContact CD1-OH 3.24Å; I711-Y722 WeakPolarHBondContact CD1-OH 3.08Å; I711-L739 HydrophobicContact CD1-CD2 3.85Å
712	V	90.4	Very high	89.5	Confident	57 Å²	57	42.8 Å²	42.8	35%	0.345	28%	0.278	S	S	.	.	S	Bend	trans	-84.6	145	-179.5	-176.6	0	0	0	0	109.9	T670 R699 F701 I710	T670-V712 HydrophobicContact CG2-CG2 4.14Å; R699-V712 WeakPolarHBondContact CB-O 3.45Å; R699-V712 WeakPolarHBondContact CD-O 3.47Å; R699-V712 PolarHBondContact NH1-O 3.02Å; R699-V712 VanDerWaalsContact NH1-O 3.13Å; R699-V712 PolarHBondContact O-N 3.3Å; F701-V712 HydrophobicContact CD2-CG2 4.02Å; F701-V712 HydrophobicContact CE2-CG2 3.82Å; I710-V712 HydrophobicContact CG2-CG2 4.37Å
713	D	88.3	Confident	89.5	Confident	97 Å²	97	39.5 Å²	39.5	52%	0.519	26%	0.264	S	S	.	.	S	Bend	trans	53.3	61.2	-178.4	-178.5	34.6	0	0	0	111.6	G668 E669 R699 G715	G668-D713 WeakPolarHBondContact CA-OD1 3.38Å; E669-D713 PolarHBondContact O-N 2.96Å; R699-D713 PolarHBondContact NH1-O 3.28Å; D713-G715 PolarHBondContact O-N 3.19Å
714	A	86.9	Confident	89.8	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	25%	0.25	C	S	.	.			trans	-65.1	122.5	-174.2	0	0	0	0	0	111.7	V665 R667 G668 E669 V741	V665-A714 HydrophobicContact CG2-CB 3.68Å; R667-A714 WeakPolarHBondContact CA-O 3.45Å; G668-A714 PolarHBondContact N-O 2.87Å; E669-A714 VanDerWaalsContact O-CB 3.31Å; E669-A714 WeakPolarHBondContact O-CB 3.34Å; E669-A714 PolarHBondContact O-N 2.79Å; A714-V741 HydrophobicContact CB-CG2 4.31Å
715	G	86.4	Confident	90	Very high	16 Å²	16	36.3 Å²	36.3	17%	0.165	23%	0.233	C	C	.	.			trans	-113.8	169	179.5	0	0	0	0	0	113.2	D713 A717 D718	D713-G715 PolarHBondContact O-N 3.19Å; G715-A717 PolarHBondContact O-N 3.08Å; G715-D718 PolarHBondContact N-OD2 2.89Å; G715-D718 WeakPolarHBondContact O-CB 3.49Å; G715-D718 PolarHBondContact O-N 3.02Å
716	P	82.8	Confident	90.3	Very high	89 Å²	89	32.3 Å²	32.3	58%	0.578	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-21.9	-176.9	-26.7	35.6	0	0	0	115.7	A719	P716-A719 WeakPolarHBondContact O-CB 3.33Å
717	A	85.3	Confident	90.4	Very high	86 Å²	86	31.3 Å²	31.3	71%	0.711	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-20	176.4	0	0	0	0	0	113.7	K689 G715 A719	K689-A717 PolarHBondContact NZ-O 3.16Å; K689-A717 VanDerWaalsContact NZ-O 3.13Å; G715-A717 PolarHBondContact O-N 3.08Å; A717-A719 VanDerWaalsContact C-N 3.31Å
718	D	87.9	Confident	90.5	Very high	10 Å²	10	30.4 Å²	30.4	5%	0.053	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-18.8	174.2	-52.3	-48.8	0	0	0	110.9	K689 R699 H700 I711 G715 Y722 L739	K689-D718 VanDerWaalsContact CE-O 3.23Å; K689-D718 WeakPolarHBondContact CE-O 3.44Å; R699-D718 IonicContact CZ-OD1 2.78Å; R699-D718 IonicContact CZ-OD2 3.11Å; R699-D718 IonicContact NH1-OD1 3.49Å; R699-D718 IonicContact NH1-OD2 3.89Å; R699-D718 PolarHBondContact NH1-OD2 3.37Å; R699-D718 IonicContact NH2-OD1 3.64Å; R699-D718 PolarHBondContact NH2-OD1 3.11Å; R699-D718 IonicContact NH2-OD2 2.74Å; R699-D718 PolarHBondContact NH2-OD2 2.81Å; R699-D718 VanDerWaalsContact NH2-OD2 3.11Å; H700-D718 IonicContact CE1-OD1 3.68Å; I711-D718 HydrophobicContact CG2-CB 4.3Å; G715-D718 PolarHBondContact N-OD2 2.89Å; G715-D718 WeakPolarHBondContact O-CB 3.49Å; G715-D718 PolarHBondContact O-N 3.02Å; D718-Y722 VanDerWaalsContact O-CE2 3.22Å; D718-Y722 WeakPolarHBondContact O-CE2 3.38Å; D718-Y722 PolarHBondContact O-OH 3.15Å; D718-L739 HydrophobicContact CB-CD2 4.49Å
719	A	88.2	Confident	90.3	Very high	33 Å²	33	34 Å²	34	27%	0.273	22%	0.219	S	C	.	.			trans	-59.4	142.2	170.6	0	0	0	0	0	111.1	K689 P716 A717 L739 V741	K689-A719 PolarHBondContact NZ-O 2.82Å; P716-A719 WeakPolarHBondContact O-CB 3.33Å; A717-A719 VanDerWaalsContact C-N 3.31Å; A719-L739 CarbonylContact C-O 3.6Å; A719-L739 VanDerWaalsContact CA-O 3.23Å; A719-L739 WeakPolarHBondContact CA-O 3.4Å; A719-L739 WeakPolarHBondContact CB-O 3.3Å; A719-V741 HydrophobicContact CB-CG2 4.28Å
720	G	90.8	Very high	90	Very high	19 Å²	19	34.8 Å²	34.8	20%	0.196	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151.2	-175.6	-176.9	0	0	0	0	0	113.9	D690 L739	D690-G720 WeakPolarHBondContact OD1-CA 3.45Å; G720-L739 PolarHBondContact N-O 3.12Å; G720-L739 PolarHBondContact O-N 3.16Å
721	K	93.9	Very high	89.7	Confident	40 Å²	40	34 Å²	34	17%	0.174	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	107.5	-179.8	179.5	-167.8	172.1	-157.8	0	109.7	K689 D690 D691 H736 Y738	K689-K721 WeakPolarHBondContact CA-O 3.33Å; D690-K721 PolarHBondContact N-O 3.12Å; D690-K721 PolarHBondContact OD1-N 3.13Å; D691-K721 IonicContact OD1-NZ 3.12Å; D691-K721 PolarHBondContact OD1-NZ 2.92Å; D691-K721 IonicContact OD2-NZ 3.84Å; D691-K721 PolarHBondContact OD2-NZ 2.52Å; K721-H736 VanDerWaalsContact CE-ND1 3.28Å; K721-H736 WeakPolarHBondContact CE-ND1 3.36Å; K721-H736 HydrophobicContact CG-CB 4.35Å; K721-Y738 HydrophobicContact CB-CD1 4Å; K721-Y738 HydrophobicContact CB-CE1 3.73Å; K721-Y738 HydrophobicContact CD-CE1 4.25Å; K721-Y738 HydrophobicContact CG-CD1 4.34Å; K721-Y738 HydrophobicContact CG-CE1 3.77Å
722	Y	94.6	Very high	89.6	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	118.4	173.3	-72.5	-100.5	0	0	0	109.7	L673 T688 K689 L694 L709 I711 D718 H736 I737 L739	L673-Y722 HydrophobicContact CD1-CD1 3.66Å; L673-Y722 HydrophobicContact CD1-CD2 3.55Å; L673-Y722 HydrophobicContact CD1-CE1 4.11Å; L673-Y722 HydrophobicContact CD1-CE2 4.04Å; L673-Y722 HydrophobicContact CD1-CG 3.35Å; T688-Y722 CarbonylContact O-C 3.52Å; T688-Y722 WeakPolarHBondContact O-CA 3.46Å; K689-Y722 HydrophobicContact CB-CD1 4.43Å; K689-Y722 HydrophobicContact CB-CE1 4.3Å; K689-Y722 HydrophobicContact CD-CE1 4.05Å; K689-Y722 HydrophobicContact CD-CE2 4.15Å; K689-Y722 WeakPolarHBondContact CD-OH 3.24Å; K689-Y722 WeakPolarHBondContact CE-OH 3.22Å; K689-Y722 HydrophobicContact CG-CD1 4.48Å; K689-Y722 HydrophobicContact CG-CE1 4.16Å; K689-Y722 HydrophobicContact CG-CE2 4.23Å; L694-Y722 HydrophobicContact CD1-CD1 4.28Å; L694-Y722 HydrophobicContact CD1-CE1 3.7Å; L709-Y722 HydrophobicContact CD2-CD1 3.61Å; L709-Y722 HydrophobicContact CD2-CE1 3.78Å; I711-Y722 HydrophobicContact CD1-CE1 3.91Å; I711-Y722 HydrophobicContact CD1-CE2 4.42Å; I711-Y722 VanDerWaalsContact CD1-OH 3.24Å; I711-Y722 WeakPolarHBondContact CD1-OH 3.08Å; D718-Y722 VanDerWaalsContact O-CE2 3.22Å; D718-Y722 WeakPolarHBondContact O-CE2 3.38Å; D718-Y722 PolarHBondContact O-OH 3.15Å; Y722-H736 CarbonylContact O-C 3.36Å; Y722-H736 WeakPolarHBondContact O-CA 3.31Å; Y722-I737 PolarHBondContact N-O 3.49Å; Y722-I737 PolarHBondContact O-N 2.84Å; Y722-L739 HydrophobicContact CD2-CB 4.05Å; Y722-L739 HydrophobicContact CE2-CB 3.89Å; Y722-L739 HydrophobicContact CE2-CD2 3.99Å
723	T	93.4	Very high	89.6	Confident	5 Å²	5	39.8 Å²	39.8	3%	0.031	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	114	178.3	-60.7	0	0	0	0	109.6	T688 I725 G735 H736	T688-T723 PolarHBondContact N-O 3.27Å; T688-T723 PolarHBondContact O-N 3.4Å; T688-T723 VanDerWaalsContact OG1-CB 3.3Å; T688-T723 WeakPolarHBondContact OG1-CB 3.45Å; T688-T723 PolarHBondContact OG1-O 3.46Å; T723-I725 HydrophobicContact CG2-CG1 4.13Å; T723-G735 CarbonylContact C-O 3.11Å; T723-G735 WeakPolarHBondContact CA-O 3.42Å; T723-H736 PolarHBondContact OG1-CE1 2.9Å; T723-H736 VanDerWaalsContact OG1-CE1 3.31Å; T723-H736 PolarHBondContact OG1-ND1 2.94Å
724	C	92.6	Very high	89.8	Confident	1 Å²	1	43 Å²	43	1%	0.007	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	130.1	170.6	-177.1	0	0	0	0	109.7	C675 W687 R734 G735	C675-C724 HydrophobicContact CB-CB 3.69Å; C675-C724 WeakPolarHBondContact CB-SG 3.37Å; C675-C724 WeakPolarHBondContact SG-CB 3.31Å; C675-C724 CovalentContact SG-SG 2.03Å; C675-C724 PolarHBondContact SG-SG 2.95Å; W687-C724 HydrophobicContact CD2-CB 4.17Å; W687-C724 HydrophobicContact CE3-CB 4.03Å; W687-C724 HydrophobicContact CH2-CB 4.2Å; W687-C724 HydrophobicContact CZ2-CB 4.31Å; W687-C724 HydrophobicContact CZ3-CB 4.04Å; C724-R734 WeakPolarHBondContact O-CA 3.43Å; C724-G735 PolarHBondContact N-O 2.86Å; C724-G735 PolarHBondContact O-N 3.14Å; C724-G735 VanDerWaalsContact O-N 3.08Å
725	I	91.9	Very high	90	Very high	28 Å²	28	43.4 Å²	43.4	14%	0.144	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	118.6	179.7	-53	178	0	0	0	107.6	L685 N686 T688 T723 T732 R734	L685-I725 CarbonylContact C-O 3.56Å; L685-I725 WeakPolarHBondContact CA-O 3.38Å; N686-I725 PolarHBondContact N-O 3.13Å; N686-I725 PolarHBondContact O-N 2.83Å; T688-I725 HydrophobicContact CG2-CD1 4.38Å; T723-I725 HydrophobicContact CG2-CG1 4.13Å; I725-T732 HydrophobicContact CG2-CG2 3.82Å; I725-R734 HydrophobicContact CB-CG 4.27Å; I725-R734 HydrophobicContact CG1-CG 3.95Å; I725-R734 HydrophobicContact CG2-CG 4.01Å
726	M	92.8	Very high	90.4	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	130	179.1	54.5	173.9	65.3	0	0	110.6	P654 S655 F656 A677 P683 R684 L685 T732 K733	P654-M726 HydrophobicContact CB-CB 4.16Å; P654-M726 HydrophobicContact CB-CG 3.64Å; P654-M726 HydrophobicContact CB-SD 3.66Å; S655-M726 VanDerWaalsContact O-SD 3.34Å; F656-M726 HydrophobicContact CD1-CE 3.38Å; F656-M726 HydrophobicContact CD1-SD 4.45Å; F656-M726 HydrophobicContact CE1-CE 3.28Å; F656-M726 HydrophobicContact CE1-SD 4.34Å; F656-M726 HydrophobicContact CG-CE 4.14Å; F656-M726 HydrophobicContact CZ-CE 3.96Å; A677-M726 HydrophobicContact CB-CB 4.49Å; A677-M726 HydrophobicContact CB-CE 3.46Å; A677-M726 VanDerWaalsContact CB-CE 3.46Å; A677-M726 HydrophobicContact CB-SD 4.11Å; P683-M726 HydrophobicContact CB-CB 4.16Å; P683-M726 HydrophobicContact CG-CB 4.44Å; R684-M726 WeakPolarHBondContact O-CA 3.46Å; L685-M726 HydrophobicContact CG-CB 4.34Å; M726-T732 CarbonylContact O-C 3.58Å; M726-T732 VanDerWaalsContact O-CA 3.24Å; M726-T732 WeakPolarHBondContact O-CA 3.49Å; M726-T732 WeakPolarHBondContact O-CG2 3.03Å; M726-K733 HydrophobicContact CG-CB 3.85Å; M726-K733 WeakPolarHBondContact CG-O 3.45Å; M726-K733 PolarHBondContact N-O 2.85Å; M726-K733 PolarHBondContact O-N 3.49Å; M726-K733 HydrophobicContact SD-CB 4.12Å
727	S	90.7	Very high	90.9	Very high	47 Å²	47	42.2 Å²	42.2	33%	0.329	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	137.5	-177.3	59.9	0	0	0	0	113	P683 R684 G731 T732	P683-S727 CarbonylContact C-O 3.59Å; P683-S727 VanDerWaalsContact CA-O 3.29Å; P683-S727 WeakPolarHBondContact CA-O 3.44Å; R684-S727 PolarHBondContact N-O 2.85Å; R684-S727 PolarHBondContact O-N 2.92Å; S727-G731 WeakPolarHBondContact CA-O 3.39Å; S727-T732 VanDerWaalsContact CB-OG1 3.24Å; S727-T732 WeakPolarHBondContact CB-OG1 3.46Å
728	N	91.3	Very high	91.3	Very high	28 Å²	28	44 Å²	44	15%	0.15	24%	0.235	C	C	.	.			trans	-131.8	-172.5	167.2	74.1	3.5	0	0	0	110	E652 P654 P681 P683 V730 G731	E652-N728 PolarHBondContact O-ND2 2.84Å; P654-N728 WeakPolarHBondContact CD-OD1 3.47Å; P654-N728 HydrophobicContact CG-CB 4.24Å; P681-N728 WeakPolarHBondContact O-CB 3.3Å; P681-N728 PolarHBondContact O-ND2 3.47Å; P683-N728 HydrophobicContact CB-CB 4.24Å; N728-V730 PolarHBondContact O-N 2.84Å; N728-V730 WeakPolarHBondContact OD1-CA 3.4Å; N728-V730 WeakPolarHBondContact OD1-CB 3.17Å; N728-V730 PolarHBondContact OD1-N 2.83Å; N728-G731 PolarHBondContact N-O 2.88Å; N728-G731 PolarHBondContact OD1-N 2.82Å; N728-G731 VanDerWaalsContact OD1-N 3.14Å
729	T	87.9	Confident	91.5	Very high	118 Å²	118	43.8 Å²	43.8	72%	0.724	23%	0.234	S	C	*	.	S	Bend	trans	-66.2	-13.1	179.7	49.4	0	0	0	0	114.2	P681	P681-T729 WeakPolarHBondContact CD-OG1 3.44Å
730	V	86.8	Confident	91.6	Very high	16 Å²	16	44.8 Å²	44.8	10%	0.097	24%	0.238	C	C	.	.	S	Bend	trans	-97.6	-31.7	-176.5	-159.2	0	0	0	0	112	R572 L651 T653 N728	R572-V730 HydrophobicContact CG-CG1 4.22Å; L651-V730 HydrophobicContact CB-CG2 3.8Å; L651-V730 HydrophobicContact CD1-CG2 4.46Å; T653-V730 HydrophobicContact CG2-CB 4.08Å; T653-V730 HydrophobicContact CG2-CG1 3.62Å; N728-V730 PolarHBondContact O-N 2.84Å; N728-V730 WeakPolarHBondContact OD1-CA 3.4Å; N728-V730 WeakPolarHBondContact OD1-CB 3.17Å; N728-V730 PolarHBondContact OD1-N 2.83Å
731	G	87.5	Confident	91.5	Very high	24 Å²	24	45.1 Å²	45.1	25%	0.247	24%	0.236	C	C	.	.			trans	178.8	-169.5	-178.6	0	0	0	0	0	114.6	P654 S727 N728	P654-G731 WeakPolarHBondContact CG-O 3.46Å; S727-G731 WeakPolarHBondContact CA-O 3.39Å; N728-G731 PolarHBondContact N-O 2.88Å; N728-G731 PolarHBondContact OD1-N 2.82Å; N728-G731 VanDerWaalsContact OD1-N 3.14Å
732	T	90.9	Very high	90.8	Very high	86 Å²	86	45.3 Å²	45.3	53%	0.528	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	134.3	177.4	-63.7	0	0	0	0	109.6	I725 M726 S727	I725-T732 HydrophobicContact CG2-CG2 3.82Å; M726-T732 CarbonylContact O-C 3.58Å; M726-T732 VanDerWaalsContact O-CA 3.24Å; M726-T732 WeakPolarHBondContact O-CA 3.49Å; M726-T732 WeakPolarHBondContact O-CG2 3.03Å; S727-T732 VanDerWaalsContact CB-OG1 3.24Å; S727-T732 WeakPolarHBondContact CB-OG1 3.46Å
733	K	91.4	Very high	89.4	Confident	93 Å²	93	50.7 Å²	50.7	40%	0.404	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	151.5	174	-164.4	173.9	-176.3	179.8	0	109.9	P654 F656 M726	P654-K733 HydrophobicContact CB-CB 4.28Å; P654-K733 WeakPolarHBondContact O-CB 3.42Å; P654-K733 VanDerWaalsContact O-CD 3.22Å; P654-K733 WeakPolarHBondContact O-CD 3.39Å; F656-K733 HydrophobicContact CD2-CD 3.89Å; F656-K733 HydrophobicContact CD2-CG 4.42Å; F656-K733 HydrophobicContact CE2-CD 3.83Å; F656-K733 HydrophobicContact CE2-CG 3.84Å; M726-K733 HydrophobicContact CG-CB 3.85Å; M726-K733 WeakPolarHBondContact CG-O 3.45Å; M726-K733 PolarHBondContact N-O 2.85Å; M726-K733 PolarHBondContact O-N 3.49Å; M726-K733 HydrophobicContact SD-CB 4.12Å
734	R	92.5	Very high	87.7	Confident	163 Å²	163	56.3 Å²	56.3	62%	0.615	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.7	152.7	179.3	-60.9	-171.3	174.1	142.6	-1.7	109.9	C724 I725	C724-R734 WeakPolarHBondContact O-CA 3.43Å; I725-R734 HydrophobicContact CB-CG 4.27Å; I725-R734 HydrophobicContact CG1-CG 3.95Å; I725-R734 HydrophobicContact CG2-CG 4.01Å
735	G	90.9	Very high	85.5	Confident	10 Å²	10	62.4 Å²	62.4	10%	0.103	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	162.3	178.4	0	0	0	0	0	110.5	T723 C724	T723-G735 CarbonylContact C-O 3.11Å; T723-G735 WeakPolarHBondContact CA-O 3.42Å; C724-G735 PolarHBondContact N-O 2.86Å; C724-G735 PolarHBondContact O-N 3.14Å; C724-G735 VanDerWaalsContact O-N 3.08Å
736	H	93.5	Very high	83.1	Confident	79 Å²	79	67 Å²	67	37%	0.366	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	143.8	-167.8	-50.7	-59.9	0	0	0	110.6	K721 Y722 T723	K721-H736 VanDerWaalsContact CE-ND1 3.28Å; K721-H736 WeakPolarHBondContact CE-ND1 3.36Å; K721-H736 HydrophobicContact CG-CB 4.35Å; Y722-H736 CarbonylContact O-C 3.36Å; Y722-H736 WeakPolarHBondContact O-CA 3.31Å; T723-H736 PolarHBondContact OG1-CE1 2.9Å; T723-H736 VanDerWaalsContact OG1-CE1 3.31Å; T723-H736 PolarHBondContact OG1-ND1 2.94Å
737	I	94.3	Very high	80.4	Confident	1 Å²	1	72.7 Å²	72.7	1%	0.005	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	125.4	169.4	-61.8	166.6	0	0	0	106.7	L660 E661 L673 W687 Y722	L660-I737 HydrophobicContact CB-CG1 3.87Å; L660-I737 HydrophobicContact CD1-CG1 4.35Å; L660-I737 HydrophobicContact CD2-CD1 4.26Å; L660-I737 HydrophobicContact CD2-CG1 4.38Å; L660-I737 HydrophobicContact CG-CG1 4.43Å; E661-I737 VanDerWaalsContact O-CG2 3.31Å; E661-I737 WeakPolarHBondContact O-CG2 3.41Å; L673-I737 HydrophobicContact CB-CD1 3.93Å; L673-I737 HydrophobicContact CD2-CG2 3.94Å; W687-I737 HydrophobicContact CH2-CD1 3.84Å; W687-I737 HydrophobicContact CZ3-CD1 4.05Å; Y722-I737 PolarHBondContact N-O 3.49Å; Y722-I737 PolarHBondContact O-N 2.84Å
738	Y	93.8	Very high	77.9	Confident	124 Å²	124	77.6 Å²	77.6	49%	0.486	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	120.2	169.5	-63.1	-81.8	0	0	0	109.5	D662 R663 K721	D662-Y738 WeakPolarHBondContact CA-O 3.3Å; D662-Y738 WeakPolarHBondContact OD1-CD2 3.21Å; D662-Y738 PolarHBondContact OD1-N 3.41Å; R663-Y738 PolarHBondContact N-O 3.14Å; K721-Y738 HydrophobicContact CB-CD1 4Å; K721-Y738 HydrophobicContact CB-CE1 3.73Å; K721-Y738 HydrophobicContact CD-CE1 4.25Å; K721-Y738 HydrophobicContact CG-CD1 4.34Å; K721-Y738 HydrophobicContact CG-CE1 3.77Å
739	L	93	Very high	75.3	Confident	5 Å²	5	82.1 Å²	82.1	3%	0.026	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	124.1	169.4	179.6	56.9	0	0	0	108.8	R663 V665 A671 L673 I711 D718 A719 G720 Y722	R663-L739 HydrophobicContact CB-CD1 4.17Å; R663-L739 CarbonylContact O-C 3.56Å; R663-L739 WeakPolarHBondContact O-CA 3.44Å; V665-L739 HydrophobicContact CG1-CD1 4.5Å; V665-L739 HydrophobicContact CG2-CD1 4.06Å; A671-L739 HydrophobicContact CB-CD1 3.83Å; A671-L739 HydrophobicContact CB-CD2 3.93Å; L673-L739 HydrophobicContact CD2-CB 4.37Å; L673-L739 HydrophobicContact CD2-CD1 4.28Å; L673-L739 HydrophobicContact CD2-CD2 4.47Å; I711-L739 HydrophobicContact CD1-CD2 3.85Å; D718-L739 HydrophobicContact CB-CD2 4.49Å; A719-L739 CarbonylContact C-O 3.6Å; A719-L739 VanDerWaalsContact CA-O 3.23Å; A719-L739 WeakPolarHBondContact CA-O 3.4Å; A719-L739 WeakPolarHBondContact CB-O 3.3Å; G720-L739 PolarHBondContact N-O 3.12Å; G720-L739 PolarHBondContact O-N 3.16Å; Y722-L739 HydrophobicContact CD2-CB 4.05Å; Y722-L739 HydrophobicContact CE2-CB 3.89Å; Y722-L739 HydrophobicContact CE2-CD2 3.99Å
740	S	89.6	Confident	72.8	Confident	53 Å²	53	81.2 Å²	81.2	37%	0.371	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	144.4	170	81.5	0	0	0	0	110.8	R663 T664 V665	R663-S740 PolarHBondContact O-N 2.66Å; T664-S740 WeakPolarHBondContact CA-O 3.4Å; T664-S740 WeakPolarHBondContact CG2-OG 3.13Å; T664-S740 PolarHBondContact OG1-OG 3.01Å; V665-S740 PolarHBondContact N-O 3.34Å
741	V	87.9	Confident	70.3	Confident	26 Å²	26	85.7 Å²	85.7	16%	0.158	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	111.8	-178.1	-178.1	0	0	0	0	108.6	V665 R667 A714 A719	V665-V741 HydrophobicContact CG2-CG2 4.01Å; V665-V741 CarbonylContact O-C 3.45Å; V665-V741 WeakPolarHBondContact O-CA 3.41Å; R667-V741 HydrophobicContact CB-CG1 4.03Å; A714-V741 HydrophobicContact CB-CG2 4.31Å; A719-V741 HydrophobicContact CB-CG2 4.28Å
742	S	79.4	Confident	67.7	Low	45 Å²	45	87.5 Å²	87.5	32%	0.315	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	143.9	-176.8	60.5	0	0	0	0	111.9	V665 A666 R667	V665-S742 PolarHBondContact O-N 2.89Å; V665-S742 PolarHBondContact O-OG 3.26Å; A666-S742 WeakPolarHBondContact CA-OG 3.44Å; R667-S742 PolarHBondContact N-O 3.07Å
743	P	65.6	Low	64.9	Low	112 Å²	112	94.6 Å²	94.6	73%	0.727	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-72.9	145.1	173.8	30.4	-33.8	0	0	0	111.1
744	L	56.9	Low	62.1	Low	124 Å²	124	96.6 Å²	96.6	65%	0.649	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-62.6	134	175.7	-70	159	0	0	0	110.8
745	P	47.3	Very low	59.3	Low	129 Å²	129	98.2 Å²	98.2	84%	0.838	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-73.7	132.5	179.8	28.5	-33.4	0	0	0	112.3
746	S	41.6	Very low	56.6	Low	123 Å²	123	105.5 Å²	105.5	86%	0.86	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-86.9	143.8	173.7	53.2	0	0	0	0	111.9
747	C	36.6	Very low	53.7	Low	121 Å²	121	104.4 Å²	104.4	82%	0.818	62%	0.621	S	S	*	*			trans	-117.3	136.5	-173.5	-172.7	0	0	0	0	111.3
748	D	37.3	Very low	50.9	Low	150 Å²	150	116.3 Å²	116.3	80%	0.802	67%	0.666	S	S	*	*			trans	-152.1	112.2	164.6	-118	-34	0	0	0	115.9
749	T	37.5	Very low	48.1	Very low	122 Å²	122	116.6 Å²	116.6	75%	0.748	68%	0.681	S	S	*	*			trans	25.1	119.3	147.9	54.1	0	0	0	0	126.4
750	A	34.1	Very low	45.6	Very low	100 Å²	100	123.3 Å²	123.3	83%	0.826	72%	0.722	S	S	*	*				114.8	141.9	111.8	0	0	0	0	0	123.3
751	A	34.5	Very low	43.1	Very low	110 Å²	110	126.8 Å²	126.8	91%	0.909	74%	0.741	S	S	*	*			trans	74.2	125.5	171.3	0	0	0	0	0	118.8
752	G	32.2	Very low	40.6	Very low	61 Å²	61	128.7 Å²	128.7	63%	0.629	77%	0.766	S	S	*	*			cis	165.7	137.1	-12.5	0	0	0	0	0	113.9
753	Y	33.5	Very low	39	Very low	235 Å²	235	133.5 Å²	133.5	92%	0.922	79%	0.787	S	S	*	*			trans	63.3	143.6	167.8	-52.2	-78.2	0	0	0	117.6
754	D	32.2	Very low	37.6	Very low	135 Å²	135	134.1 Å²	134.1	72%	0.722	79%	0.788	S	S	*	*			cis	-151.2	172.8	-0.4	-151	17.1	0	0	0	112.9
755	Y	34.7	Very low	36.9	Very low	198 Å²	198	133.9 Å²	133.9	78%	0.776	79%	0.791	S	S	*	*			trans	-28.7	129.5	-172.5	-78.3	-86.1	0	0	0	122.8
756	D	32.5	Very low	36.5	Very low	162 Å²	162	134.4 Å²	134.4	87%	0.866	79%	0.786	S	S	*	*				174.3	144.9	114	-92.6	-17.1	0	0	0	109.8
757	G	32.9	Very low	36.6	Very low	57 Å²	57	133.8 Å²	133.8	59%	0.588	78%	0.776	S	S	*	*			cis	160.8	34.7	3.3	0	0	0	0	0	115
758	W	36.1	Very low	36.7	Very low	251 Å²	251	133.6 Å²	133.6	95%	0.951	77%	0.771	S	S	*	*			trans	-139.1	125	-179.9	-67.5	94.6	0	0	0	114.3
759	T	34.4	Very low	37	Very low	129 Å²	129	132 Å²	132	79%	0.791	77%	0.766	S	S	*	*			trans	-106.5	123	176.2	50.7	0	0	0	0	111.5
760	T	40.2	Very low	37.2	Very low	147 Å²	147	131.4 Å²	131.4	90%	0.902	77%	0.766	S	S	*	*			trans	-98.1	114.1	168	-47.9	0	0	0	0	109.8
761	V	37.1	Very low	37.5	Very low	125 Å²	125	132.4 Å²	132.4	76%	0.758	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-86.4	117.9	178.3	177.6	0	0	0	0	109.5
762	G	36.1	Very low	37.8	Very low	66 Å²	66	133.4 Å²	133.4	68%	0.68	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-80.1	133.5	169	0	0	0	0	0	111.5
763	I	45.6	Very low	38.7	Very low	147 Å²	147	137.8 Å²	137.8	75%	0.754	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-86.3	125.7	175.9	-63.7	173.4	0	0	0	109.1	V765	I763-V765 HydrophobicContact CG2-CG2 4.14Å
764	V	35.8	Very low	39.7	Very low	124 Å²	124	129.9 Å²	129.9	75%	0.752	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-92.7	122.2	171.9	177.7	0	0	0	0	109	I766	V764-I766 HydrophobicContact CG1-CG1 4.04Å
765	V	42.5	Very low	40.5	Very low	119 Å²	119	129.6 Å²	129.6	72%	0.721	77%	0.768	S	S	*	*			trans	-110.6	117.6	171.7	-178.6	0	0	0	0	108.6	I763 V767	I763-V765 HydrophobicContact CG2-CG2 4.14Å; V765-V767 HydrophobicContact CG1-CG2 4.33Å
766	I	39.5	Very low	41.4	Very low	141 Å²	141	126.2 Å²	126.2	72%	0.723	77%	0.773	S	S	*	*			trans	-102.6	121.2	174.4	-60	175.9	0	0	0	107.8	V764 V768	V764-I766 HydrophobicContact CG1-CG1 4.04Å; I766-V768 HydrophobicContact CG2-CG2 4.13Å
767	V	42.5	Very low	41.9	Very low	110 Å²	110	125.7 Å²	125.7	67%	0.667	77%	0.77	S	S	*	*			trans	-104.1	118.2	172	-179.3	0	0	0	0	108.5	V765 V769	V765-V767 HydrophobicContact CG1-CG2 4.33Å; V767-V769 HydrophobicContact CG1-CG2 4.24Å
768	V	40.4	Very low	42.4	Very low	116 Å²	116	129.6 Å²	129.6	70%	0.703	78%	0.782	S	S	*	*			trans	-99.7	117.9	174.9	-179.9	0	0	0	0	108.7	I766	I766-V768 HydrophobicContact CG2-CG2 4.13Å
769	V	42.2	Very low	42.7	Very low	116 Å²	116	128.3 Å²	128.3	70%	0.703	78%	0.777	S	S	*	*			trans	-102.4	109.3	174.8	-179.2	0	0	0	0	108.8	V767	V767-V769 HydrophobicContact CG1-CG2 4.24Å
770	C	42.8	Very low	43.1	Very low	110 Å²	110	127.6 Å²	127.6	74%	0.743	77%	0.772	S	S	*	*			trans	-104.8	110.1	169.7	-77.5	0	0	0	0	109.7	V772	C770-V772 PolarHBondContact O-N 3.4Å
771	C	40.3	Very low	43.3	Very low	122 Å²	122	127.6 Å²	127.6	82%	0.824	77%	0.765	S	S	*	*			trans	-79.1	114.8	169.7	-60.7	0	0	0	0	109.8
772	V	40.7	Very low	43.5	Very low	130 Å²	130	127.7 Å²	127.7	79%	0.788	77%	0.765	S	S	*	*			trans	-107.3	129.1	161.3	179.1	0	0	0	0	107.8	C770 G774	C770-V772 PolarHBondContact O-N 3.4Å; V772-G774 PolarHBondContact O-N 3.39Å
773	V	50.8	Low	43.7	Very low	153 Å²	153	131.5 Å²	131.5	93%	0.927	77%	0.769	S	S	*	*	S	Bend	trans	-67.3	122.6	179.9	178.6	0	0	0	0	109.5
774	G	54	Low	43.2	Very low	69 Å²	69	132.6 Å²	132.6	71%	0.711	77%	0.765	S	S	*	*	S	Bend	trans	153.1	-45.2	162.7	0	0	0	0	0	117.1	V772	V772-G774 PolarHBondContact O-N 3.39Å
775	T	50.2	Low	43.1	Very low	130 Å²	130	135.3 Å²	135.3	80%	0.798	77%	0.769	S	S	*	*			trans	-146.3	138.6	-172.7	49	0	0	0	0	113.1	L777	T775-L777 PolarHBondContact O-N 3.46Å; T775-L777 VanDerWaalsContact O-N 3.13Å
776	S	52.4	Low	42.5	Very low	127 Å²	127	136.9 Å²	136.9	89%	0.888	77%	0.77	S	S	*	*			trans	-86.6	74.1	-169.4	-57.2	0	0	0	0	114
777	L	43.8	Very low	42	Very low	151 Å²	151	142.4 Å²	142.4	79%	0.791	78%	0.782	S	S	*	*			trans	-138.9	130.1	166.3	-71.5	175.8	0	0	0	111.3	T775	T775-L777 PolarHBondContact O-N 3.46Å; T775-L777 VanDerWaalsContact O-N 3.13Å
778	V	43.4	Very low	41.5	Very low	139 Å²	139	147.4 Å²	147.4	84%	0.842	79%	0.789	S	S	*	*			trans	-115.4	127.4	175.9	178	0	0	0	0	109.1
779	W	41.2	Very low	40.8	Very low	224 Å²	224	151.2 Å²	151.2	85%	0.848	80%	0.796	S	S	*	*			trans	-100.1	136.8	172.3	-72.9	88	0	0	0	110.6
780	V	43.3	Very low	40.2	Very low	113 Å²	113	150.5 Å²	150.5	69%	0.685	79%	0.788	S	S	*	*			trans	-115.2	122	170.8	180	0	0	0	0	108.4	V782	V780-V782 HydrophobicContact CG1-CG2 4.23Å
781	I	44.1	Very low	39.9	Very low	147 Å²	147	152.1 Å²	152.1	75%	0.754	79%	0.785	S	S	*	*			trans	-108.9	122.9	174.6	-60.8	176.4	0	0	0	108.1	I783	I781-I783 HydrophobicContact CG2-CG1 4.25Å
782	V	42.6	Very low	39.4	Very low	127 Å²	127	152.5 Å²	152.5	77%	0.77	78%	0.779	S	S	*	*			trans	-110.4	121.5	173.7	-179.4	0	0	0	0	108.5	V780	V780-V782 HydrophobicContact CG1-CG2 4.23Å
783	I	40.5	Very low	38.9	Very low	147 Å²	147	155.9 Å²	155.9	75%	0.754	78%	0.779	S	S	*	*			trans	-101.8	121.8	174.8	-59.5	177.9	0	0	0	108.4	I781	I781-I783 HydrophobicContact CG2-CG1 4.25Å
784	Y	34.8	Very low	37.9	Very low	169 Å²	169	152.9 Å²	152.9	66%	0.663	76%	0.764	S	S	*	*			trans	-116.7	129.4	177.7	-174.3	-107.7	0	0	0	110.5	M786	Y784-M786 HydrophobicContact CD1-CB 4.31Å; Y784-M786 HydrophobicContact CE1-CB 3.7Å; Y784-M786 HydrophobicContact CE1-CG 3.55Å; Y784-M786 HydrophobicContact CE1-SD 3.8Å; Y784-M786 WeakPolarHBondContact OH-CE 3.46Å; Y784-M786 PolarHBondContact OH-SD 3.13Å; Y784-M786 VanDerWaalsContact OH-SD 3.4Å
785	H	32.8	Very low	36.9	Very low	182 Å²	182	156.7 Å²	156.7	84%	0.843	77%	0.767	S	S	*	*			trans	-112.7	110.3	177.2	-112	-58.8	0	0	0	110.4
786	M	31.2	Very low	35.9	Very low	151 Å²	151	156.6 Å²	156.6	74%	0.744	77%	0.766	S	S	*	*			trans	-122.2	140.5	167.8	-114.2	-167.7	167.1	0	0	110.6	Y784	Y784-M786 HydrophobicContact CD1-CB 4.31Å; Y784-M786 HydrophobicContact CE1-CB 3.7Å; Y784-M786 HydrophobicContact CE1-CG 3.55Å; Y784-M786 HydrophobicContact CE1-SD 3.8Å; Y784-M786 WeakPolarHBondContact OH-CE 3.46Å; Y784-M786 PolarHBondContact OH-SD 3.13Å; Y784-M786 VanDerWaalsContact OH-SD 3.4Å
787	R	29.1	Very low	34.9	Very low	257 Å²	257	158.1 Å²	158.1	97%	0.97	77%	0.765	S	S	*	*			trans	-114.9	137.4	176	-156.7	175.5	-170.8	179.4	3.5	109.7
788	R	30.3	Very low	34.4	Very low	215 Å²	215	156.4 Å²	156.4	81%	0.811	76%	0.76	S	S	*	*			trans	-116.2	149.3	-156.7	-159.9	-171.2	-159.2	178.9	4.6	112.2
789	K	27.1	Very low	33.9	Very low	197 Å²	197	156.2 Å²	156.2	86%	0.857	75%	0.754	S	S	*	*			trans	-157.6	113.3	143.6	-96.3	-171.5	172.6	-170.1	0	105.8
790	N	29.8	Very low	33.5	Very low	100 Å²	100	153.9 Å²	153.9	54%	0.535	75%	0.753	S	S	.	*				65.6	132.8	72.1	-70.9	36.3	0	0	0	110.7
791	E	36.1	Very low	32.9	Very low	144 Å²	144	156.4 Å²	156.4	67%	0.673	76%	0.759	S	S	*	*			cis	-155.3	167	20	-116.4	138	-142.4	0	0	107.5
792	D	28.8	Very low	32.2	Very low	131 Å²	131	157.3 Å²	157.3	70%	0.701	77%	0.766	S	S	*	*			cis	-156.6	147.8	39.2	-89.5	-49.2	0	0	0	113.9
793	Y	31.3	Very low	31.6	Very low	201 Å²	201	159.4 Å²	159.4	79%	0.788	77%	0.772	S	S	*	*			trans	29.9	147.3	139.5	-72.3	-87.6	0	0	0	123.7
794	S	29.1	Very low	31.1	Very low	89 Å²	89	157.7 Å²	157.7	62%	0.622	77%	0.77	S	S	*	*			cis	-167.5	148	8.2	51.6	0	0	0	0	115.1
795	I	33.1	Very low	30.9	Very low	149 Å²	149	153.9 Å²	153.9	76%	0.764	77%	0.773	S	S	*	*			trans	62.6	128.5	138.2	-66.4	166.9	0	0	0	117.9
796	T	29.9	Very low	30.7	Very low	129 Å²	129	151.8 Å²	151.8	79%	0.791	77%	0.769	S	S	*	*			cis	-154.3	151.7	0.3	14	0	0	0	0	109.4
797	N	31.2	Very low	30.8	Very low	159 Å²	159	151.3 Å²	151.3	85%	0.85	77%	0.768	S	S	*	*			trans	-151.5	136.2	171.4	-154.4	27.1	0	0	0	109.7
798	T	33.5	Very low	31.4	Very low	114 Å²	114	144 Å²	144	70%	0.699	75%	0.753	S	S	*	*			trans	-177	131.2	167.5	40	0	0	0	0	105.8
799	D	32.6	Very low	31.3	Very low	135 Å²	135	139.4 Å²	139.4	72%	0.722	75%	0.754	S	S	*	*			cis	-155.7	173.3	-0.5	-81	-40.2	0	0	0	105.5
800	E	32.4	Very low	31.5	Very low	175 Å²	175	140.1 Å²	140.1	82%	0.818	75%	0.753	S	S	*	*			cis	-156	-179.6	7.4	-139.5	166.6	-172.8	0	0	110.7
801	M	29.6	Very low	31.5	Very low	166 Å²	166	143.6 Å²	143.6	82%	0.818	77%	0.771	S	S	*	*			trans	-47.7	145.1	-179.7	-75.9	169.2	154.2	0	0	118
802	N	29.6	Very low	31.2	Very low	167 Å²	167	141.5 Å²	141.5	89%	0.893	77%	0.772	S	S	*	*				-161.4	147.2	109.8	-96.5	-43.8	0	0	0	112.1
803	L	30.3	Very low	31.5	Very low	170 Å²	170	139.6 Å²	139.6	89%	0.89	77%	0.769	S	S	*	*			trans	-91.7	143	175.9	-91.4	156.1	0	0	0	110.4
804	P	31.2	Very low	31.5	Very low	112 Å²	112	139 Å²	139	73%	0.727	77%	0.773	S	S	*	*			trans	-90	155.3	-171.7	35.5	-35.1	0	0	0	113.7
805	A	29	Very low	31.4	Very low	88 Å²	88	137.8 Å²	137.8	73%	0.727	78%	0.775	S	S	*	*			trans	-133.9	121.6	157.1	0	0	0	0	0	108.2
806	D	30.7	Very low	31.3	Very low	139 Å²	139	136.2 Å²	136.2	74%	0.743	77%	0.772	S	S	*	*			trans	-122.6	126.8	168.6	-78.1	-54.3	0	0	0	107.8
807	I	32.5	Very low	31.2	Very low	141 Å²	141	138 Å²	138	72%	0.723	78%	0.776	S	S	*	*				75	131.3	54	-61.1	170.8	0	0	0	108.4
808	P	41.5	Very low	31	Very low	102 Å²	102	135.8 Å²	135.8	66%	0.662	77%	0.773	S	S	*	*			cis	-145.2	162.3	46.8	37.4	-16.6	0	0	0	119.8	Y810	P808-Y810 HydrophobicContact CB-CD2 4.46Å
809	S	29	Very low	30.8	Very low	120 Å²	120	138.9 Å²	138.9	84%	0.839	78%	0.78	S	S	*	*			trans	-144.9	114.7	137.5	59.2	0	0	0	0	110.3
810	Y	30.2	Very low	31.5	Very low	212 Å²	212	137 Å²	137	83%	0.831	78%	0.775	S	S	*	*			trans	-75.9	140.6	176.4	-89.1	-110.5	0	0	0	111.5	P808	P808-Y810 HydrophobicContact CB-CD2 4.46Å
811	L	29.6	Very low	31.3	Very low	173 Å²	173	135.7 Å²	135.7	91%	0.906	77%	0.769	S	S	*	*				-165.3	146.5	115.2	-104.8	160.6	0	0	0	111.6
812	S	30.9	Very low	31.2	Very low	99 Å²	99	136 Å²	136	69%	0.692	77%	0.768	S	S	*	*			trans	-109	179.5	-172.5	59.2	0	0	0	0	110
813	S	34.5	Very low	31	Very low	92 Å²	92	131.1 Å²	131.1	64%	0.643	76%	0.758	S	S	*	*			cis	-173.5	155.4	23.4	60.1	0	0	0	0	113.7
814	Q	30.9	Very low	30.8	Very low	187 Å²	187	133.9 Å²	133.9	87%	0.874	76%	0.758	S	S	*	*			trans	66.5	144.7	153.2	-41.9	-141.2	-14.7	0	0	118.4
815	G	27.9	Very low	30.5	Very low	64 Å²	64	133.7 Å²	133.7	66%	0.66	76%	0.76	S	S	*	*			cis	-163	178.8	-5.2	0	0	0	0	0	108.1
816	T	30.3	Very low	30.5	Very low	116 Å²	116	136.6 Å²	136.6	71%	0.712	76%	0.763	S	S	*	*			cis	175.7	128.8	-0.8	17	0	0	0	0	106
817	L	27.1	Very low	30.5	Very low	167 Å²	167	134.4 Å²	134.4	87%	0.874	76%	0.758	S	S	*	*			trans	63.7	145.9	148.1	-58.9	161.3	0	0	0	118.1
818	S	28.6	Very low	30.4	Very low	112 Å²	112	136.6 Å²	136.6	78%	0.783	77%	0.765	S	S	*	*			cis	-152.5	153.3	13.6	50.3	0	0	0	0	114.3
819	E	28.9	Very low	29.9	Very low	179 Å²	179	136.4 Å²	136.4	84%	0.836	77%	0.772	S	S	*	*			trans	-63	-175.6	163	-80.2	-174.2	147.3	0	0	114.8
820	P	47.6	Very low	30	Very low	97 Å²	97	133.9 Å²	133.9	63%	0.63	77%	0.765	S	S	*	*			cis	-144.5	-166.3	-44.4	42.1	-24.5	0	0	0	114.9
821	Q	27.3	Very low	30	Very low	147 Å²	147	128.9 Å²	128.9	69%	0.687	76%	0.762	S	S	*	*			trans	89.3	126.1	145.3	-85.3	-174.8	-51.9	0	0	123.4
822	E	28.2	Very low	30.2	Very low	171 Å²	171	128.3 Å²	128.3	80%	0.799	75%	0.754	S	S	*	*			trans	51.2	140.1	134.5	-64.1	170.9	-151.7	0	0	121.4
823	G	24.7	Very low	30.2	Very low	65 Å²	65	130.5 Å²	130.5	67%	0.67	75%	0.753	S	S	*	*			cis	169.5	173.1	-1.6	0	0	0	0	0	112.8
824	Y	25.8	Very low	30.1	Very low	228 Å²	228	133.2 Å²	133.2	89%	0.894	76%	0.756	S	S	*	*			trans	57	110.7	163.1	-77	-83.7	0	0	0	122.6
825	S	25.9	Very low	29.9	Very low	109 Å²	109	132.6 Å²	132.6	76%	0.762	76%	0.757	S	S	*	*				175.9	125.5	114.8	31.2	0	0	0	0	109.5
826	N	28.3	Very low	29.8	Very low	148 Å²	148	137.7 Å²	137.7	79%	0.791	77%	0.766	S	S	*	*				57.5	132.7	88.6	-71.8	-6.8	0	0	0	113.7
827	S	30.1	Very low	31.3	Very low	94 Å²	94	137.4 Å²	137.4	66%	0.657	77%	0.766	S	S	*	*			cis	-173.8	174.9	8.3	44.2	0	0	0	0	112.7
828	E	30.6	Very low	32.6	Very low	186 Å²	186	134.1 Å²	134.1	87%	0.869	76%	0.755	S	S	*	*			trans	74.4	143.6	157.9	-69	175.5	173.7	0	0	119.6
829	A	32.1	Very low	32.6	Very low	98 Å²	98	136.5 Å²	136.5	81%	0.81	76%	0.758	S	S	*	*			cis	-166.3	155.8	-15	0	0	0	0	0	113.3
830	G	29.5	Very low	32.5	Very low	67 Å²	67	132 Å²	132	69%	0.691	75%	0.746	S	S	*	*			trans	92.9	104.3	151	0	0	0	0	0	117.4
831	S	31.3	Very low	31.6	Very low	108 Å²	108	134.6 Å²	134.6	76%	0.755	76%	0.755	S	S	*	*				78.1	146.6	56.9	82.5	0	0	0	0	113.4
832	H	32.8	Very low	31.6	Very low	161 Å²	161	131 Å²	131	75%	0.745	76%	0.757	S	S	*	*			cis	-169	170.7	-3.6	-112.6	11.4	0	0	0	107.9
833	Q	32.5	Very low	31.7	Very low	145 Å²	145	132.3 Å²	132.3	68%	0.678	76%	0.756	S	S	*	*			cis	-155.7	-159.5	6.2	-139.2	172.1	-53.2	0	0	113.2
834	Q	31.4	Very low	31.9	Very low	148 Å²	148	135 Å²	135	69%	0.692	75%	0.754	S	S	*	*			trans	-78.5	165.6	-175.5	-59.9	148.7	-51.6	0	0	117.1
835	L	27.6	Very low	32	Very low	174 Å²	174	132.4 Å²	132.4	91%	0.911	75%	0.75	S	S	*	*				-176.1	158.2	113.1	-96.7	159.9	0	0	0	114
836	M	24.7	Very low	32.1	Very low	172 Å²	172	136.6 Å²	136.6	85%	0.847	75%	0.754	S	S	*	*			trans	-134.9	177.9	176.9	-97.8	-156.1	-176.5	0	0	108.4
837	P	63.2	Low	32.1	Very low	109 Å²	109	132.6 Å²	132.6	71%	0.708	75%	0.748	S	S	*	*			cis	-119.5	-112.7	-28.9	26.4	-2.7	0	0	0	108.2
838	P	52.6	Low	32	Very low	98 Å²	98	134 Å²	134	64%	0.636	75%	0.753	S	S	*	*			cis	-130.3	-171	-47.1	33.6	-12.8	0	0	0	114.7
839	L	28.5	Very low	31.8	Very low	162 Å²	162	132.9 Å²	132.9	85%	0.848	75%	0.753	S	S	*	*			trans	75.4	146.5	160.3	-58.8	168	0	0	0	118.5
840	S	27.6	Very low	31.6	Very low	84 Å²	84	131.6 Å²	131.6	59%	0.587	75%	0.749	S	S	*	*			cis	-172.5	154.7	-19.7	56.9	0	0	0	0	111.7
841	N	29	Very low	31.5	Very low	153 Å²	153	134.9 Å²	134.9	82%	0.818	76%	0.755	S	S	*	*			trans	60.1	135	149.8	-64.7	-16.8	0	0	0	121.1
842	G	27.9	Very low	31.1	Very low	71 Å²	71	134.7 Å²	134.7	73%	0.732	75%	0.753	S	S	*	*			trans	174.2	38.5	148.1	0	0	0	0	0	123
843	Y	29.3	Very low	30.8	Very low	198 Å²	198	138.5 Å²	138.5	78%	0.776	76%	0.762	S	S	*	*			trans	56.3	107.4	147.9	-76.3	-89.7	0	0	0	123.1
844	I	28.1	Very low	30.5	Very low	122 Å²	122	135 Å²	135	63%	0.626	77%	0.765	S	S	*	*				45.2	117.3	118.6	-55	179.3	0	0	0	119.9
845	H	28.7	Very low	30.3	Very low	174 Å²	174	135.1 Å²	135.1	81%	0.806	77%	0.77	S	S	*	*				-170.7	129.1	114.7	-103.9	-84	0	0	0	107.8
846	K	27.6	Very low	30.4	Very low	196 Å²	196	133.9 Å²	133.9	85%	0.852	77%	0.77	S	S	*	*				67	111.6	57.2	-104.1	-165.9	179.7	-173.2	0	115.5
847	G	28.2	Very low	30.5	Very low	64 Å²	64	128.7 Å²	128.7	66%	0.66	76%	0.761	S	S	*	*			trans	133.3	98	165.8	0	0	0	0	0	112.3
848	T	28.4	Very low	28.8	Very low	125 Å²	125	129.1 Å²	129.1	77%	0.767	77%	0.767	S	S	*	*				78.8	112.1	75.5	57.2	0	0	0	0	115.7
849	D	27.7	Very low	27.6	Very low	162 Å²	162	133 Å²	133	87%	0.866	78%	0.776	S	S	*	*			trans	55.9	140.8	135	-46.9	-27.5	0	0	0	123
850	G	26.6	Very low	27.5	Very low	70 Å²	70	130.5 Å²	130.5	72%	0.722	77%	0.768	S	S	*	*			trans	119.8	90.7	168.6	0	0	0	0	0	112.9
851	V	26.9	Very low	27.4	Very low	136 Å²	136	134.6 Å²	134.6	82%	0.824	78%	0.777	S	S	*	*				68.8	103.7	68.3	-174.6	0	0	0	0	114.3
852	C	24.4	Very low	27.3	Very low	104 Å²	104	133 Å²	133	70%	0.703	77%	0.773	S	S	*	*			trans	22.5	125.3	148.5	-52.2	0	0	0	0	121.2
853	Y	25.5	Very low	27.3	Very low	241 Å²	241	138.8 Å²	138.8	95%	0.945	78%	0.781	S	S	*	*				169.8	151.4	103.3	-106.1	-82.3	0	0	0	111.9
854	G	26.6	Very low	27.2	Very low	72 Å²	72	133 Å²	133	74%	0.742	78%	0.782	S	S	*	*			trans	135.4	110.6	155.8	0	0	0	0	0	117
855	D	27.4	Very low	27.2	Very low	150 Å²	150	136 Å²	136	80%	0.802	80%	0.799	S	S	*	*			trans	-70	154	174	-60.1	-73.1	0	0	0	114.4
856	T	29.6	Very low	27	Very low	148 Å²	148	131.3 Å²	131.3	91%	0.908	80%	0.798	S	S	*	*				158.9	145.6	110.5	41.7	0	0	0	0	113.9
857	G	27	Very low	27	Very low	64 Å²	64	130.6 Å²	130.6	66%	0.66	80%	0.8	S	S	*	*			trans	102.5	107.2	170.6	0	0	0	0	0	113.9
858	S	28.1	Very low	26.8	Very low	117 Å²	117	135.2 Å²	135.2	82%	0.818	81%	0.808	S	S	*	*				64.3	123.3	79.3	72.8	0	0	0	0	112.3
859	E	26.2	Very low	26.6	Very low	179 Å²	179	137.7 Å²	137.7	84%	0.836	81%	0.811	S	S	*	*			cis	-169.4	-179.9	12.4	-166.6	167.9	-129.3	0	0	108.7
860	V	27.1	Very low	26.3	Very low	110 Å²	110	135.3 Å²	135.3	67%	0.667	81%	0.806	S	S	*	*			trans	89.7	105	159.9	-172.1	0	0	0	0	120
861	E	25.6	Very low	26.1	Very low	170 Å²	170	141.8 Å²	141.8	79%	0.794	81%	0.814	S	S	*	*			trans	82.1	147.1	136.5	-75.9	173.1	-172.3	0	0	127
862	T	27.3	Very low	26	Very low	119 Å²	119	144.1 Å²	144.1	73%	0.73	82%	0.818	S	S	*	*			trans	80	115.1	159.1	44.7	0	0	0	0	122.1
863	E	26.5	Very low	25.9	Very low	194 Å²	194	142.2 Å²	142.2	91%	0.907	82%	0.816	S	S	*	*			trans	41.3	131.5	132.2	-58.5	-173.9	156.5	0	0	121.7
864	G	27.5	Very low	26	Very low	76 Å²	76	136.2 Å²	136.2	78%	0.784	81%	0.809	S	S	*	*			trans	156.1	115.9	160	0	0	0	0	0	114.3
865	N	27.6	Very low	25.9	Very low	185 Å²	185	139.6 Å²	139.6	99%	0.989	81%	0.81	S	S	*	*			trans	-64.3	134.2	167.4	-81.6	-32.7	0	0	0	110.5
866	G	26.3	Very low	25.8	Very low	76 Å²	76	140.6 Å²	140.6	78%	0.784	81%	0.807	S	S	*	*			trans	-151.9	94.2	176	0	0	0	0	0	110.9
867	M	27.5	Very low	25.5	Very low	180 Å²	180	140.2 Å²	140.2	89%	0.887	81%	0.805	S	S	*	*			trans	-73.5	138.3	-179.8	-165.8	-171.3	-56.6	0	0	110.6
868	L	23.4	Very low	25.4	Very low	161 Å²	161	141 Å²	141	84%	0.843	81%	0.814	S	S	*	*			trans	-151.6	106.8	166	-116.3	159.3	0	0	0	111.9
869	H	23.8	Very low	25.3	Very low	178 Å²	178	146.9 Å²	146.9	82%	0.824	82%	0.818	S	S	*	*			trans	-72	137.2	165.5	-113.7	-97.1	0	0	0	109.7
870	C	21	Very low	25.4	Very low	112 Å²	112	143.1 Å²	143.1	76%	0.757	81%	0.811	S	S	*	*			trans	-149.8	106	165.1	-102.5	0	0	0	0	110.3
871	K	23.8	Very low	25.3	Very low	205 Å²	205	143.1 Å²	143.1	89%	0.891	82%	0.816	S	S	*	*				179.3	133.6	127.9	-104.3	171.7	179.2	178.3	0	113.8
872	M	23.3	Very low	25.2	Very low	186 Å²	186	144.1 Å²	144.1	92%	0.916	82%	0.818	S	S	*	*			trans	-69.8	155.9	144.4	-74.6	-179.1	169.4	0	0	110.3
873	G	24	Very low	25.1	Very low	63 Å²	63	146.5 Å²	146.5	65%	0.649	82%	0.821	S	S	*	*				132.1	131.2	121.6	0	0	0	0	0	118
874	S	26.7	Very low	26	Very low	116 Å²	116	143 Å²	143	81%	0.811	82%	0.815	S	S	*	*			trans	68.8	150.3	160.1	71.4	0	0	0	0	117.9
875	L	24.6	Very low	25.9	Very low	143 Å²	143	142.5 Å²	142.5	75%	0.749	81%	0.81	S	S	*	*			cis	158.7	140.1	-28.8	-102.8	161.8	0	0	0	106
876	F	24.8	Very low	25.9	Very low	171 Å²	171	143.1 Å²	143.1	75%	0.75	81%	0.806	S	S	*	*			trans	83	132.3	148.1	-94	-57.7	0	0	0	123.8
877	T	24.6	Very low	26	Very low	139 Å²	139	144.3 Å²	144.3	85%	0.853	80%	0.803	S	S	*	*			trans	82	137.7	147	57.6	0	0	0	0	121.3
878	G	24.5	Very low	26	Very low	82 Å²	82	146 Å²	146	85%	0.845	80%	0.799	S	S	*	*			trans	156.3	103.2	155.2	0	0	0	0	0	114.8
879	R	25.7	Very low	26.4	Very low	239 Å²	239	146.1 Å²	146.1	90%	0.902	80%	0.796	S	S	*	*			trans	-104.3	139.7	-174.6	-130.5	-177.9	-175.6	179.1	0	112.1
880	S	27	Very low	26.5	Very low	100 Å²	100	140.9 Å²	140.9	70%	0.699	79%	0.79	S	S	*	*			trans	53.3	132.7	145.2	62.1	0	0	0	0	122.2
881	S	26.1	Very low	26.8	Very low	110 Å²	110	144.1 Å²	144.1	77%	0.769	80%	0.799	S	S	*	*				167	140.4	101.8	49.6	0	0	0	0	117
882	F	23.4	Very low	27.1	Very low	191 Å²	191	138.9 Å²	138.9	84%	0.838	79%	0.794	S	S	*	*			trans	27	117.1	146.6	-73.8	-97.8	0	0	0	125.1
883	H	25.4	Very low	27.2	Very low	170 Å²	170	133.6 Å²	133.6	79%	0.787	79%	0.787	S	S	*	*				64	167.4	108.1	-108.3	14.3	0	0	0	122.4
884	P	45.8	Very low	27.4	Very low	120 Å²	120	137 Å²	137	78%	0.779	80%	0.795	S	S	*	*				-133.9	-174.8	-93.4	40.7	-20.3	0	0	0	117.3
885	G	24.7	Very low	27.5	Very low	66 Å²	66	137 Å²	137	68%	0.68	80%	0.795	S	S	*	*			trans	167.8	125.7	166.5	0	0	0	0	0	113.2
886	E	28.7	Very low	27.6	Very low	197 Å²	197	135.7 Å²	135.7	92%	0.921	80%	0.798	S	S	*	*				63.8	137.5	86.9	-71.4	-167.8	163.6	0	0	115.6
887	S	28.4	Very low	27.7	Very low	102 Å²	102	131.5 Å²	131.5	71%	0.713	80%	0.803	S	S	*	*			cis	-169.4	150.1	-1	54	0	0	0	0	115.1
888	R	27.2	Very low	27.8	Very low	214 Å²	214	129 Å²	129	81%	0.808	80%	0.804	S	S	*	*			trans	46.8	138	139.2	-81.4	177.7	166.5	-138	-4.3	128.4
889	E	30.1	Very low	27.9	Very low	164 Å²	164	130.5 Å²	130.5	77%	0.766	81%	0.809	S	S	*	*				98.9	133.7	129.3	-81.7	172.8	-150.6	0	0	126
890	G	27.3	Very low	28	Very low	69 Å²	69	122.4 Å²	122.4	71%	0.711	80%	0.8	S	S	*	*			trans	113.7	95.4	158.3	0	0	0	0	0	118
891	L	27.6	Very low	28.1	Very low	179 Å²	179	123.8 Å²	123.8	94%	0.937	81%	0.807	S	S	*	*				59	132.5	81.6	-67.7	169.5	0	0	0	116.3
892	A	28.3	Very low	28	Very low	96 Å²	96	125.5 Å²	125.5	79%	0.793	81%	0.807	S	S	*	*			cis	-167.9	158.9	-0.8	0	0	0	0	0	114.9
893	G	26.6	Very low	28.1	Very low	75 Å²	75	123.1 Å²	123.1	77%	0.773	81%	0.808	S	S	*	*			trans	86.8	148.8	154.4	0	0	0	0	0	119.7
894	V	27.8	Very low	28	Very low	134 Å²	134	121.3 Å²	121.3	81%	0.812	80%	0.802	S	S	*	*			cis	-156.3	134.7	-4.4	171.5	0	0	0	0	110.9
895	S	28.1	Very low	27	Very low	115 Å²	115	121.3 Å²	121.3	80%	0.804	80%	0.804	S	S	*	*			trans	57.5	142.4	163.2	73.7	0	0	0	0	119.5
896	S	28.1	Very low	26.9	Very low	116 Å²	116	123.2 Å²	123.2	81%	0.811	81%	0.807	S	S	*	*			cis	-158.8	148.1	20.2	57.1	0	0	0	0	114.2
897	G	26.7	Very low	26.9	Very low	83 Å²	83	121.7 Å²	121.7	86%	0.856	81%	0.805	S	S	*	*			trans	102.3	133.6	145.2	0	0	0	0	0	118.9
898	G	27.1	Very low	26.6	Very low	86 Å²	86	122 Å²	122	89%	0.887	81%	0.806	S	S	*	*			trans	93.5	96.7	161.1	0	0	0	0	0	116.2
899	A	26.8	Very low	26.5	Very low	115 Å²	115	121.3 Å²	121.3	95%	0.95	81%	0.805	S	S	*	*			trans	-101.5	130.8	174.3	0	0	0	0	0	111.9
900	G	27.3	Very low	26.2	Very low	69 Å²	69	120.5 Å²	120.5	71%	0.711	81%	0.806	S	S	*	*			trans	-141.7	134.1	164.7	0	0	0	0	0	108.4
901	P	29.5	Very low	26	Very low	129 Å²	129	122.7 Å²	122.7	84%	0.838	80%	0.801	S	S	*	*			trans	-83.8	156.3	-165.7	32.8	-35.7	0	0	0	114.2
902	L	23.4	Very low	25.9	Very low	146 Å²	146	119.2 Å²	119.2	76%	0.764	80%	0.798	S	S	*	*			trans	-60.6	145	171.3	-71.3	72.5	0	0	0	111.5	I904	L902-I904 HydrophobicContact CB-CG1 4.41Å; L902-I904 HydrophobicContact CD2-CD1 4.15Å; L902-I904 HydrophobicContact CD2-CG1 4.2Å
903	V	25.2	Very low	25.8	Very low	141 Å²	141	120.4 Å²	120.4	86%	0.855	79%	0.791	S	S	*	*			trans	-94.1	111.4	151.5	177.7	0	0	0	0	107.6
904	I	23.6	Very low	25.8	Very low	131 Å²	131	125.1 Å²	125.1	67%	0.672	80%	0.797	S	S	*	*			trans	-99.9	125.8	163.1	-70.8	174.4	0	0	0	106.5	L902	L902-I904 HydrophobicContact CB-CG1 4.41Å; L902-I904 HydrophobicContact CD2-CD1 4.15Å; L902-I904 HydrophobicContact CD2-CG1 4.2Å
905	C	23.8	Very low	25.6	Very low	120 Å²	120	126.3 Å²	126.3	81%	0.811	79%	0.788	S	S	*	*			trans	-70.6	136.6	167.4	-63.5	0	0	0	0	110.2
906	S	24.3	Very low	25.5	Very low	107 Å²	107	126.5 Å²	126.5	75%	0.748	79%	0.789	S	S	*	*			trans	-151.4	95.7	162.4	62.1	0	0	0	0	111
907	D	26.9	Very low	25.4	Very low	165 Å²	165	130 Å²	130	88%	0.882	79%	0.785	S	S	*	*			trans	-67.7	131.4	144.6	-84.4	-41.1	0	0	0	108
908	C	23.7	Very low	25.3	Very low	109 Å²	109	132 Å²	132	74%	0.736	78%	0.78	S	S	*	*			trans	176.1	126.1	144.7	-98.2	0	0	0	0	113
909	Y	23.6	Very low	25.3	Very low	198 Å²	198	137.2 Å²	137.2	78%	0.776	77%	0.773	S	S	*	*			trans	61.4	137.1	151	-71.7	-101.8	0	0	0	118.1
910	D	24.3	Very low	25.3	Very low	147 Å²	147	137.4 Å²	137.4	79%	0.786	76%	0.755	S	S	*	*				-155.5	173.7	55.6	-141.9	-20.4	0	0	0	116.2
911	N	24.5	Very low	25.1	Very low	116 Å²	116	143.9 Å²	143.9	62%	0.62	76%	0.759	S	S	*	*			trans	-82	154	-169.4	-64.9	-91.6	0	0	0	115.2
912	A	25.1	Very low	24.7	Very low	105 Å²	105	143.1 Å²	143.1	87%	0.868	76%	0.756	S	S	*	*			trans	-148.9	115.8	141.6	0	0	0	0	0	111.8
913	N	26.6	Very low	24.7	Very low	122 Å²	122	144.2 Å²	144.2	65%	0.652	76%	0.757	S	S	*	*			trans	-71.6	147.9	176.7	-64.5	-84.8	0	0	0	112.5	Y915	N913-Y915 HydrophobicContact CB-CD2 4.5Å
914	I	25.5	Very low	24.6	Very low	174 Å²	174	148 Å²	148	89%	0.892	76%	0.757	S	S	*	*				-132.3	131.6	129.2	-64	-171.4	0	0	0	109.3
915	Y	24.4	Very low	24.7	Very low	158 Å²	158	146 Å²	146	62%	0.62	76%	0.76	S	S	*	*			trans	-80.8	145.5	178.9	-94.7	-117.5	0	0	0	112.6	N913 R917	N913-Y915 HydrophobicContact CB-CD2 4.5Å; Y915-R917 HydrophobicContact CD1-CG 4.49Å
916	S	25.9	Very low	24.6	Very low	120 Å²	120	150.9 Å²	150.9	84%	0.839	76%	0.763	S	S	*	*				-153.8	132	114.3	55.2	0	0	0	0	112.1
917	R	25.4	Very low	24.7	Very low	189 Å²	189	154 Å²	154	71%	0.713	77%	0.77	S	S	*	*			trans	-84.3	157.8	166	-64.3	174.3	175.4	172.4	-1.9	107.2	Y915	Y915-R917 HydrophobicContact CD1-CG 4.49Å
918	T	25.7	Very low	24.5	Very low	125 Å²	125	149.2 Å²	149.2	77%	0.767	76%	0.76	S	S	*	*				-156.9	146.6	55.5	42.2	0	0	0	0	110.3
919	R	25.7	Very low	24.7	Very low	196 Å²	196	152.9 Å²	152.9	74%	0.74	77%	0.766	S	S	*	*				54.7	133.9	69.3	-97.2	-167.7	163.1	167.7	-5.6	112.8
920	E	26.6	Very low	24.8	Very low	119 Å²	119	150.8 Å²	150.8	56%	0.556	77%	0.769	S	S	*	*			cis	-169.9	179.7	3.8	-159.1	156.1	-133.2	0	0	109.4
921	Y	23.8	Very low	24.9	Very low	205 Å²	205	151 Å²	151	80%	0.804	77%	0.77	S	S	*	*			trans	92.6	147.6	163.1	-78.7	-80.4	0	0	0	123.2
922	C	22	Very low	25.1	Very low	113 Å²	113	149.5 Å²	149.5	76%	0.764	77%	0.769	S	S	*	*			trans	-101.6	180	-167.8	-46.8	0	0	0	0	112.8
923	Q	23	Very low	25.2	Very low	168 Å²	168	151.7 Å²	151.7	79%	0.785	77%	0.765	S	S	*	*				135.3	111.1	112.7	-149.9	171.1	3.9	0	0	116.1
924	Y	23.2	Very low	25.2	Very low	220 Å²	220	150.9 Å²	150.9	86%	0.863	76%	0.761	S	S	*	*			trans	57.3	159	144	-82.6	-104.5	0	0	0	125
925	A	24.2	Very low	25.3	Very low	89 Å²	89	152.8 Å²	152.8	74%	0.736	76%	0.757	S	S	*	*			trans	87.5	120.1	165.9	0	0	0	0	0	116.6
926	Y	23	Very low	25.5	Very low	223 Å²	223	150 Å²	150	88%	0.875	77%	0.766	S	S	*	*			cis	79.9	143	49.8	-106.9	-83.9	0	0	0	115.5
927	L	25.6	Very low	25.6	Very low	173 Å²	173	152.1 Å²	152.1	91%	0.906	77%	0.767	S	S	*	*			trans	80.8	138.1	-175.1	-50.3	168.6	0	0	0	113.9
928	G	23	Very low	26.3	Very low	65 Å²	65	149.1 Å²	149.1	67%	0.67	77%	0.772	S	S	*	*			cis	145.4	145.3	-3.5	0	0	0	0	0	112
929	E	26.9	Very low	26.5	Very low	185 Å²	185	148.3 Å²	148.3	86%	0.864	77%	0.771	S	S	*	*			trans	70.5	120.2	171.3	-66.5	168.1	-173.1	0	0	115.3
930	D	26.6	Very low	26.6	Very low	155 Å²	155	147.4 Å²	147.4	83%	0.829	78%	0.78	S	S	*	*				63.2	129.6	83.8	-71.1	-29.7	0	0	0	112
931	D	26.8	Very low	26.8	Very low	150 Å²	150	149.3 Å²	149.3	80%	0.802	79%	0.787	S	S	*	*				-163.8	-179.2	54.6	-153.4	-23.9	0	0	0	112.6
932	S	27.2	Very low	27.2	Very low	86 Å²	86	145.9 Å²	145.9	60%	0.601	78%	0.783	S	S	*	*			trans	-83.1	156.1	-176.1	57.3	0	0	0	0	116.1
933	L	28.2	Very low	27.5	Very low	151 Å²	151	144 Å²	144	79%	0.791	78%	0.783	S	S	*	*				172.5	138.3	117.1	-122.4	73.9	0	0	0	116.4
934	D	26.8	Very low	27.9	Very low	105 Å²	105	144.6 Å²	144.6	56%	0.561	79%	0.79	S	S	*	*			trans	49.1	129.5	135.9	-105.2	4.3	0	0	0	126
935	R	28.1	Very low	28.1	Very low	214 Å²	214	137.5 Å²	137.5	81%	0.808	78%	0.784	S	S	*	*			trans	53	126.1	133.9	-68.4	170.2	-178.9	149.7	-8.7	121.6
936	A	27.7	Very low	28.4	Very low	98 Å²	98	140.8 Å²	140.8	81%	0.81	79%	0.789	S	S	*	*				178.2	144	88.2	0	0	0	0	0	114
937	L	27.6	Very low	28.8	Very low	165 Å²	165	134.8 Å²	134.8	86%	0.864	79%	0.785	S	S	*	*			trans	-86.1	160.4	160.1	-83.9	159.8	0	0	0	110
938	P	40.8	Very low	29	Very low	127 Å²	127	131.7 Å²	131.7	83%	0.825	79%	0.785	S	S	*	*				-144.1	164.3	109	36.1	-21.1	0	0	0	116.2
939	S	30.4	Very low	29.4	Very low	107 Å²	107	137.4 Å²	137.4	75%	0.748	79%	0.793	S	S	*	*			trans	-97	154.5	-176.7	55.3	0	0	0	0	114.8
940	L	28.3	Very low	30.4	Very low	177 Å²	177	133.6 Å²	133.6	93%	0.927	79%	0.785	S	S	*	*			trans	-164.8	164.5	155.1	-111	135.5	0	0	0	111.4
941	K	29.7	Very low	30.6	Very low	160 Å²	160	134.2 Å²	134.2	70%	0.696	78%	0.783	S	S	*	*				-163.4	158.1	-91.3	-151.9	-179.4	163	-86.3	0	108.1
942	D	31.3	Very low	30.7	Very low	133 Å²	133	133.9 Å²	133.9	71%	0.711	78%	0.781	S	S	*	*			trans	75.9	143.1	159.1	-56.2	-38.2	0	0	0	120.9
943	G	29.1	Very low	30.7	Very low	74 Å²	74	137 Å²	137	76%	0.763	80%	0.796	S	S	*	*			trans	-177.7	-15.9	172	0	0	0	0	0	127.3
944	L	31	Very low	30.8	Very low	179 Å²	179	134.1 Å²	134.1	94%	0.937	79%	0.794	S	S	*	*			trans	49.5	139.4	159.3	-80.9	151.8	0	0	0	125.6
945	G	27.8	Very low	30.7	Very low	71 Å²	71	136.4 Å²	136.4	73%	0.732	81%	0.806	S	S	*	*			trans	111.4	138.1	144.9	0	0	0	0	0	117.1
946	D	30.3	Very low	30.6	Very low	159 Å²	159	133.1 Å²	133.1	85%	0.85	81%	0.805	S	S	*	*			cis	150.5	134.6	-16.6	-112.5	-28.9	0	0	0	109.2
947	A	32	Very low	30.5	Very low	96 Å²	96	133 Å²	133	79%	0.793	80%	0.798	S	S	*	*			trans	113.3	127.8	143.4	0	0	0	0	0	122.6
948	A	30	Very low	30.5	Very low	108 Å²	108	132.5 Å²	132.5	89%	0.893	80%	0.795	S	S	*	*			trans	102.9	127.7	142.9	0	0	0	0	0	122
949	H	30.4	Very low	29.8	Very low	185 Å²	185	133.3 Å²	133.3	86%	0.856	79%	0.789	S	S	*	*			trans	-113.5	172.5	170	-109.9	-45.8	0	0	0	108.1
950	P	49	Very low	29.8	Very low	105 Å²	105	134.9 Å²	134.9	68%	0.682	79%	0.785	S	S	*	*			cis	-154.2	-177.2	46.2	43.6	-21.3	0	0	0	119.8
951	E	30	Very low	29.7	Very low	169 Å²	169	131.9 Å²	131.9	79%	0.79	78%	0.779	S	S	*	*			trans	76.8	113.6	150.3	-83	169.4	-151.4	0	0	124
952	D	28.9	Very low	29.6	Very low	143 Å²	143	130.4 Å²	130.4	77%	0.765	78%	0.778	S	S	*	*			trans	44.8	111.6	136.4	-63.9	1.7	0	0	0	123
953	T	28.7	Very low	29.5	Very low	150 Å²	150	133 Å²	133	92%	0.92	79%	0.786	S	S	*	*				-177.2	163.1	95.5	26.2	0	0	0	0	113.3
954	A	28.3	Very low	29.4	Very low	91 Å²	91	135.7 Å²	135.7	75%	0.752	79%	0.787	S	S	*	*			trans	-64	169.5	-162.7	0	0	0	0	0	120.1
955	L	26.1	Very low	29.4	Very low	154 Å²	154	132.8 Å²	132.8	81%	0.806	78%	0.782	S	S	*	*			trans	99.4	116.9	154	-83.9	143.4	0	0	0	120.5
956	D	26.2	Very low	29.4	Very low	145 Å²	145	133.5 Å²	133.5	78%	0.775	78%	0.781	S	S	*	*			trans	78.4	140.2	147.1	-86.1	-28.7	0	0	0	124.4
957	S	25.1	Very low	29.2	Very low	95 Å²	95	133.4 Å²	133.4	66%	0.664	78%	0.776	S	S	*	*			trans	82.2	122.9	157.5	74.9	0	0	0	0	120.3
958	L	26.8	Very low	28.9	Very low	154 Å²	154	135.8 Å²	135.8	81%	0.806	77%	0.77	S	S	*	*			trans	71.7	146.4	144.4	-63.3	163.8	0	0	0	116.3
959	M	27.2	Very low	28.7	Very low	144 Å²	144	139.5 Å²	139.5	71%	0.709	76%	0.762	S	S	*	*			cis	-168	-178.5	20.3	-122.9	-100	-121.4	0	0	112.5
960	H	29.4	Very low	28.4	Very low	141 Å²	141	137.8 Å²	137.8	65%	0.653	77%	0.765	S	S	*	*			trans	81.7	123	153.7	-64.1	-18.9	0	0	0	122.7
961	S	27.2	Very low	27.4	Very low	114 Å²	114	140 Å²	140	80%	0.797	76%	0.764	S	S	*	*				-152.2	119.2	99.6	-2.8	0	0	0	0	108.6
962	N	27.6	Very low	27.3	Very low	128 Å²	128	138.5 Å²	138.5	68%	0.684	76%	0.761	S	S	*	*				56.3	113.5	93.7	-78	-6.3	0	0	0	114.7
963	H	29.2	Very low	27.2	Very low	189 Å²	189	136.3 Å²	136.3	88%	0.875	76%	0.757	S	S	*	*				-167.3	136.1	99.6	-105.6	-75.9	0	0	0	113.1
964	T	26.6	Very low	27.1	Very low	129 Å²	129	136.3 Å²	136.3	79%	0.791	75%	0.751	S	S	*	*			trans	-111.3	147.7	167.9	41.5	0	0	0	0	110.2
965	S	30.1	Very low	27	Very low	118 Å²	118	137 Å²	137	83%	0.825	75%	0.75	S	S	*	*			trans	165	114.5	154.6	-76	0	0	0	0	107.5
966	A	27.8	Very low	27	Very low	87 Å²	87	140.6 Å²	140.6	72%	0.719	75%	0.753	S	S	*	*				74.2	142.1	83.7	0	0	0	0	0	113.2
967	E	27.1	Very low	27	Very low	156 Å²	156	138.8 Å²	138.8	73%	0.729	75%	0.752	S	S	*	*			cis	-166.6	150.8	-7.5	-114.2	-176.6	140.3	0	0	110.3
968	Q	25.2	Very low	26.9	Very low	146 Å²	146	141.1 Å²	141.1	68%	0.682	76%	0.756	S	S	*	*			trans	62.8	133	138.1	-70.6	-176.6	3.9	0	0	126.3
969	Y	25.7	Very low	26.8	Very low	186 Å²	186	144.2 Å²	144.2	73%	0.729	76%	0.757	S	S	*	*			trans	59.8	121.6	136.8	-86.2	-81.7	0	0	0	123.5
970	V	25.2	Very low	26.6	Very low	150 Å²	150	146.3 Å²	146.3	91%	0.909	76%	0.757	S	S	*	*				-139.8	159.3	124.7	176.2	0	0	0	0	108.8
971	K	26.2	Very low	26.5	Very low	151 Å²	151	145.2 Å²	145.2	66%	0.657	75%	0.752	S	S	*	*			trans	-131.1	169.4	-171.9	-146.4	-172.3	-173.8	-175.2	0	110.3
972	D	29.5	Very low	26.4	Very low	137 Å²	137	146.4 Å²	146.4	73%	0.733	75%	0.75	S	S	*	*			trans	72.4	146.5	161.6	-64.4	-12.7	0	0	0	116.5
973	S	26.2	Very low	26.3	Very low	97 Å²	97	149.2 Å²	149.2	68%	0.678	76%	0.758	S	S	*	*			cis	-172.7	171.3	-4.2	48.2	0	0	0	0	114.9
974	L	27.4	Very low	26.2	Very low	150 Å²	150	147.7 Å²	147.7	79%	0.785	76%	0.757	S	S	*	*			trans	86.2	121	143	-82.1	160.8	0	0	0	124.5
975	S	24.9	Very low	27.6	Very low	105 Å²	105	146.6 Å²	146.6	73%	0.734	75%	0.752	S	S	*	*			trans	75	158.4	133.8	73.1	0	0	0	0	120.9
976	R	26.4	Very low	27.4	Very low	230 Å²	230	146.6 Å²	146.6	87%	0.868	75%	0.752	S	S	*	*			cis	-174.8	157.5	-42.7	-134.4	-174.7	-162.4	-161.2	6.2	108.2
977	S	25.5	Very low	27.3	Very low	108 Å²	108	147.2 Å²	147.2	76%	0.755	75%	0.751	S	S	*	*			trans	73.1	156.4	157.6	84.9	0	0	0	0	118.2
978	L	24.4	Very low	27.3	Very low	143 Å²	143	146.3 Å²	146.3	75%	0.749	76%	0.756	S	S	*	*			cis	-169.6	177.8	-22.2	-113.9	163.9	0	0	0	109.7
979	W	23.4	Very low	27.2	Very low	220 Å²	220	144.8 Å²	144.8	83%	0.833	76%	0.761	S	S	*	*			trans	86.6	126.6	175.1	-52	97.4	0	0	0	115.9
980	R	22.9	Very low	27.4	Very low	188 Å²	188	144.8 Å²	144.8	71%	0.709	77%	0.768	S	S	*	*			cis	71	138.6	38	-76.8	-178.3	162.2	-131.9	1.4	113.5
981	E	27.4	Very low	28.3	Very low	118 Å²	118	143.6 Å²	143.6	55%	0.551	76%	0.764	S	S	*	*			cis	-160.7	-176.7	4.7	-132	153.6	-176.4	0	0	111
982	D	25.1	Very low	28.3	Very low	139 Å²	139	139.7 Å²	139.7	74%	0.743	77%	0.766	S	S	*	*			trans	73.1	143.8	158.4	-54.7	-18.9	0	0	0	120.5
983	E	25.9	Very low	28.4	Very low	186 Å²	186	138.1 Å²	138.1	87%	0.869	77%	0.772	S	S	*	*			cis	-155.2	-174.7	-15.8	-128.9	-165.6	-169.7	0	0	112.8
984	D	27.8	Very low	28.7	Very low	158 Å²	158	137.7 Å²	137.7	85%	0.845	77%	0.769	S	S	*	*			trans	-91.4	179.9	-155.1	-121.6	6.6	0	0	0	117.2
985	P	55.7	Low	28.9	Very low	106 Å²	106	138.3 Å²	138.3	69%	0.688	77%	0.768	S	S	*	*			trans	-110.7	171	-161.2	42.6	-39.5	0	0	0	117.3
986	S	26	Very low	29	Very low	117 Å²	117	139.9 Å²	139.9	82%	0.818	77%	0.767	S	S	*	*			trans	178.4	162.6	152.8	45.4	0	0	0	0	110.6
987	S	25.9	Very low	29.3	Very low	101 Å²	101	134 Å²	134	71%	0.706	76%	0.761	S	S	*	*			cis	-170.9	141.9	-31.1	59.6	0	0	0	0	109.5
988	V	26.2	Very low	29.6	Very low	136 Å²	136	133.3 Å²	133.3	82%	0.824	76%	0.762	S	S	*	*			trans	56.8	111.2	150.9	-178.4	0	0	0	0	119.6
989	S	24.3	Very low	30	Very low	115 Å²	115	130.5 Å²	130.5	80%	0.804	76%	0.759	S	S	*	*				174.9	129.4	107.6	45.8	0	0	0	0	114.8
990	Q	29.5	Very low	30.4	Very low	185 Å²	185	127 Å²	127	86%	0.864	76%	0.756	S	S	*	*			trans	-76	169.6	156.7	-93.9	-172.7	3	0	0	109.9
991	P	44.9	Very low	30.7	Very low	126 Å²	126	124.4 Å²	124.4	82%	0.818	75%	0.752	S	S	*	*			cis	-155.7	179.9	41.3	42.9	-20.7	0	0	0	120.2
992	G	25.8	Very low	30.8	Very low	69 Å²	69	129 Å²	129	71%	0.711	76%	0.764	S	S	*	*			trans	114	108.4	157.6	0	0	0	0	0	114.7
993	A	30	Very low	31.1	Very low	103 Å²	103	128.7 Å²	128.7	85%	0.851	77%	0.767	S	S	*	*				73.6	138.4	65.1	0	0	0	0	0	113.6
994	S	34.2	Very low	32.3	Very low	89 Å²	89	125.8 Å²	125.8	62%	0.622	77%	0.765	S	S	*	*			cis	-177.2	-175.6	-4.7	49.6	0	0	0	0	110.5
995	H	30	Very low	32.5	Very low	163 Å²	163	122.2 Å²	122.2	76%	0.755	76%	0.757	S	S	*	*			trans	111	140.4	160.6	-61.9	-56.9	0	0	0	117.3
996	L	28.4	Very low	31.3	Very low	138 Å²	138	124.9 Å²	124.9	72%	0.723	77%	0.765	S	S	*	*			cis	-161	134	-0.5	-113.1	161.8	0	0	0	113.5
997	S	31.6	Very low	31.5	Very low	105 Å²	105	125 Å²	125	73%	0.734	76%	0.76	S	S	*	*			trans	49.2	159.1	134.2	73.1	0	0	0	0	123.3
998	A	31.9	Very low	31.6	Very low	95 Å²	95	125.1 Å²	125.1	79%	0.785	76%	0.761	S	S	*	*			cis	-169.7	-178.8	12.7	0	0	0	0	0	109.5
999	A	34.2	Very low	31.8	Very low	83 Å²	83	123.3 Å²	123.3	69%	0.686	76%	0.761	S	S	*	*			cis	-179.6	-166.6	-26.2	0	0	0	0	0	109.7
1000	L	31.5	Very low	32.1	Very low	147 Å²	147	122.3 Å²	122.3	77%	0.77	76%	0.759	S	S	*	*			trans	84.2	135.3	167.4	-51.2	172.3	0	0	0	117.7
1001	H	29.5	Very low	32	Very low	134 Å²	134	119.8 Å²	119.8	62%	0.62	75%	0.752	S	S	*	*			cis	-163.1	139.5	-9.5	-127.1	11.4	0	0	0	115.6
1002	R	29.5	Very low	31.3	Very low	215 Å²	215	124.4 Å²	124.4	81%	0.811	75%	0.753	S	S	*	*			trans	70.9	140.7	142.5	-68.1	179.8	-167.4	-146	1	125.1
1003	T	31.3	Very low	31.6	Very low	131 Å²	131	125.6 Å²	125.6	80%	0.804	76%	0.756	S	S	*	*			trans	-109.1	176.4	173.2	57.4	0	0	0	0	111
1004	P	51	Low	31.6	Very low	126 Å²	126	125 Å²	125	82%	0.818	75%	0.751	S	S	*	*				-151.1	-176.5	81.6	36.6	-15.9	0	0	0	114.3
1005	A	31.3	Very low	31.4	Very low	82 Å²	82	128.8 Å²	128.8	68%	0.678	76%	0.759	S	S	*	*			cis	175.9	158.9	-30	0	0	0	0	0	108.7
1006	L	30.6	Very low	31.4	Very low	163 Å²	163	129 Å²	129	85%	0.853	76%	0.76	S	S	*	*			trans	78.4	158.8	171.6	-51.2	165.7	0	0	0	115.9
1007	T	29.3	Very low	31.5	Very low	118 Å²	118	126.7 Å²	126.7	72%	0.724	76%	0.756	S	S	*	*			cis	-152.9	156.5	4.6	-15.5	0	0	0	0	114.4
1008	S	29.9	Very low	31.5	Very low	104 Å²	104	130.6 Å²	130.6	73%	0.727	76%	0.762	S	S	*	*			trans	39.5	118.1	147.6	65.5	0	0	0	0	125.3
1009	A	29.6	Very low	31.5	Very low	99 Å²	99	129.9 Å²	129.9	82%	0.818	76%	0.756	S	S	*	*				41.5	136.9	122.6	0	0	0	0	0	125
1010	A	30.1	Very low	31.4	Very low	93 Å²	93	132.8 Å²	132.8	77%	0.769	77%	0.765	S	S	*	*			trans	97.3	138.5	141.7	0	0	0	0	0	122.3
1011	D	27.9	Very low	31.4	Very low	132 Å²	132	129.6 Å²	129.6	71%	0.706	76%	0.76	S	S	*	*			trans	70.7	117.3	153.7	-81.4	-46.3	0	0	0	125.2
1012	R	30.5	Very low	31.4	Very low	223 Å²	223	130 Å²	130	84%	0.842	77%	0.767	S	S	*	*				43.9	114.3	128.3	-74.7	176	164.4	151.8	-5.7	123.1
1013	A	30.6	Very low	31.4	Very low	94 Å²	94	130.8 Å²	130.8	78%	0.777	77%	0.771	S	S	*	*				76.6	136.1	115.7	0	0	0	0	0	122.8
1014	A	30.3	Very low	31.4	Very low	91 Å²	91	133.7 Å²	133.7	75%	0.752	77%	0.773	S	S	*	*			trans	65.3	152.5	159.1	0	0	0	0	0	116.8
1015	E	30	Very low	31.7	Very low	168 Å²	168	132.5 Å²	132.5	79%	0.785	77%	0.765	S	S	*	*			cis	-156.7	-178.9	-9.9	-124	169.6	168.8	0	0	109.4
1016	Q	31.6	Very low	31.6	Very low	168 Å²	168	139.9 Å²	139.9	79%	0.785	78%	0.776	S	S	*	*			trans	-15.8	157.7	156.8	-68.6	168.2	10.3	0	0	118.4
1017	S	30.2	Very low	31.9	Very low	89 Å²	89	140.7 Å²	140.7	62%	0.622	78%	0.775	S	S	*	*			cis	-179.6	165.1	10.8	39.6	0	0	0	0	110.9
1018	E	31.3	Very low	33	Very low	188 Å²	188	140.2 Å²	140.2	88%	0.879	77%	0.774	S	S	*	*			trans	61.8	160	151.1	-73.9	176.5	178.7	0	0	119.5
1019	A	32.2	Very low	33.2	Very low	79 Å²	79	140.6 Å²	140.6	65%	0.653	77%	0.772	S	S	*	*			cis	-168.6	153.2	-22.7	0	0	0	0	0	111.9
1020	V	31.5	Very low	33.4	Very low	145 Å²	145	143.6 Å²	143.6	88%	0.879	77%	0.769	S	S	*	*			trans	72.1	139.1	140.1	165.1	0	0	0	0	123.5
1021	A	30.6	Very low	33.7	Very low	80 Å²	80	145.4 Å²	145.4	66%	0.661	77%	0.766	S	S	*	*			trans	106.8	98.5	148.6	0	0	0	0	0	122.4
1022	N	31.4	Very low	34	Very low	143 Å²	143	148.8 Å²	148.8	77%	0.765	78%	0.777	S	S	*	*				33.8	128.2	122.4	-56.8	-12.9	0	0	0	121.8
1023	Y	28.6	Very low	34.1	Very low	230 Å²	230	149 Å²	149	90%	0.902	78%	0.778	S	S	*	*				-178.7	142.7	97.1	-112.1	-91.1	0	0	0	113.6
1024	F	32.1	Very low	34.4	Very low	193 Å²	193	149.9 Å²	149.9	85%	0.846	78%	0.779	S	S	*	*			trans	-87.8	-176.4	165.1	-103.7	-82.8	0	0	0	109.8
1025	P	56.8	Low	34.6	Very low	100 Å²	100	149.2 Å²	149.2	65%	0.649	77%	0.773	S	S	*	*			cis	-141.6	-169.9	-9.2	28.5	-2.8	0	0	0	116.6
1026	R	29.7	Very low	34.6	Very low	237 Å²	237	151.5 Å²	151.5	89%	0.894	78%	0.776	S	S	*	*			trans	98.2	127	149.2	-67.5	-174.4	177.6	179.9	-1.4	120.8
1027	Q	36.3	Very low	34.6	Very low	180 Å²	180	150 Å²	150	84%	0.841	77%	0.773	S	S	*	*			trans	-77	174.8	159.1	-52.3	174.4	-40.1	0	0	110.7
1028	P	51.3	Low	34.9	Very low	108 Å²	108	156.3 Å²	156.3	70%	0.701	78%	0.783	S	S	*	*				-154.1	163	86.3	40.2	-20.7	0	0	0	118.9
1029	T	34.8	Very low	34.9	Very low	113 Å²	113	154.4 Å²	154.4	69%	0.693	79%	0.785	S	S	*	*			trans	71.3	124.7	139.4	48.4	0	0	0	0	125.8
1030	Q	34.6	Very low	35	Very low	162 Å²	162	157.9 Å²	157.9	76%	0.757	79%	0.792	S	S	*	*				95.9	113.8	124.3	-79.5	-170.8	-47.7	0	0	124.5
1031	D	34.9	Very low	36.2	Very low	130 Å²	130	156.1 Å²	156.1	70%	0.695	78%	0.784	S	S	*	*				47.7	125.3	123.2	-64.2	-34	0	0	0	122.4
1032	H	34.5	Very low	36.3	Very low	204 Å²	204	159.6 Å²	159.6	94%	0.944	79%	0.787	S	S	*	*				-150.1	164.6	124.5	-106.5	-64.8	0	0	0	112.3
1033	R	33.8	Very low	36.5	Very low	227 Å²	227	158.4 Å²	158.4	86%	0.857	78%	0.78	S	S	*	*			trans	-122.3	151.1	-150.5	-124.5	-178.6	-175.6	-179.1	1.5	113
1034	S	35.1	Very low	36.8	Very low	113 Å²	113	155 Å²	155	79%	0.79	77%	0.772	S	S	*	*			trans	67.2	150.4	142.2	72.7	0	0	0	0	118.8
1035	A	34.5	Very low	37	Very low	76 Å²	76	157 Å²	157	63%	0.628	77%	0.774	S	S	*	*			cis	-179.2	152.2	17.1	0	0	0	0	0	111.5
1036	Y	31.8	Very low	36.2	Very low	217 Å²	217	156.5 Å²	156.5	85%	0.851	78%	0.779	S	S	*	*			trans	60.4	153.8	151.4	-77	-105.7	0	0	0	119.1
1037	N	29.7	Very low	37.8	Very low	137 Å²	137	150.7 Å²	150.7	73%	0.733	77%	0.771	S	S	*	*			cis	-151.4	173.8	17.1	-149.7	-15.4	0	0	0	113.5
1038	R	37.5	Very low	38.1	Very low	221 Å²	221	152.4 Å²	152.4	83%	0.834	80%	0.795	S	S	*	*			trans	-81.9	158.2	-174.9	-60.7	168	167.5	169.5	-5.9	115.4
1039	T	31.4	Very low	37.4	Very low	148 Å²	148	154.7 Å²	154.7	91%	0.908	80%	0.799	S	S	*	*				-164.8	148.3	124.1	18.6	0	0	0	0	113.6
1040	N	34.9	Very low	37.5	Very low	151 Å²	151	156.8 Å²	156.8	81%	0.807	81%	0.805	S	S	*	*			trans	-122.3	177.3	168.1	-143.5	11.2	0	0	0	106
1041	P	55.8	Low	37.7	Very low	109 Å²	109	156.6 Å²	156.6	71%	0.708	81%	0.808	S	S	*	*			cis	-153.4	-171.6	34.3	38.2	-12.1	0	0	0	119.2
1042	Q	31.9	Very low	37.9	Very low	153 Å²	153	158.1 Å²	158.1	72%	0.715	81%	0.814	S	S	*	*			trans	106.4	100.3	149.9	-61.2	-126.7	-93.6	0	0	121.9
1043	D	37	Very low	38.1	Very low	118 Å²	118	155.3 Å²	155.3	63%	0.631	81%	0.806	S	S	*	*				43.6	122.7	118.3	-56.5	-51.5	0	0	0	122.9
1044	H	34.4	Very low	38.3	Very low	159 Å²	159	150.5 Å²	150.5	74%	0.736	80%	0.803	S	S	*	*				-179.2	130.6	93.2	-94.9	-46.1	0	0	0	116
1045	R	37.1	Very low	38.6	Very low	234 Å²	234	153.1 Å²	153.1	88%	0.883	80%	0.804	S	S	*	*			trans	48.5	134.2	141.7	-66.8	-177.9	177	176.7	-0.1	123.2
1046	A	39.9	Very low	38.9	Very low	90 Å²	90	159.1 Å²	159.1	74%	0.744	82%	0.817	S	S	*	*			trans	-84.3	-163	164.5	0	0	0	0	0	111.3
1047	P	61.9	Low	39.5	Very low	114 Å²	114	154.3 Å²	154.3	74%	0.74	81%	0.814	S	S	*	*			cis	-135.9	171.8	-9.7	40.2	-23.1	0	0	0	115.7
1048	T	42.3	Very low	40.4	Very low	217 Å²	217	155.8 Å²	155.8	100%	1.331	82%	0.822	S	S	*	*				-155.1	0	129.7	17.6	0	0	0	0	108.5

Retrieved 1,048 of 1,048 residues in 686.5 ms (Link to these results)

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