A0A093I0Z1_STRCA Loading...

Prickle-like 1

AlphaFold DB , UniProt , Accession A0A093I0Z1, Species STRCA (Struthio camelus australis), Gene n/a, Length 831 aa.

						>A0A093I0Z1_STRCA|A0A093I0Z1
MPLEMEPKANSLAFGCQRSSTSDDDSGCALEEYAWVPPGLRPEQVQLYFACLPEEKVPYVNSPGEKHRIKQLLYQLPPHDNEVRYCQSLSEEEKKELQMFSSQRKKEALGRGTIKLLSRAVMHAVCEQCGTKVNGGEVAVFASRAGPGVCWHPSCFVCFTCNELLVDLIYFYQDGKIHCGRHHAELLKPRCSACDEIIFADECTEAEGRHWHMKHFCCLECETILGGQRYIMKDGRPFCCNCFESLYAEYCETCGEHIGVDHAQMTYDGQHWHATETCFSCAQCKTSLLGCPFLPKQGQIYCSKTCSLGEDVHASDSSDSAFQSARSRDSRRSVRMGKSSRSADQCRQSLLLSPALNYKFPGLSSNADDTLSRKLDDLSLSRQGAGFVNEDFWKGRVEQDMPEDPEEWAEHEDYMTQLLLKFGDKSLFQQPAEVDIRSSEHWISDSMVKSKLDLKKNNPSLASKKYQSDMYWAQSQDGLGDSAYGSHPGPASSRKIQELDMEHGAAGYKHDQTPWYEGSLECLSDLKQQEQSVRDSMDSLALSNITGASMDGEGKPRPSLYSLQTFQELEVEDCEKMSNMGTLNSSMLHRSTESLKSLSSELCQEKVLPEEKPVHMPVLRRSKSQSRPQQVKFSDDVIDNGSYENVEIRQPPMSERTRRRVYHFEERGSRPHHHRRRSRKSRSDNALNLAAERRCSPKERFRFYSPQDHEKFIQNKSSREIQAYIQNAELYGQYAHTTSDYALRNQVVDKFFGLYGDEDDSWCSTSSSSSDSEEEGYFLGQPIPQPRSLRYPYYTDDLSGTTTALSSSQFGQRTTKSKKKRGHKGKNCIIS
					

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(Predicted Aligned Error values between residue pairs)

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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	45.6	Very low	35.1	Very low	207 Å²	207	149.9 Å²	149.9	100%	1.02	82%	0.818	S	S	*	*				0	139.4	0	-69.7	-51.9	-165	0	0	108.6	L3	M1-L3 HydrophobicContact CE-CD1 4.24Å; M1-L3 HydrophobicContact SD-CD1 3.6Å; M1-L3 HydrophobicContact SD-CG 4.01Å
2	P	46.3	Very low	35	Very low	119 Å²	119	151 Å²	151	77%	0.773	82%	0.821	S	S	*	*			cis	-86.3	174.1	-13.6	41	-35.9	0	0	0	110
3	L	34.8	Very low	34.7	Very low	120 Å²	120	146.9 Å²	146.9	63%	0.628	82%	0.82	S	S	*	*			cis	75.5	134.8	25.7	-58.5	177.9	0	0	0	115	M1	M1-L3 HydrophobicContact CE-CD1 4.24Å; M1-L3 HydrophobicContact SD-CD1 3.6Å; M1-L3 HydrophobicContact SD-CG 4.01Å
4	E	32.8	Very low	34.8	Very low	158 Å²	158	151.9 Å²	151.9	74%	0.738	83%	0.829	S	S	*	*			cis	-165.7	173.9	-24.5	-149.7	176.7	-126.5	0	0	110.6
5	M	30.6	Very low	34.6	Very low	168 Å²	168	146.9 Å²	146.9	83%	0.828	83%	0.827	S	S	*	*			trans	79.6	152.4	160.1	-66.2	-173.9	68.2	0	0	121.6
6	E	35.5	Very low	34.5	Very low	174 Å²	174	145.1 Å²	145.1	81%	0.813	83%	0.825	S	S	*	*			trans	-107.1	163.1	-167.8	-64.6	-168.8	130.5	0	0	115.3
7	P	35.2	Very low	34.7	Very low	125 Å²	125	147.4 Å²	147.4	81%	0.812	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-78.2	144.3	162.4	33.8	-34.2	0	0	0	112.7
8	K	31	Very low	35	Very low	196 Å²	196	151.7 Å²	151.7	85%	0.852	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-89.2	160.2	-179.6	-71.3	177.4	178	174.9	0	113.3
9	A	32.3	Very low	35.3	Very low	103 Å²	103	149.1 Å²	149.1	85%	0.851	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-57.9	146.8	169.7	0	0	0	0	0	112.8
10	N	30.2	Very low	35.3	Very low	165 Å²	165	146.4 Å²	146.4	88%	0.882	81%	0.814	S	S	*	*			trans	-108.8	146	173.7	-105.6	-14.5	0	0	0	111.4
11	S	31.8	Very low	36	Very low	114 Å²	114	145.9 Å²	145.9	80%	0.797	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-75.4	142	-176.9	-174.6	0	0	0	0	112.7
12	L	34.2	Very low	35.8	Very low	163 Å²	163	140 Å²	140	85%	0.853	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-95.3	132.7	157.9	-76.3	174.2	0	0	0	109.2
13	A	31	Very low	36	Very low	98 Å²	98	142.2 Å²	142.2	81%	0.81	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-82.2	130.8	-170	0	0	0	0	0	113
14	F	35.8	Very low	36.9	Very low	217 Å²	217	143.7 Å²	143.7	95%	0.952	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-73.5	137.8	161	-81.4	-101.9	0	0	0	109.8
15	G	31.6	Very low	37.5	Very low	77 Å²	77	143.2 Å²	143.2	79%	0.794	81%	0.81	S	S	*	*			trans	-142.7	11.2	-160.8	0	0	0	0	0	118.6
16	C	32.4	Very low	38.7	Very low	117 Å²	117	140.1 Å²	140.1	79%	0.791	81%	0.806	S	S	*	*			trans	-155.5	89.9	165.4	-157.2	0	0	0	0	112.6
17	Q	39.1	Very low	39.5	Very low	184 Å²	184	133.5 Å²	133.5	86%	0.86	78%	0.784	S	S	*	*			trans	-89.4	109.3	163.6	-77.8	-175.6	-39.7	0	0	109.4	S19	Q17-S19 PolarHBondContact O-N 2.66Å
18	R	40.5	Very low	40.8	Very low	226 Å²	226	130.9 Å²	130.9	85%	0.853	77%	0.768	S	S	*	*			trans	-80.4	93.6	160	-81	-172.8	167.2	-134.3	-0.5	108.6	S20	R18-S20 PolarHBondContact O-N 2.89Å
19	S	39.1	Very low	42.3	Very low	102 Å²	102	122.4 Å²	122.4	71%	0.713	73%	0.734	S	S	*	*			trans	-77.5	65.1	177.2	-57.3	0	0	0	0	112	Q17	Q17-S19 PolarHBondContact O-N 2.66Å
20	S	36.6	Very low	43.7	Very low	94 Å²	94	123.2 Å²	123.2	66%	0.657	72%	0.724	S	S	*	*			trans	-93.4	95	170.4	-66.3	0	0	0	0	109.7	R18 S22	R18-S20 PolarHBondContact O-N 2.89Å; S20-S22 PolarHBondContact O-N 2.94Å
21	T	49	Very low	45.9	Very low	137 Å²	137	122.3 Å²	122.3	84%	0.84	71%	0.714	S	S	*	*			trans	-84	85.4	174.1	53.9	0	0	0	0	110.3
22	S	42.8	Very low	48.3	Very low	83 Å²	83	121.5 Å²	121.5	58%	0.58	70%	0.698	S	S	*	*			trans	-148.4	93.1	172.7	51.8	0	0	0	0	108.7	S20 D24	S20-S22 PolarHBondContact O-N 2.94Å; S22-D24 PolarHBondContact O-N 3.14Å
23	D	49.4	Very low	50.9	Low	166 Å²	166	114.2 Å²	114.2	89%	0.888	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	46.1	-172.5	-60.7	-62.3	0	0	0	113.6
24	D	53.2	Low	53.7	Low	151 Å²	151	111.1 Å²	111.1	81%	0.807	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.2	16.4	179.2	-93.3	-48.6	0	0	0	112.5	S22 S26	S22-D24 PolarHBondContact O-N 3.14Å; D24-S26 PolarHBondContact O-N 3.25Å
25	D	47.2	Very low	56.3	Low	147 Å²	147	101.9 Å²	101.9	79%	0.786	59%	0.592	S	S	*	*			trans	-75.8	66.8	175	-164.1	-1.4	0	0	0	111.5	G27	D25-G27 PolarHBondContact O-N 3.17Å; D25-G27 VanDerWaalsContact O-N 3.11Å; D25-G27 PolarHBondContact OD1-N 3.06Å
26	S	54	Low	59.1	Low	104 Å²	104	99.7 Å²	99.7	73%	0.727	56%	0.563	S	S	*	*			trans	-81.1	47.3	168.3	-63.3	0	0	0	0	110.8	D24 C28	D24-S26 PolarHBondContact O-N 3.25Å; S26-C28 PolarHBondContact O-N 3.36Å; S26-C28 VanDerWaalsContact O-N 3.09Å
27	G	53.8	Low	61.8	Low	34 Å²	34	94.2 Å²	94.2	35%	0.351	53%	0.526	S	S	.	.			trans	-51.2	115.3	-178.2	0	0	0	0	0	111.4	D25 A29	D25-G27 PolarHBondContact O-N 3.17Å; D25-G27 VanDerWaalsContact O-N 3.11Å; D25-G27 PolarHBondContact OD1-N 3.06Å; G27-A29 PolarHBondContact O-N 3.14Å
28	C	62	Low	64	Low	71 Å²	71	88.6 Å²	88.6	48%	0.48	51%	0.506	S	S	.	.			trans	-72.2	117.7	-178.4	-68.9	0	0	0	0	108.1	S26 L30 E31	S26-C28 PolarHBondContact O-N 3.36Å; S26-C28 VanDerWaalsContact O-N 3.09Å; C28-L30 PolarHBondContact O-N 2.94Å; C28-E31 HydrophobicContact CB-CG 4.14Å; C28-E31 WeakPolarHBondContact CB-OE1 3.41Å; C28-E31 VanDerWaalsContact O-CB 3.31Å; C28-E31 WeakPolarHBondContact O-CB 3.29Å; C28-E31 PolarHBondContact O-N 3.48Å
29	A	62.5	Low	66	Low	18 Å²	18	81.9 Å²	81.9	15%	0.149	51%	0.507	C	S	.	.	H	α-helix	trans	-55.9	-22.4	178.6	0	0	0	0	0	113	G27 E31 E32 Y33 V36 P42 V45	G27-A29 PolarHBondContact O-N 3.14Å; A29-E31 PolarHBondContact O-N 3.22Å; A29-E32 PolarHBondContact O-N 3.21Å; A29-Y33 VanDerWaalsContact O-CD2 3.3Å; A29-Y33 WeakPolarHBondContact O-CD2 3.43Å; A29-Y33 PolarHBondContact O-N 3.46Å; A29-Y33 VanDerWaalsContact O-N 3.11Å; A29-V36 HydrophobicContact CB-CG1 4.19Å; A29-P42 HydrophobicContact CB-CB 4.45Å; A29-V45 HydrophobicContact CB-CG1 4.38Å; A29-V45 HydrophobicContact CB-CG2 4.45Å
30	L	62.4	Low	68.3	Low	119 Å²	119	78.4 Å²	78.4	62%	0.623	48%	0.48	S	S	*	.	H	α-helix	trans	-66.3	-11	172.2	-66.9	170.9	0	0	0	114.8	C28 V36	C28-L30 PolarHBondContact O-N 2.94Å; L30-V36 HydrophobicContact CD2-CG1 4.36Å; L30-V36 HydrophobicContact CD2-CG2 3.79Å; L30-V36 HydrophobicContact CG-CG2 4.39Å
31	E	74.6	Confident	70.7	Confident	146 Å²	146	80.3 Å²	80.3	68%	0.682	47%	0.473	S	S	*	.	H	α-helix	trans	-81.4	-30.9	172.5	-65.7	170.8	-146.7	0	0	111.8	C28 A29	C28-E31 HydrophobicContact CB-CG 4.14Å; C28-E31 WeakPolarHBondContact CB-OE1 3.41Å; C28-E31 VanDerWaalsContact O-CB 3.31Å; C28-E31 WeakPolarHBondContact O-CB 3.29Å; C28-E31 PolarHBondContact O-N 3.48Å; A29-E31 PolarHBondContact O-N 3.22Å
32	E	83.6	Confident	72.4	Confident	97 Å²	97	77 Å²	77	45%	0.453	45%	0.454	S	S	.	.	H	α-helix	trans	-87.4	-40.2	177.3	-63.7	-170.7	152.3	0	0	112.6	A29 Y59 V60	A29-E32 PolarHBondContact O-N 3.21Å; E32-Y59 WeakPolarHBondContact O-CA 3.35Å; E32-V60 PolarHBondContact O-N 3.35Å
33	Y	88.8	Confident	74.4	Confident	11 Å²	11	77.3 Å²	77.3	4%	0.043	45%	0.446	C	S	.	.	B	Isolated β-bridge	trans	-115.1	130.5	-172.4	-51.7	-87.9	0	0	0	112.2	A29 W35 V36 V45 F49 V57 P58 Y59	A29-Y33 VanDerWaalsContact O-CD2 3.3Å; A29-Y33 WeakPolarHBondContact O-CD2 3.43Å; A29-Y33 PolarHBondContact O-N 3.46Å; A29-Y33 VanDerWaalsContact O-N 3.11Å; Y33-W35 WeakPolarHBondContact CB-O 3.43Å; Y33-W35 PolarHBondContact O-N 3.16Å; Y33-W35 VanDerWaalsContact O-N 3.08Å; Y33-V36 HydrophobicContact CD2-CG1 4.12Å; Y33-V36 HydrophobicContact CG-CG1 4.27Å; Y33-V45 HydrophobicContact CD2-CG1 4.1Å; Y33-V45 HydrophobicContact CE2-CG1 4.15Å; Y33-F49 AromaticContact CD1-CD2 3.58Å; Y33-F49 HydrophobicContact CD1-CD2 3.58Å; Y33-F49 AromaticContact CD1-CE2 3.46Å; Y33-F49 HydrophobicContact CD1-CE2 3.46Å; Y33-F49 VanDerWaalsContact CD1-CE2 3.46Å; Y33-F49 HydrophobicContact CD1-CG 4.37Å; Y33-F49 HydrophobicContact CD1-CZ 4.19Å; Y33-F49 HydrophobicContact CD2-CD2 4.38Å; Y33-F49 HydrophobicContact CD2-CE2 4.14Å; Y33-F49 HydrophobicContact CE1-CB 4.42Å; Y33-F49 AromaticContact CE1-CD2 3.4Å; Y33-F49 HydrophobicContact CE1-CD2 3.4Å; Y33-F49 AromaticContact CE1-CE2 3.82Å; Y33-F49 HydrophobicContact CE1-CE2 3.82Å; Y33-F49 HydrophobicContact CE1-CG 4.06Å; Y33-F49 HydrophobicContact CE2-CD2 4.3Å; Y33-F49 HydrophobicContact CG-CD2 4.11Å; Y33-F49 AromaticContact CG-CE2 3.67Å; Y33-F49 HydrophobicContact CG-CE2 3.67Å; Y33-F49 AromaticContact CZ-CD2 3.85Å; Y33-V57 HydrophobicContact CD1-CG1 3.93Å; Y33-V57 HydrophobicContact CE1-CG1 3.63Å; Y33-P58 CarbonylContact C-O 3.58Å; Y33-P58 WeakPolarHBondContact CA-O 3.33Å; Y33-Y59 AromaticContact CD1-CD1 3.85Å; Y33-Y59 HydrophobicContact CD1-CD1 3.85Å; Y33-Y59 AromaticContact CD1-CE1 3.97Å; Y33-Y59 HydrophobicContact CD1-CE1 3.97Å; Y33-Y59 HydrophobicContact CD1-CG 4.47Å; Y33-Y59 AromaticContact CE1-CD1 3.56Å; Y33-Y59 HydrophobicContact CE1-CD1 3.56Å; Y33-Y59 AromaticContact CE1-CE1 3.18Å; Y33-Y59 HydrophobicContact CE1-CE1 3.18Å; Y33-Y59 HydrophobicContact CE1-CG 4.39Å; Y33-Y59 AromaticContact CE1-CZ 3.75Å; Y33-Y59 AromaticContact CZ-CE1 3.57Å; Y33-Y59 WeakPolarHBondContact OH-CE1 3.26Å
34	A	88.6	Confident	76.3	Confident	33 Å²	33	71 Å²	71	27%	0.273	41%	0.412	S	S	.	.	S	Bend	trans	-65.6	-9	174.3	0	0	0	0	0	113.8	P58 V60 E65	A34-P58 PolarHBondContact N-O 2.87Å; A34-V60 HydrophobicContact CB-CG2 4.25Å; A34-E65 HydrophobicContact CB-CB 4.25Å; A34-E65 VanDerWaalsContact CB-CD 3.43Å; A34-E65 HydrophobicContact CB-CG 3.74Å; A34-E65 WeakPolarHBondContact CB-OE1 3.43Å
35	W	91.2	Very high	78.1	Confident	23 Å²	23	63.9 Å²	63.9	9%	0.087	37%	0.373	C	S	.	.			trans	-160.4	142.5	168.5	175.2	95	0	0	0	109.8	Y33 P37 Y48 F49 R68 D167 L168 Y414	Y33-W35 WeakPolarHBondContact CB-O 3.43Å; Y33-W35 PolarHBondContact O-N 3.16Å; Y33-W35 VanDerWaalsContact O-N 3.08Å; W35-P37 HydrophobicContact CH2-CB 3.9Å; W35-P37 HydrophobicContact CH2-CG 3.63Å; W35-P37 HydrophobicContact CZ2-CB 4.45Å; W35-P37 HydrophobicContact CZ3-CB 4.41Å; W35-P37 HydrophobicContact CZ3-CG 3.68Å; W35-Y48 HydrophobicContact CZ3-CE1 4.32Å; W35-F49 HydrophobicContact CE3-CZ 4.18Å; W35-F49 HydrophobicContact CZ3-CZ 4.32Å; W35-F49 WeakPolarHBondContact O-CZ 3.43Å; W35-R68 VanDerWaalsContact CB-NE 3.31Å; W35-D167 VanDerWaalsContact CZ2-CA 3.41Å; W35-D167 HydrophobicContact CZ2-CB 3.8Å; W35-D167 VanDerWaalsContact NE1-CG 3.27Å; W35-D167 PolarHBondContact NE1-OD2 3.22Å; W35-L168 HydrophobicContact CH2-CD1 4.31Å; W35-L168 HydrophobicContact CH2-CG 4.14Å; W35-Y414 PolarHBondContact NE1-OH 2.77Å
36	V	90.9	Very high	80.1	Confident	30 Å²	30	62.1 Å²	62.1	18%	0.182	36%	0.36	C	S	.	.			trans	-127.4	151.9	168.7	-55.5	0	0	0	0	109.3	A29 L30 Y33 V45 F49	A29-V36 HydrophobicContact CB-CG1 4.19Å; L30-V36 HydrophobicContact CD2-CG1 4.36Å; L30-V36 HydrophobicContact CD2-CG2 3.79Å; L30-V36 HydrophobicContact CG-CG2 4.39Å; Y33-V36 HydrophobicContact CD2-CG1 4.12Å; Y33-V36 HydrophobicContact CG-CG1 4.27Å; V36-V45 HydrophobicContact CB-CG1 4.06Å; V36-V45 HydrophobicContact CB-CG2 4.17Å; V36-V45 HydrophobicContact CG1-CG1 3.72Å; V36-V45 HydrophobicContact CG1-CG2 4.45Å; V36-F49 HydrophobicContact CG1-CE2 4.45Å
37	P	88.8	Confident	81.8	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.013	35%	0.349	C	S	.	.			trans	-61.7	143.6	171.4	-17.5	28.7	0	0	0	111.9	W35 L40 Y48 I114 L168	W35-P37 HydrophobicContact CH2-CB 3.9Å; W35-P37 HydrophobicContact CH2-CG 3.63Å; W35-P37 HydrophobicContact CZ2-CB 4.45Å; W35-P37 HydrophobicContact CZ3-CB 4.41Å; W35-P37 HydrophobicContact CZ3-CG 3.68Å; P37-L40 HydrophobicContact CB-CD1 3.87Å; P37-L40 HydrophobicContact CB-CG 4.29Å; P37-L40 HydrophobicContact CG-CD1 3.9Å; P37-Y48 HydrophobicContact CG-CD1 3.65Å; P37-Y48 HydrophobicContact CG-CE1 3.66Å; P37-Y48 HydrophobicContact CG-CG 4.21Å; P37-I114 HydrophobicContact CB-CD1 3.54Å; P37-I114 HydrophobicContact CG-CD1 3.5Å; P37-I114 VanDerWaalsContact CG-CD1 3.5Å; P37-L168 HydrophobicContact CB-CD1 4.09Å
38	P	85.3	Confident	83.6	Confident	66 Å²	66	60.6 Å²	60.6	43%	0.429	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	154.8	178.1	32.5	-38.4	0	0	0	111.7	L40	P38-L40 PolarHBondContact O-N 2.96Å
39	G	82.4	Confident	85.1	Confident	86 Å²	86	57.6 Å²	57.6	89%	0.887	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	0	173.6	0	0	0	0	0	116.1
40	L	86.8	Confident	86.5	Confident	29 Å²	29	60.8 Å²	60.8	15%	0.152	34%	0.34	C	S	.	.			trans	-90.8	141.8	176.3	-64.9	-171	0	0	0	112.7	P37 P38 Q44 V45 I114	P37-L40 HydrophobicContact CB-CD1 3.87Å; P37-L40 HydrophobicContact CB-CG 4.29Å; P37-L40 HydrophobicContact CG-CD1 3.9Å; P38-L40 PolarHBondContact O-N 2.96Å; L40-Q44 HydrophobicContact CB-CB 4.21Å; L40-Q44 HydrophobicContact CD2-CB 4.1Å; L40-V45 HydrophobicContact CB-CG2 3.73Å; L40-V45 HydrophobicContact CD1-CG2 4.32Å; L40-I114 HydrophobicContact CD1-CB 4.31Å; L40-I114 HydrophobicContact CD1-CD1 3.91Å; L40-I114 HydrophobicContact CD1-CG2 4.18Å; L40-I114 HydrophobicContact CD2-CB 4.05Å; L40-I114 HydrophobicContact CD2-CG2 3.9Å
41	R	87	Confident	87.8	Confident	134 Å²	134	57.7 Å²	57.7	51%	0.506	33%	0.327	S	S	.	.			trans	-78.4	155.8	166.6	-52.7	-177	-52.4	109	15.2	110.1	E43 Q44 V45	R41-E43 VanDerWaalsContact C-N 3.28Å; R41-E43 VanDerWaalsContact CB-OE2 3.22Å; R41-E43 WeakPolarHBondContact CB-OE2 3.35Å; R41-E43 IonicContact CZ-OE1 3.42Å; R41-E43 IonicContact CZ-OE2 3.61Å; R41-E43 VanDerWaalsContact NH1-CD 3.34Å; R41-E43 IonicContact NH1-OE1 2.72Å; R41-E43 PolarHBondContact NH1-OE1 3.19Å; R41-E43 IonicContact NH1-OE2 3.13Å; R41-E43 PolarHBondContact NH1-OE2 3.39Å; R41-E43 IonicContact NH2-OE1 2.69Å; R41-E43 PolarHBondContact NH2-OE1 3.48Å; R41-E43 IonicContact NH2-OE2 3.66Å; R41-E43 PolarHBondContact NH2-OE2 3.11Å; R41-E43 PolarHBondContact O-N 3.39Å; R41-E43 VanDerWaalsContact O-N 3.12Å; R41-Q44 HydrophobicContact CB-CG 4.41Å; R41-Q44 WeakPolarHBondContact O-CA 3.45Å; R41-Q44 WeakPolarHBondContact O-CB 3.41Å; R41-Q44 PolarHBondContact O-N 3.06Å; R41-V45 PolarHBondContact O-N 2.87Å; R41-V45 VanDerWaalsContact O-N 3.11Å
42	P	85.6	Confident	88.7	Confident	67 Å²	67	51.9 Å²	51.9	44%	0.435	30%	0.301	S	S	.	.	H	α-helix	trans	-52.5	-38.8	-173.8	-29.4	36.5	0	0	0	115	A29 Q44 V45 Q46	A29-P42 HydrophobicContact CB-CB 4.45Å; P42-Q44 VanDerWaalsContact C-N 3.27Å; P42-Q44 PolarHBondContact O-N 3.21Å; P42-V45 WeakPolarHBondContact O-CB 3.38Å; P42-V45 PolarHBondContact O-N 3.3Å; P42-Q46 PolarHBondContact O-N 2.68Å
43	E	85.1	Confident	89.1	Confident	89 Å²	89	50.6 Å²	50.6	42%	0.416	30%	0.301	S	S	.	.	H	α-helix	trans	-70.7	-26.5	179.8	-29.3	94.1	111.5	0	0	111.9	R41 L47	R41-E43 VanDerWaalsContact C-N 3.28Å; R41-E43 VanDerWaalsContact CB-OE2 3.22Å; R41-E43 WeakPolarHBondContact CB-OE2 3.35Å; R41-E43 IonicContact CZ-OE1 3.42Å; R41-E43 IonicContact CZ-OE2 3.61Å; R41-E43 VanDerWaalsContact NH1-CD 3.34Å; R41-E43 IonicContact NH1-OE1 2.72Å; R41-E43 PolarHBondContact NH1-OE1 3.19Å; R41-E43 IonicContact NH1-OE2 3.13Å; R41-E43 PolarHBondContact NH1-OE2 3.39Å; R41-E43 IonicContact NH2-OE1 2.69Å; R41-E43 PolarHBondContact NH2-OE1 3.48Å; R41-E43 IonicContact NH2-OE2 3.66Å; R41-E43 PolarHBondContact NH2-OE2 3.11Å; R41-E43 PolarHBondContact O-N 3.39Å; R41-E43 VanDerWaalsContact O-N 3.12Å; E43-L47 WeakPolarHBondContact O-CG 3.38Å; E43-L47 PolarHBondContact O-N 3.28Å
44	Q	88.8	Confident	89.2	Confident	35 Å²	35	57.8 Å²	57.8	16%	0.164	34%	0.335	C	S	.	.	H	α-helix	trans	-79.7	-30	176.9	-59	171.5	-45.6	0	0	111.7	L40 R41 P42 L47 Y48 L116	L40-Q44 HydrophobicContact CB-CB 4.21Å; L40-Q44 HydrophobicContact CD2-CB 4.1Å; R41-Q44 HydrophobicContact CB-CG 4.41Å; R41-Q44 WeakPolarHBondContact O-CA 3.45Å; R41-Q44 WeakPolarHBondContact O-CB 3.41Å; R41-Q44 PolarHBondContact O-N 3.06Å; P42-Q44 VanDerWaalsContact C-N 3.27Å; P42-Q44 PolarHBondContact O-N 3.21Å; Q44-L47 PolarHBondContact O-N 3.48Å; Q44-Y48 PolarHBondContact O-N 3.2Å; Q44-L116 HydrophobicContact CB-CD1 4.27Å; Q44-L116 HydrophobicContact CG-CD1 3.92Å
45	V	89.9	Confident	89.3	Confident	1 Å²	1	64 Å²	64	1%	0.006	36%	0.359	C	S	.	.	H	α-helix	trans	-62.8	-44.9	171.8	176	0	0	0	0	110.5	A29 Y33 V36 L40 R41 P42 Y48 F49	A29-V45 HydrophobicContact CB-CG1 4.38Å; A29-V45 HydrophobicContact CB-CG2 4.45Å; Y33-V45 HydrophobicContact CD2-CG1 4.1Å; Y33-V45 HydrophobicContact CE2-CG1 4.15Å; V36-V45 HydrophobicContact CB-CG1 4.06Å; V36-V45 HydrophobicContact CB-CG2 4.17Å; V36-V45 HydrophobicContact CG1-CG1 3.72Å; V36-V45 HydrophobicContact CG1-CG2 4.45Å; L40-V45 HydrophobicContact CB-CG2 3.73Å; L40-V45 HydrophobicContact CD1-CG2 4.32Å; R41-V45 PolarHBondContact O-N 2.87Å; R41-V45 VanDerWaalsContact O-N 3.11Å; P42-V45 WeakPolarHBondContact O-CB 3.38Å; P42-V45 PolarHBondContact O-N 3.3Å; V45-Y48 PolarHBondContact O-N 2.93Å; V45-F49 HydrophobicContact CG1-CD2 3.65Å; V45-F49 HydrophobicContact CG1-CE2 3.5Å; V45-F49 WeakPolarHBondContact O-CD2 3.48Å; V45-F49 PolarHBondContact O-N 2.8Å
46	Q	89.1	Confident	89.4	Confident	109 Å²	109	65.4 Å²	65.4	51%	0.509	37%	0.365	S	S	.	.	H	α-helix	trans	-61.8	-44.3	175.4	-68.6	179.8	-10.9	0	0	112	P42 Y48 F49 A50	P42-Q46 PolarHBondContact O-N 2.68Å; Q46-Y48 VanDerWaalsContact C-N 3.32Å; Q46-Y48 PolarHBondContact O-N 3.06Å; Q46-F49 PolarHBondContact O-N 3.41Å; Q46-A50 WeakPolarHBondContact O-CB 3.26Å; Q46-A50 PolarHBondContact O-N 3Å
47	L	90.4	Very high	89.5	Confident	93 Å²	93	64.1 Å²	64.1	49%	0.487	36%	0.358	S	S	.	.	H	α-helix	trans	-61.7	-37.1	175.2	-71.8	171.2	0	0	0	113	E43 Q44 C51 V138	E43-L47 WeakPolarHBondContact O-CG 3.38Å; E43-L47 PolarHBondContact O-N 3.28Å; Q44-L47 PolarHBondContact O-N 3.48Å; L47-C51 PolarHBondContact O-SG 3.21Å; L47-V138 HydrophobicContact CB-CG1 4.24Å
48	Y	91.9	Very high	89.7	Confident	14 Å²	14	64.3 Å²	64.3	6%	0.055	36%	0.359	C	S	.	.	H	α-helix	trans	-66.5	-49.6	175.6	170.3	-102.8	0	0	0	112.3	W35 P37 Q44 V45 Q46 A50 C51 L52 I114 P153	W35-Y48 HydrophobicContact CZ3-CE1 4.32Å; P37-Y48 HydrophobicContact CG-CD1 3.65Å; P37-Y48 HydrophobicContact CG-CE1 3.66Å; P37-Y48 HydrophobicContact CG-CG 4.21Å; Q44-Y48 PolarHBondContact O-N 3.2Å; V45-Y48 PolarHBondContact O-N 2.93Å; Q46-Y48 VanDerWaalsContact C-N 3.32Å; Q46-Y48 PolarHBondContact O-N 3.06Å; Y48-A50 VanDerWaalsContact C-N 3.32Å; Y48-A50 PolarHBondContact O-N 3.17Å; Y48-C51 WeakPolarHBondContact O-CB 3.42Å; Y48-C51 PolarHBondContact O-N 2.84Å; Y48-C51 VanDerWaalsContact O-N 3.09Å; Y48-L52 HydrophobicContact CE1-CD1 3.95Å; Y48-I114 HydrophobicContact CD1-CD1 4.33Å; Y48-I114 HydrophobicContact CD2-CD1 3.28Å; Y48-I114 HydrophobicContact CD2-CG1 4.18Å; Y48-I114 HydrophobicContact CE1-CD1 4.42Å; Y48-I114 HydrophobicContact CE2-CD1 3.39Å; Y48-I114 HydrophobicContact CE2-CG1 4.24Å; Y48-I114 HydrophobicContact CG-CD1 3.77Å; Y48-P153 HydrophobicContact CD2-CB 3.81Å; Y48-P153 HydrophobicContact CD2-CG 3.78Å; Y48-P153 HydrophobicContact CE2-CB 3.62Å; Y48-P153 HydrophobicContact CE2-CG 4.03Å
49	F	93.3	Very high	90.1	Very high	7 Å²	7	65.5 Å²	65.5	3%	0.031	36%	0.355	C	S	.	.	H	α-helix	trans	-69.8	-28.4	-178.6	-72.1	-53.3	0	0	0	113.1	Y33 W35 V36 V45 Q46 C51 L52 V57 P58	Y33-F49 AromaticContact CD1-CD2 3.58Å; Y33-F49 HydrophobicContact CD1-CD2 3.58Å; Y33-F49 AromaticContact CD1-CE2 3.46Å; Y33-F49 HydrophobicContact CD1-CE2 3.46Å; Y33-F49 VanDerWaalsContact CD1-CE2 3.46Å; Y33-F49 HydrophobicContact CD1-CG 4.37Å; Y33-F49 HydrophobicContact CD1-CZ 4.19Å; Y33-F49 HydrophobicContact CD2-CD2 4.38Å; Y33-F49 HydrophobicContact CD2-CE2 4.14Å; Y33-F49 HydrophobicContact CE1-CB 4.42Å; Y33-F49 AromaticContact CE1-CD2 3.4Å; Y33-F49 HydrophobicContact CE1-CD2 3.4Å; Y33-F49 AromaticContact CE1-CE2 3.82Å; Y33-F49 HydrophobicContact CE1-CE2 3.82Å; Y33-F49 HydrophobicContact CE1-CG 4.06Å; Y33-F49 HydrophobicContact CE2-CD2 4.3Å; Y33-F49 HydrophobicContact CG-CD2 4.11Å; Y33-F49 AromaticContact CG-CE2 3.67Å; Y33-F49 HydrophobicContact CG-CE2 3.67Å; Y33-F49 AromaticContact CZ-CD2 3.85Å; W35-F49 HydrophobicContact CE3-CZ 4.18Å; W35-F49 HydrophobicContact CZ3-CZ 4.32Å; W35-F49 WeakPolarHBondContact O-CZ 3.43Å; V36-F49 HydrophobicContact CG1-CE2 4.45Å; V45-F49 HydrophobicContact CG1-CD2 3.65Å; V45-F49 HydrophobicContact CG1-CE2 3.5Å; V45-F49 WeakPolarHBondContact O-CD2 3.48Å; V45-F49 PolarHBondContact O-N 2.8Å; Q46-F49 PolarHBondContact O-N 3.41Å; F49-C51 PolarHBondContact O-N 2.98Å; F49-L52 HydrophobicContact CD1-CD1 4.12Å; F49-L52 PolarHBondContact O-N 2.79Å; F49-V57 HydrophobicContact CB-CG1 3.9Å; F49-V57 HydrophobicContact CB-CG2 4.15Å; F49-V57 HydrophobicContact CD1-CB 4.5Å; F49-V57 HydrophobicContact CD1-CG1 3.87Å; F49-V57 HydrophobicContact CD1-CG2 4.29Å; F49-V57 HydrophobicContact CD2-CG1 4.38Å; F49-V57 HydrophobicContact CG-CG1 3.81Å; F49-P58 HydrophobicContact CE1-CG 3.88Å; F49-P58 HydrophobicContact CZ-CG 3.82Å
50	A	91.4	Very high	90.5	Very high	86 Å²	86	64.6 Å²	64.6	71%	0.711	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-16	170.4	0	0	0	0	0	114	Q46 Y48	Q46-A50 WeakPolarHBondContact O-CB 3.26Å; Q46-A50 PolarHBondContact O-N 3Å; Y48-A50 VanDerWaalsContact C-N 3.32Å; Y48-A50 PolarHBondContact O-N 3.17Å
51	C	90.9	Very high	90.6	Very high	53 Å²	53	69.6 Å²	69.6	36%	0.358	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-2	172.6	-63.9	0	0	0	0	113.9	L47 Y48 F49 P153 S154	L47-C51 PolarHBondContact O-SG 3.21Å; Y48-C51 WeakPolarHBondContact O-CB 3.42Å; Y48-C51 PolarHBondContact O-N 2.84Å; Y48-C51 VanDerWaalsContact O-N 3.09Å; F49-C51 PolarHBondContact O-N 2.98Å; C51-P153 HydrophobicContact CB-CB 3.74Å; C51-P153 HydrophobicContact CB-CG 3.76Å; C51-S154 WeakPolarHBondContact O-CB 3.5Å
52	L	92.4	Very high	90.9	Very high	24 Å²	24	64.1 Å²	64.1	13%	0.126	34%	0.341	C	S	.	.	S	Bend	trans	-111.5	157.4	-179.1	-58.8	-171.9	0	0	0	111.7	Y48 F49 E54 V57 P153 L164	Y48-L52 HydrophobicContact CE1-CD1 3.95Å; F49-L52 HydrophobicContact CD1-CD1 4.12Å; F49-L52 PolarHBondContact O-N 2.79Å; L52-E54 PolarHBondContact O-N 3.08Å; L52-V57 HydrophobicContact CB-CG2 4.34Å; L52-P153 HydrophobicContact CD2-CB 3.83Å; L52-L164 HydrophobicContact CD2-CD1 4.06Å; L52-L164 HydrophobicContact CD2-CD2 4.37Å
53	P	91.9	Very high	91.3	Very high	70 Å²	70	65.7 Å²	65.7	46%	0.455	35%	0.352	S	S	.	.			trans	-62.6	133.3	171.1	-19.4	32.4	0	0	0	111	E55 K56 V57	P53-E55 PolarHBondContact O-N 3.26Å; P53-E55 VanDerWaalsContact O-N 3.17Å; P53-K56 WeakPolarHBondContact O-CA 3.46Å; P53-K56 PolarHBondContact O-N 2.87Å; P53-V57 PolarHBondContact O-N 3.15Å
54	E	90.7	Very high	91.7	Very high	163 Å²	163	61.5 Å²	61.5	76%	0.762	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-52.2	-40.4	-177.5	-171.1	177.7	178.3	0	0	112.8	L52 K56 V57	L52-E54 PolarHBondContact O-N 3.08Å; E54-K56 PolarHBondContact O-N 2.85Å; E54-K56 VanDerWaalsContact O-N 3.07Å; E54-V57 PolarHBondContact O-N 3.27Å
55	E	92	Very high	91.9	Very high	163 Å²	163	62 Å²	62	76%	0.762	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-59.4	-18.6	175.6	-61.3	-178.8	-174.3	0	0	114.7	P53 G64	P53-E55 PolarHBondContact O-N 3.26Å; P53-E55 VanDerWaalsContact O-N 3.17Å; E55-G64 VanDerWaalsContact O-CA 3.26Å; E55-G64 WeakPolarHBondContact O-CA 3.45Å
56	K	92.3	Very high	92.1	Very high	53 Å²	53	68.5 Å²	68.5	23%	0.23	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-107.8	-1.7	179.3	-61.1	-168.4	176.4	-172.5	0	113.1	P53 E54 E163 L164	P53-K56 WeakPolarHBondContact O-CA 3.46Å; P53-K56 PolarHBondContact O-N 2.87Å; E54-K56 PolarHBondContact O-N 2.85Å; E54-K56 VanDerWaalsContact O-N 3.07Å; K56-E163 IonicContact NZ-OE1 3.22Å; K56-E163 PolarHBondContact NZ-OE1 3.24Å; K56-E163 IonicContact NZ-OE2 3.44Å; K56-E163 PolarHBondContact NZ-OE2 3.05Å; K56-L164 HydrophobicContact CD-CD1 3.96Å
57	V	93.8	Very high	92.4	Very high	3 Å²	3	65.9 Å²	65.9	2%	0.018	35%	0.35	C	S	.	.	S	Bend	trans	-78	123.7	176.5	178.7	0	0	0	0	109.8	Y33 F49 L52 P53 E54 Y59 G64	Y33-V57 HydrophobicContact CD1-CG1 3.93Å; Y33-V57 HydrophobicContact CE1-CG1 3.63Å; F49-V57 HydrophobicContact CB-CG1 3.9Å; F49-V57 HydrophobicContact CB-CG2 4.15Å; F49-V57 HydrophobicContact CD1-CB 4.5Å; F49-V57 HydrophobicContact CD1-CG1 3.87Å; F49-V57 HydrophobicContact CD1-CG2 4.29Å; F49-V57 HydrophobicContact CD2-CG1 4.38Å; F49-V57 HydrophobicContact CG-CG1 3.81Å; L52-V57 HydrophobicContact CB-CG2 4.34Å; P53-V57 PolarHBondContact O-N 3.15Å; E54-V57 PolarHBondContact O-N 3.27Å; V57-Y59 HydrophobicContact CB-CD2 4.01Å; V57-Y59 HydrophobicContact CB-CE2 3.7Å; V57-Y59 HydrophobicContact CG1-CD2 3.68Å; V57-Y59 HydrophobicContact CG1-CE1 4.24Å; V57-Y59 HydrophobicContact CG1-CE2 3.32Å; V57-Y59 HydrophobicContact CG1-CG 4.27Å; V57-Y59 PolarHBondContact O-N 3.3Å; V57-G64 WeakPolarHBondContact O-CA 3.34Å
58	P	93.3	Very high	92.5	Very high	5 Å²	5	62.5 Å²	62.5	3%	0.032	33%	0.331	C	S	.	.			trans	-83.3	55.6	-169.1	36.2	-37.8	0	0	0	113	Y33 A34 F49 R68	Y33-P58 CarbonylContact C-O 3.58Å; Y33-P58 WeakPolarHBondContact CA-O 3.33Å; A34-P58 PolarHBondContact N-O 2.87Å; F49-P58 HydrophobicContact CE1-CG 3.88Å; F49-P58 HydrophobicContact CZ-CG 3.82Å; P58-R68 HydrophobicContact CB-CB 4.28Å
59	Y	93.1	Very high	92.5	Very high	92 Å²	92	63.4 Å²	63.4	36%	0.361	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-58.5	144.7	169.4	-64.4	-73.1	0	0	0	110.8	E32 Y33 V57 N61 S62 E65	E32-Y59 WeakPolarHBondContact O-CA 3.35Å; Y33-Y59 AromaticContact CD1-CD1 3.85Å; Y33-Y59 HydrophobicContact CD1-CD1 3.85Å; Y33-Y59 AromaticContact CD1-CE1 3.97Å; Y33-Y59 HydrophobicContact CD1-CE1 3.97Å; Y33-Y59 HydrophobicContact CD1-CG 4.47Å; Y33-Y59 AromaticContact CE1-CD1 3.56Å; Y33-Y59 HydrophobicContact CE1-CD1 3.56Å; Y33-Y59 AromaticContact CE1-CE1 3.18Å; Y33-Y59 HydrophobicContact CE1-CE1 3.18Å; Y33-Y59 HydrophobicContact CE1-CG 4.39Å; Y33-Y59 AromaticContact CE1-CZ 3.75Å; Y33-Y59 AromaticContact CZ-CE1 3.57Å; Y33-Y59 WeakPolarHBondContact OH-CE1 3.26Å; V57-Y59 HydrophobicContact CB-CD2 4.01Å; V57-Y59 HydrophobicContact CB-CE2 3.7Å; V57-Y59 HydrophobicContact CG1-CD2 3.68Å; V57-Y59 HydrophobicContact CG1-CE1 4.24Å; V57-Y59 HydrophobicContact CG1-CE2 3.32Å; V57-Y59 HydrophobicContact CG1-CG 4.27Å; V57-Y59 PolarHBondContact O-N 3.3Å; Y59-N61 PolarHBondContact O-N 2.89Å; Y59-S62 PolarHBondContact N-OG 3.39Å; Y59-S62 WeakPolarHBondContact O-CB 3.27Å; Y59-S62 PolarHBondContact O-N 3.3Å; Y59-S62 VanDerWaalsContact O-N 3.1Å; Y59-S62 PolarHBondContact O-OG 3.02Å; Y59-E65 WeakPolarHBondContact O-CB 3.45Å
60	V	91.2	Very high	92.5	Very high	67 Å²	67	70.7 Å²	70.7	41%	0.406	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	132.6	-177.9	-179.9	0	0	0	0	111.6	E32 A34 S62	E32-V60 PolarHBondContact O-N 3.35Å; A34-V60 HydrophobicContact CB-CG2 4.25Å; V60-S62 PolarHBondContact O-N 3.23Å
61	N	89.1	Confident	92.7	Very high	133 Å²	133	67.7 Å²	67.7	71%	0.711	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	3.2	-174.4	-64.2	-63.4	0	0	0	116.8	Y59 E65	Y59-N61 PolarHBondContact O-N 2.89Å; N61-E65 WeakPolarHBondContact CA-OE2 3.41Å; N61-E65 PolarHBondContact N-OE2 2.81Å
62	S	93.6	Very high	92.8	Very high	19 Å²	19	65.3 Å²	65.3	13%	0.133	32%	0.323	C	S	.	.	S	Bend	trans	-77.8	170.5	-172.7	74.4	0	0	0	0	114.8	Y59 V60 G64 E65 K66	Y59-S62 PolarHBondContact N-OG 3.39Å; Y59-S62 WeakPolarHBondContact O-CB 3.27Å; Y59-S62 PolarHBondContact O-N 3.3Å; Y59-S62 VanDerWaalsContact O-N 3.1Å; Y59-S62 PolarHBondContact O-OG 3.02Å; V60-S62 PolarHBondContact O-N 3.23Å; S62-G64 PolarHBondContact O-N 3.16Å; S62-G64 PolarHBondContact OG-N 2.74Å; S62-G64 VanDerWaalsContact OG-N 3.15Å; S62-E65 PolarHBondContact O-N 2.81Å; S62-E65 PolarHBondContact OG-N 3.21Å; S62-K66 PolarHBondContact O-N 2.88Å
63	P	93.4	Very high	92.8	Very high	101 Å²	101	66 Å²	66	66%	0.656	33%	0.327	S	S	*	.	H	α-helix	trans	-57.8	-34.1	164.7	-23.8	35.6	0	0	0	113.1	K66 H67	P63-K66 PolarHBondContact O-N 3.15Å; P63-H67 WeakPolarHBondContact O-CB 3.49Å; P63-H67 PolarHBondContact O-N 3.04Å
64	G	93.5	Very high	93	Very high	1 Å²	1	67 Å²	67	1%	0.01	32%	0.322	C	S	.	.	H	α-helix	trans	-71.7	-33.3	-180	0	0	0	0	0	113.7	E55 V57 S62 H67 R68	E55-G64 VanDerWaalsContact O-CA 3.26Å; E55-G64 WeakPolarHBondContact O-CA 3.45Å; V57-G64 WeakPolarHBondContact O-CA 3.34Å; S62-G64 PolarHBondContact O-N 3.16Å; S62-G64 PolarHBondContact OG-N 2.74Å; S62-G64 VanDerWaalsContact OG-N 3.15Å; G64-H67 PolarHBondContact O-N 3.25Å; G64-R68 WeakPolarHBondContact O-CB 3.47Å; G64-R68 PolarHBondContact O-N 3.21Å
65	E	93.4	Very high	93.2	Very high	44 Å²	44	59.2 Å²	59.2	21%	0.206	29%	0.286	C	S	.	.	H	α-helix	trans	-63.2	-45	168.8	178.1	179.7	-165.5	0	0	110.5	A34 Y59 N61 S62 H67 R68 I69	A34-E65 HydrophobicContact CB-CB 4.25Å; A34-E65 VanDerWaalsContact CB-CD 3.43Å; A34-E65 HydrophobicContact CB-CG 3.74Å; A34-E65 WeakPolarHBondContact CB-OE1 3.43Å; Y59-E65 WeakPolarHBondContact O-CB 3.45Å; N61-E65 WeakPolarHBondContact CA-OE2 3.41Å; N61-E65 PolarHBondContact N-OE2 2.81Å; S62-E65 PolarHBondContact O-N 2.81Å; S62-E65 PolarHBondContact OG-N 3.21Å; E65-H67 VanDerWaalsContact C-N 3.31Å; E65-H67 PolarHBondContact O-N 3.11Å; E65-R68 PolarHBondContact O-N 3.1Å; E65-I69 HydrophobicContact CG-CD1 3.89Å; E65-I69 HydrophobicContact CG-CG1 4.45Å; E65-I69 WeakPolarHBondContact O-CG1 3.32Å; E65-I69 PolarHBondContact O-N 2.8Å
66	K	93.1	Very high	93.3	Very high	139 Å²	139	51.7 Å²	51.7	60%	0.604	25%	0.251	S	S	*	.	H	α-helix	trans	-64.2	-37.6	177.6	-65.7	166.4	-173.3	166.7	0	111.5	S62 P63 K70	S62-K66 PolarHBondContact O-N 2.88Å; P63-K66 PolarHBondContact O-N 3.15Å; K66-K70 WeakPolarHBondContact O-CB 3.47Å; K66-K70 PolarHBondContact O-N 3.33Å
67	H	94.8	Very high	93.4	Very high	53 Å²	53	49.2 Å²	49.2	25%	0.245	24%	0.241	C	C	.	.	H	α-helix	trans	-61.7	-49.7	171.4	-172.9	96	0	0	0	110.9	P63 G64 E65 I69 K70 Q71	P63-H67 WeakPolarHBondContact O-CB 3.49Å; P63-H67 PolarHBondContact O-N 3.04Å; G64-H67 PolarHBondContact O-N 3.25Å; E65-H67 VanDerWaalsContact C-N 3.31Å; E65-H67 PolarHBondContact O-N 3.11Å; H67-I69 PolarHBondContact O-N 3.42Å; H67-K70 PolarHBondContact O-N 2.84Å; H67-Q71 WeakPolarHBondContact NE2-CG 3.37Å; H67-Q71 PolarHBondContact NE2-NE2 3.24Å; H67-Q71 WeakPolarHBondContact O-CG 3.43Å; H67-Q71 PolarHBondContact O-N 2.86Å
68	R	93.8	Very high	93.2	Very high	22 Å²	22	49.2 Å²	49.2	8%	0.083	24%	0.24	C	C	.	.	H	α-helix	trans	-57.5	-47.7	177.3	177.2	-178.4	161.5	-92.8	-13.6	112.1	W35 P58 G64 E65 K70 Q71 L72 V166 D167	W35-R68 VanDerWaalsContact CB-NE 3.31Å; P58-R68 HydrophobicContact CB-CB 4.28Å; G64-R68 WeakPolarHBondContact O-CB 3.47Å; G64-R68 PolarHBondContact O-N 3.21Å; E65-R68 PolarHBondContact O-N 3.1Å; R68-K70 PolarHBondContact O-N 2.86Å; R68-Q71 PolarHBondContact O-N 2.9Å; R68-L72 WeakPolarHBondContact O-CB 3.4Å; R68-L72 PolarHBondContact O-N 3.48Å; R68-V166 HydrophobicContact CG-CG2 4.22Å; R68-D167 IonicContact CZ-OD1 2.97Å; R68-D167 IonicContact CZ-OD2 3.59Å; R68-D167 IonicContact NE-OD1 3.53Å; R68-D167 PolarHBondContact NE-OD1 3.22Å; R68-D167 IonicContact NE-OD2 3.5Å; R68-D167 IonicContact NH2-OD1 2.65Å; R68-D167 PolarHBondContact NH2-OD1 2.86Å; R68-D167 IonicContact NH2-OD2 3.84Å; R68-D167 PolarHBondContact NH2-OD2 3.42Å
69	I	92.1	Very high	93.2	Very high	34 Å²	34	50.1 Å²	50.1	17%	0.174	24%	0.244	C	C	.	.	H	α-helix	trans	-63.4	-41.7	178.8	-65.4	168.8	0	0	0	110.8	E65 H67 L72 L73 F422	E65-I69 HydrophobicContact CG-CD1 3.89Å; E65-I69 HydrophobicContact CG-CG1 4.45Å; E65-I69 WeakPolarHBondContact O-CG1 3.32Å; E65-I69 PolarHBondContact O-N 2.8Å; H67-I69 PolarHBondContact O-N 3.42Å; I69-L72 WeakPolarHBondContact O-CB 3.44Å; I69-L72 PolarHBondContact O-N 3.38Å; I69-L73 PolarHBondContact O-N 3.44Å; I69-L73 VanDerWaalsContact O-N 3.13Å; I69-F422 HydrophobicContact CD1-CE1 3.94Å; I69-F422 HydrophobicContact CG1-CD1 4.34Å; I69-F422 HydrophobicContact CG1-CE1 3.85Å; I69-F422 HydrophobicContact CG1-CZ 4.45Å; I69-F422 HydrophobicContact CG2-CD1 4.18Å
70	K	93.6	Very high	93.2	Very high	160 Å²	160	45.8 Å²	45.8	70%	0.696	23%	0.227	S	C	*	.	H	α-helix	trans	-62.2	-43.6	174.5	-176.3	-178	177.4	-175.8	0	112	K66 H67 R68 L72 Y74	K66-K70 WeakPolarHBondContact O-CB 3.47Å; K66-K70 PolarHBondContact O-N 3.33Å; H67-K70 PolarHBondContact O-N 2.84Å; R68-K70 PolarHBondContact O-N 2.86Å; K70-L72 VanDerWaalsContact C-N 3.34Å; K70-Y74 VanDerWaalsContact O-CB 3.31Å; K70-Y74 WeakPolarHBondContact O-CB 3.26Å; K70-Y74 PolarHBondContact O-N 2.91Å
71	Q	95	Very high	93.1	Very high	22 Å²	22	43.3 Å²	43.3	10%	0.103	21%	0.212	C	C	.	.	H	α-helix	trans	-65	-37.8	175.7	-70.8	-65.2	-6.3	0	0	111.5	H67 R68 Y74 Q75 V166	H67-Q71 WeakPolarHBondContact NE2-CG 3.37Å; H67-Q71 PolarHBondContact NE2-NE2 3.24Å; H67-Q71 WeakPolarHBondContact O-CG 3.43Å; H67-Q71 PolarHBondContact O-N 2.86Å; R68-Q71 PolarHBondContact O-N 2.9Å; Q71-Y74 PolarHBondContact O-N 2.98Å; Q71-Q75 WeakPolarHBondContact O-CB 3.33Å; Q71-Q75 VanDerWaalsContact O-CG 3.27Å; Q71-Q75 WeakPolarHBondContact O-CG 3.39Å; Q71-Q75 PolarHBondContact O-N 2.8Å; Q71-V166 HydrophobicContact CB-CB 4.31Å; Q71-V166 HydrophobicContact CB-CG2 4.32Å
72	L	93.5	Very high	93	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.016	19%	0.185	C	C	.	.	H	α-helix	trans	-58.2	-54.7	177.1	-166.9	77	0	0	0	111	R68 I69 K70 Y74 L76 V166 L418 F422	R68-L72 WeakPolarHBondContact O-CB 3.4Å; R68-L72 PolarHBondContact O-N 3.48Å; I69-L72 WeakPolarHBondContact O-CB 3.44Å; I69-L72 PolarHBondContact O-N 3.38Å; K70-L72 VanDerWaalsContact C-N 3.34Å; L72-Y74 VanDerWaalsContact C-N 3.32Å; L72-Y74 PolarHBondContact O-N 3.2Å; L72-L76 HydrophobicContact CD1-CD1 3.95Å; L72-L76 WeakPolarHBondContact O-CA 3.33Å; L72-L76 WeakPolarHBondContact O-CB 3.38Å; L72-L76 PolarHBondContact O-N 3.27Å; L72-V166 HydrophobicContact CB-CG2 4.05Å; L72-V166 HydrophobicContact CD1-CG1 4.08Å; L72-V166 HydrophobicContact CD1-CG2 3.83Å; L72-L418 HydrophobicContact CD1-CD1 4.16Å; L72-L418 HydrophobicContact CD1-CD2 4.47Å; L72-L418 HydrophobicContact CD2-CB 4.48Å; L72-L418 HydrophobicContact CD2-CD2 4.21Å; L72-F422 HydrophobicContact CD2-CB 4.26Å; L72-F422 HydrophobicContact CD2-CD2 3.29Å; L72-F422 HydrophobicContact CD2-CE2 3.74Å; L72-F422 HydrophobicContact CD2-CG 3.88Å
73	L	92.4	Very high	92.8	Very high	40 Å²	40	39.6 Å²	39.6	21%	0.209	19%	0.191	C	C	.	.	H	α-helix	trans	-65.7	-32.4	-179.6	-61.5	-179.8	0	0	0	113.1	I69 F422 F428	I69-L73 PolarHBondContact O-N 3.44Å; I69-L73 VanDerWaalsContact O-N 3.13Å; L73-F422 HydrophobicContact CD2-CB 4.17Å; L73-F428 HydrophobicContact CD1-CE2 4.22Å; L73-F428 HydrophobicContact CD1-CZ 4.33Å; L73-F428 HydrophobicContact CD2-CE2 3.83Å; L73-F428 HydrophobicContact CD2-CZ 3.97Å
74	Y	94.9	Very high	92.6	Very high	90 Å²	90	41.1 Å²	41.1	35%	0.353	18%	0.183	S	C	.	.	H	α-helix	trans	-79.8	-42.4	179.1	175.3	-105.2	0	0	0	113.3	K70 Q71 L72 R181	K70-Y74 VanDerWaalsContact O-CB 3.31Å; K70-Y74 WeakPolarHBondContact O-CB 3.26Å; K70-Y74 PolarHBondContact O-N 2.91Å; Q71-Y74 PolarHBondContact O-N 2.98Å; L72-Y74 VanDerWaalsContact C-N 3.32Å; L72-Y74 PolarHBondContact O-N 3.2Å; Y74-R181 VanDerWaalsContact O-CB 3.31Å; Y74-R181 WeakPolarHBondContact O-CB 3.45Å; Y74-R181 WeakPolarHBondContact O-CD 3.31Å
75	Q	95.9	Very high	92.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-80.7	-25.6	-177.3	-69.7	-171.2	31.9	0	0	112.8	Q71 L164 V166 C179 G180 R181	Q71-Q75 WeakPolarHBondContact O-CB 3.33Å; Q71-Q75 VanDerWaalsContact O-CG 3.27Å; Q71-Q75 WeakPolarHBondContact O-CG 3.39Å; Q71-Q75 PolarHBondContact O-N 2.8Å; Q75-L164 PolarHBondContact NE2-O 3.29Å; Q75-L164 PolarHBondContact OE1-O 3.02Å; Q75-V166 HydrophobicContact CB-CG1 3.91Å; Q75-V166 HydrophobicContact CG-CG1 4.47Å; Q75-V166 VanDerWaalsContact OE1-N 3.14Å; Q75-C179 HydrophobicContact CB-CB 3.82Å; Q75-C179 HydrophobicContact CG-CB 3.9Å; Q75-G180 CarbonylContact O-C 3.6Å; Q75-G180 VanDerWaalsContact O-CA 3.3Å; Q75-G180 WeakPolarHBondContact O-CA 3.36Å; Q75-G180 PolarHBondContact O-N 3.19Å; Q75-G180 VanDerWaalsContact O-N 3.08Å; Q75-R181 PolarHBondContact O-N 2.82Å
76	L	93.6	Very high	92.1	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.021	19%	0.19	C	C	.	.	S	Bend	trans	-133.2	73.6	-178	-53.8	169.5	0	0	0	109	L72 V166 I169 F171 M415 L419	L72-L76 HydrophobicContact CD1-CD1 3.95Å; L72-L76 WeakPolarHBondContact O-CA 3.33Å; L72-L76 WeakPolarHBondContact O-CB 3.38Å; L72-L76 PolarHBondContact O-N 3.27Å; L76-V166 HydrophobicContact CD1-CG1 3.8Å; L76-V166 HydrophobicContact CG-CG1 4.19Å; L76-I169 HydrophobicContact CD1-CB 4.26Å; L76-I169 HydrophobicContact CD1-CD1 3.75Å; L76-I169 HydrophobicContact CD1-CG2 4.05Å; L76-I169 HydrophobicContact CD2-CG2 3.9Å; L76-F171 HydrophobicContact CD2-CE2 4.04Å; L76-M415 HydrophobicContact CB-CE 4.35Å; L76-M415 HydrophobicContact CD1-CE 4.34Å; L76-M415 HydrophobicContact CD1-SD 3.74Å; L76-M415 HydrophobicContact CD2-CE 4.02Å; L76-M415 HydrophobicContact CD2-SD 4.1Å; L76-M415 HydrophobicContact CG-CE 4.46Å; L76-M415 HydrophobicContact CG-SD 4.42Å; L76-L419 HydrophobicContact CB-CD2 4.43Å; L76-L419 VanDerWaalsContact O-CD2 3.25Å; L76-L419 WeakPolarHBondContact O-CD2 3.28Å
77	P	93.6	Very high	91.7	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.013	19%	0.186	C	C	.	.			trans	-63.4	132.9	-177.9	-19.6	32.6	0	0	0	111.3	H79 D80 N81 R181	P77-H79 VanDerWaalsContact C-N 3.27Å; P77-H79 PolarHBondContact O-N 3.18Å; P77-D80 HydrophobicContact CB-CB 4.22Å; P77-D80 HydrophobicContact CG-CB 4.49Å; P77-D80 WeakPolarHBondContact O-CB 3.3Å; P77-D80 PolarHBondContact O-N 2.97Å; P77-D80 VanDerWaalsContact O-N 3.11Å; P77-N81 PolarHBondContact O-ND2 2.78Å; P77-R181 HydrophobicContact CG-CB 4.25Å; P77-R181 HydrophobicContact CG-CG 4.21Å
78	P	91.3	Very high	90.9	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.013	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-60	-37.2	-179.8	-23.9	33.3	0	0	0	113.1	D80 N81 E82 Y85 L419 F428	P78-D80 VanDerWaalsContact C-N 3.31Å; P78-D80 PolarHBondContact O-N 3.3Å; P78-N81 PolarHBondContact O-N 2.9Å; P78-N81 VanDerWaalsContact O-N 3.13Å; P78-E82 PolarHBondContact O-N 3.05Å; P78-Y85 HydrophobicContact CB-CD1 4.39Å; P78-Y85 HydrophobicContact CB-CD2 3.39Å; P78-Y85 HydrophobicContact CB-CE2 3.91Å; P78-Y85 HydrophobicContact CB-CG 3.68Å; P78-L419 HydrophobicContact CB-CD2 4.36Å; P78-L419 HydrophobicContact CG-CD2 4.13Å; P78-F428 HydrophobicContact CG-CE2 4.2Å; P78-F428 HydrophobicContact CG-CZ 3.95Å
79	H	92.1	Very high	90.6	Very high	25 Å²	25	43.5 Å²	43.5	12%	0.116	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-71.7	-16	177.4	56.6	-91.1	0	0	0	114.7	P77 N81 C86 D195	P77-H79 VanDerWaalsContact C-N 3.27Å; P77-H79 PolarHBondContact O-N 3.18Å; H79-N81 PolarHBondContact O-N 3.38Å; H79-C86 PolarHBondContact O-SG 3.48Å; H79-D195 PolarHBondContact NE2-O 2.84Å
80	D	93.3	Very high	90.6	Very high	1 Å²	1	44 Å²	44	1%	0.005	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-73.4	-11.3	169.4	-77.4	15	0	0	0	112.4	P77 P78 A184 R190	P77-D80 HydrophobicContact CB-CB 4.22Å; P77-D80 HydrophobicContact CG-CB 4.49Å; P77-D80 WeakPolarHBondContact O-CB 3.3Å; P77-D80 PolarHBondContact O-N 2.97Å; P77-D80 VanDerWaalsContact O-N 3.11Å; P78-D80 VanDerWaalsContact C-N 3.31Å; P78-D80 PolarHBondContact O-N 3.3Å; D80-A184 WeakPolarHBondContact OD2-CB 3.37Å; D80-R190 IonicContact OD1-CZ 2.67Å; D80-R190 IonicContact OD1-NH1 3.73Å; D80-R190 PolarHBondContact OD1-NH1 2.72Å; D80-R190 IonicContact OD1-NH2 3.98Å; D80-R190 PolarHBondContact OD1-NH2 3.32Å; D80-R190 IonicContact OD2-CZ 3.22Å; D80-R190 IonicContact OD2-NH1 3.87Å; D80-R190 IonicContact OD2-NH2 3.15Å; D80-R190 PolarHBondContact OD2-NH2 2.88Å
81	N	88.4	Confident	90.6	Very high	14 Å²	14	41.4 Å²	41.4	8%	0.075	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.8	-39.9	-171.2	-67.3	-89.7	0	0	0	112.6	P77 P78 H79 S101 L419	P77-N81 PolarHBondContact O-ND2 2.78Å; P78-N81 PolarHBondContact O-N 2.9Å; P78-N81 VanDerWaalsContact O-N 3.13Å; H79-N81 PolarHBondContact O-N 3.38Å; N81-S101 WeakPolarHBondContact O-CB 3.49Å; N81-S101 PolarHBondContact O-OG 3.34Å; N81-L419 HydrophobicContact CB-CD1 3.76Å
82	E	87.9	Confident	90.5	Very high	35 Å²	35	46.1 Å²	46.1	16%	0.164	23%	0.228	C	C	.	.			trans	-135.9	131.6	-168	-59.4	-177.3	-154.9	0	0	114.3	P78 R84 Y85 C86	P78-E82 PolarHBondContact O-N 3.05Å; E82-R84 HydrophobicContact CB-CG 4.38Å; E82-R84 PolarHBondContact O-N 3.42Å; E82-R84 VanDerWaalsContact O-N 3.13Å; E82-R84 IonicContact OE1-NH2 2.69Å; E82-R84 IonicContact OE2-CZ 3.31Å; E82-R84 IonicContact OE2-NE 2.71Å; E82-R84 PolarHBondContact OE2-NE 2.74Å; E82-R84 IonicContact OE2-NH2 2.73Å; E82-R84 PolarHBondContact OE2-NH2 3.33Å; E82-Y85 HydrophobicContact CB-CD2 4.05Å; E82-Y85 HydrophobicContact CB-CE2 4.4Å; E82-Y85 PolarHBondContact O-N 3.28Å; E82-C86 PolarHBondContact O-SG 2.9Å; E82-C86 VanDerWaalsContact O-SG 3.33Å
83	V	89.9	Confident	90.5	Very high	40 Å²	40	47.8 Å²	47.8	24%	0.242	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-52.3	-36.1	179.8	170.2	0	0	0	0	113.8	Y85 C86 K94 L97 Q98	V83-Y85 PolarHBondContact O-N 2.87Å; V83-C86 WeakPolarHBondContact O-CB 3.33Å; V83-C86 PolarHBondContact O-N 3.17Å; V83-C86 VanDerWaalsContact O-N 3.08Å; V83-K94 HydrophobicContact CB-CG 4.49Å; V83-K94 HydrophobicContact CG1-CD 3.88Å; V83-K94 HydrophobicContact CG1-CG 3.67Å; V83-K94 HydrophobicContact CG2-CB 3.98Å; V83-K94 HydrophobicContact CG2-CG 3.94Å; V83-L97 HydrophobicContact CG2-CD2 3.98Å; V83-Q98 HydrophobicContact CG2-CG 4.35Å
84	R	88.9	Confident	90.6	Very high	132 Å²	132	48.4 Å²	48.4	50%	0.498	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-67.2	-18.5	-173.9	63	172	159.2	151.2	1	114.7	E82 L420 D424	E82-R84 HydrophobicContact CB-CG 4.38Å; E82-R84 PolarHBondContact O-N 3.42Å; E82-R84 VanDerWaalsContact O-N 3.13Å; E82-R84 IonicContact OE1-NH2 2.69Å; E82-R84 IonicContact OE2-CZ 3.31Å; E82-R84 IonicContact OE2-NE 2.71Å; E82-R84 PolarHBondContact OE2-NE 2.74Å; E82-R84 IonicContact OE2-NH2 2.73Å; E82-R84 PolarHBondContact OE2-NH2 3.33Å; R84-L420 VanDerWaalsContact NH1-CD2 3.27Å; R84-D424 IonicContact NH1-OD1 3.55Å; R84-D424 IonicContact NH1-OD2 3.39Å
85	Y	88.6	Confident	90.5	Very high	51 Å²	51	49.2 Å²	49.2	20%	0.2	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-97.8	2.1	176.5	-56.7	-65.4	0	0	0	112.7	P78 E82 V83 D424	P78-Y85 HydrophobicContact CB-CD1 4.39Å; P78-Y85 HydrophobicContact CB-CD2 3.39Å; P78-Y85 HydrophobicContact CB-CE2 3.91Å; P78-Y85 HydrophobicContact CB-CG 3.68Å; E82-Y85 HydrophobicContact CB-CD2 4.05Å; E82-Y85 HydrophobicContact CB-CE2 4.4Å; E82-Y85 PolarHBondContact O-N 3.28Å; V83-Y85 PolarHBondContact O-N 2.87Å; Y85-D424 PolarHBondContact OH-OD1 3.3Å
86	C	87.9	Confident	90.5	Very high	23 Å²	23	52.7 Å²	52.7	16%	0.155	26%	0.259	C	S	.	.	S	Bend	trans	-98.8	147.8	-176.1	-55.2	0	0	0	0	113.1	H79 E82 V83 S88 L89 L97 E196	H79-C86 PolarHBondContact O-SG 3.48Å; E82-C86 PolarHBondContact O-SG 2.9Å; E82-C86 VanDerWaalsContact O-SG 3.33Å; V83-C86 WeakPolarHBondContact O-CB 3.33Å; V83-C86 PolarHBondContact O-N 3.17Å; V83-C86 VanDerWaalsContact O-N 3.08Å; C86-S88 PolarHBondContact O-N 3.38Å; C86-L89 HydrophobicContact CB-CD1 3.61Å; C86-L89 HydrophobicContact CB-CG 3.84Å; C86-L97 WeakPolarHBondContact SG-CD2 3.44Å; C86-E196 WeakPolarHBondContact CA-OE1 3.44Å
87	Q	84.4	Confident	90.6	Very high	113 Å²	113	52.5 Å²	52.5	53%	0.528	26%	0.258	S	S	.	.	S	Bend	trans	-89.2	100.1	-177.6	-61.9	-179	38.8	0	0	112.1	L89 E196	Q87-L89 PolarHBondContact O-N 3.18Å; Q87-E196 WeakPolarHBondContact CB-OE1 3.43Å; Q87-E196 PolarHBondContact N-OE1 3.13Å
88	S	78.2	Confident	90.6	Very high	100 Å²	100	57.7 Å²	57.7	70%	0.699	28%	0.282	S	S	*	.	S	Bend	trans	63.4	35.2	163.7	71.3	0	0	0	0	117.4	C86	C86-S88 PolarHBondContact O-N 3.38Å
89	L	87.9	Confident	90.8	Very high	22 Å²	22	63.8 Å²	63.8	12%	0.115	31%	0.312	C	S	.	.			trans	-59	146	171.7	-59.4	-179.2	0	0	0	112.9	C86 Q87 E93 K94 L97	C86-L89 HydrophobicContact CB-CD1 3.61Å; C86-L89 HydrophobicContact CB-CG 3.84Å; Q87-L89 PolarHBondContact O-N 3.18Å; L89-E93 HydrophobicContact CB-CB 4.15Å; L89-E93 HydrophobicContact CD2-CB 4.2Å; L89-K94 HydrophobicContact CB-CG 3.9Å; L89-K94 HydrophobicContact CD1-CG 4.44Å; L89-K94 WeakPolarHBondContact O-CE 3.18Å; L89-L97 HydrophobicContact CD1-CD2 3.76Å
90	S	91.3	Very high	90.9	Very high	46 Å²	46	63.8 Å²	63.8	32%	0.322	31%	0.311	S	S	.	.			trans	-71.1	166.3	166.8	62.4	0	0	0	0	112.7	E92 E93 K94	S90-E92 PolarHBondContact O-N 3.19Å; S90-E93 VanDerWaalsContact CB-OE2 3.25Å; S90-E93 WeakPolarHBondContact CB-OE2 3.21Å; S90-E93 PolarHBondContact N-OE2 3.42Å; S90-E93 PolarHBondContact O-N 3.33Å; S90-E93 VanDerWaalsContact OG-CD 3.29Å; S90-E93 VanDerWaalsContact OG-CG 3.26Å; S90-E93 WeakPolarHBondContact OG-CG 3.45Å; S90-E93 PolarHBondContact OG-N 3.07Å; S90-E93 PolarHBondContact OG-OE2 2.92Å; S90-K94 WeakPolarHBondContact O-CB 3.31Å; S90-K94 WeakPolarHBondContact O-CG 3.38Å; S90-K94 PolarHBondContact O-N 2.86Å
91	E	92.7	Very high	90.9	Very high	105 Å²	105	64.1 Å²	64.1	49%	0.491	31%	0.314	S	S	.	.	H	α-helix	trans	-65	-21.4	177	-63.5	-52.7	132	0	0	112.9	K94 K95	E91-K94 IonicContact OE1-NZ 2.72Å; E91-K94 PolarHBondContact OE1-NZ 2.98Å; E91-K95 WeakPolarHBondContact O-CD 3.36Å; E91-K95 WeakPolarHBondContact O-CE 3.44Å; E91-K95 WeakPolarHBondContact O-CG 3.48Å; E91-K95 PolarHBondContact O-N 3.24Å; E91-K95 PolarHBondContact O-NZ 3.32Å
92	E	93.3	Very high	91.1	Very high	120 Å²	120	66.5 Å²	66.5	56%	0.561	33%	0.332	S	S	*	.	H	α-helix	trans	-78.9	-51.5	177.6	-71.4	51.1	-111.7	0	0	109.6	S90 K94 K95 E96	S90-E92 PolarHBondContact O-N 3.19Å; E92-K94 VanDerWaalsContact C-N 3.28Å; E92-K94 PolarHBondContact O-N 2.72Å; E92-K95 PolarHBondContact O-N 2.67Å; E92-K95 VanDerWaalsContact O-N 3.17Å; E92-K95 IonicContact OE1-NZ 3.62Å; E92-K95 PolarHBondContact OE1-NZ 2.91Å; E92-E96 PolarHBondContact O-N 3.41Å
93	E	93.8	Very high	91.5	Very high	38 Å²	38	68.8 Å²	68.8	18%	0.178	34%	0.342	C	S	.	.	H	α-helix	trans	-62.2	-33.4	175.4	-66.8	163.5	123.3	0	0	112.3	L89 S90 E96 L97 F199	L89-E93 HydrophobicContact CB-CB 4.15Å; L89-E93 HydrophobicContact CD2-CB 4.2Å; S90-E93 VanDerWaalsContact CB-OE2 3.25Å; S90-E93 WeakPolarHBondContact CB-OE2 3.21Å; S90-E93 PolarHBondContact N-OE2 3.42Å; S90-E93 PolarHBondContact O-N 3.33Å; S90-E93 VanDerWaalsContact OG-CD 3.29Å; S90-E93 VanDerWaalsContact OG-CG 3.26Å; S90-E93 WeakPolarHBondContact OG-CG 3.45Å; S90-E93 PolarHBondContact OG-N 3.07Å; S90-E93 PolarHBondContact OG-OE2 2.92Å; E93-E96 PolarHBondContact O-N 3.44Å; E93-L97 WeakPolarHBondContact O-CB 3.34Å; E93-L97 PolarHBondContact O-N 2.84Å; E93-F199 HydrophobicContact CB-CB 4.12Å; E93-F199 HydrophobicContact CG-CB 3.98Å
94	K	93.9	Very high	91.7	Very high	54 Å²	54	67.3 Å²	67.3	24%	0.235	33%	0.332	C	S	.	.	H	α-helix	trans	-61.5	-44.2	173.5	-75.4	172.8	-168.2	169.5	0	112.6	V83 L89 S90 E91 E92 Q98	V83-K94 HydrophobicContact CB-CG 4.49Å; V83-K94 HydrophobicContact CG1-CD 3.88Å; V83-K94 HydrophobicContact CG1-CG 3.67Å; V83-K94 HydrophobicContact CG2-CB 3.98Å; V83-K94 HydrophobicContact CG2-CG 3.94Å; L89-K94 HydrophobicContact CB-CG 3.9Å; L89-K94 HydrophobicContact CD1-CG 4.44Å; L89-K94 WeakPolarHBondContact O-CE 3.18Å; S90-K94 WeakPolarHBondContact O-CB 3.31Å; S90-K94 WeakPolarHBondContact O-CG 3.38Å; S90-K94 PolarHBondContact O-N 2.86Å; E91-K94 IonicContact OE1-NZ 2.72Å; E91-K94 PolarHBondContact OE1-NZ 2.98Å; E92-K94 VanDerWaalsContact C-N 3.28Å; E92-K94 PolarHBondContact O-N 2.72Å; K94-Q98 WeakPolarHBondContact O-CG 3.44Å; K94-Q98 PolarHBondContact O-N 2.73Å
95	K	94.6	Very high	91.8	Very high	107 Å²	107	62.2 Å²	62.2	47%	0.465	31%	0.314	S	S	.	.	H	α-helix	trans	-67	-40.4	176.4	-65	156.5	-160.6	148.9	0	110.1	E91 E92 Q98 M99	E91-K95 WeakPolarHBondContact O-CD 3.36Å; E91-K95 WeakPolarHBondContact O-CE 3.44Å; E91-K95 WeakPolarHBondContact O-CG 3.48Å; E91-K95 PolarHBondContact O-N 3.24Å; E91-K95 PolarHBondContact O-NZ 3.32Å; E92-K95 PolarHBondContact O-N 2.67Å; E92-K95 VanDerWaalsContact O-N 3.17Å; E92-K95 IonicContact OE1-NZ 3.62Å; E92-K95 PolarHBondContact OE1-NZ 2.91Å; K95-Q98 PolarHBondContact O-N 2.98Å; K95-M99 WeakPolarHBondContact O-CG 3.33Å; K95-M99 PolarHBondContact O-N 3.33Å
96	E	95.2	Very high	92	Very high	72 Å²	72	66.9 Å²	66.9	34%	0.336	34%	0.335	S	S	.	.	H	α-helix	trans	-65	-43.8	177.5	-159.8	-176.1	176.8	0	0	111.9	E92 E93 Q98 M99 F100 K188 F199	E92-E96 PolarHBondContact O-N 3.41Å; E93-E96 PolarHBondContact O-N 3.44Å; E96-Q98 PolarHBondContact O-N 2.97Å; E96-M99 PolarHBondContact O-N 3.13Å; E96-F100 WeakPolarHBondContact O-CB 3.19Å; E96-F100 PolarHBondContact O-N 3.44Å; E96-K188 WeakPolarHBondContact OE1-CE 3.14Å; E96-K188 IonicContact OE1-NZ 3.27Å; E96-K188 PolarHBondContact OE1-NZ 3Å; E96-K188 IonicContact OE2-NZ 2.82Å; E96-K188 PolarHBondContact OE2-NZ 2.78Å; E96-F199 HydrophobicContact CB-CD1 4.02Å; E96-F199 HydrophobicContact CG-CD1 3.81Å; E96-F199 HydrophobicContact CG-CE1 4.42Å; E96-F199 WeakPolarHBondContact OE2-CB 3.45Å
97	L	94.6	Very high	92.2	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-58.8	-44.4	173.2	172	59.2	0	0	0	111.9	V83 C86 L89 E93 F100 S101 F199	V83-L97 HydrophobicContact CG2-CD2 3.98Å; C86-L97 WeakPolarHBondContact SG-CD2 3.44Å; L89-L97 HydrophobicContact CD1-CD2 3.76Å; E93-L97 WeakPolarHBondContact O-CB 3.34Å; E93-L97 PolarHBondContact O-N 2.84Å; L97-F100 PolarHBondContact O-N 3.02Å; L97-S101 WeakPolarHBondContact O-CB 3.37Å; L97-S101 PolarHBondContact O-N 2.87Å; L97-S101 PolarHBondContact O-OG 3.07Å; L97-F199 HydrophobicContact CB-CD2 4.37Å; L97-F199 HydrophobicContact CB-CE1 4.42Å; L97-F199 HydrophobicContact CB-CE2 3.84Å; L97-F199 HydrophobicContact CB-CZ 3.88Å; L97-F199 HydrophobicContact CD1-CE2 3.8Å; L97-F199 HydrophobicContact CD1-CZ 3.63Å; L97-F199 HydrophobicContact CG-CE2 4.28Å; L97-F199 HydrophobicContact CG-CZ 4.33Å
98	Q	93.9	Very high	92.6	Very high	111 Å²	111	66 Å²	66	52%	0.519	33%	0.329	S	S	.	.	H	α-helix	trans	-61.7	-44	176.5	-75.6	173.8	-14.5	0	0	112.3	V83 K94 K95 E96 S101 S102	V83-Q98 HydrophobicContact CG2-CG 4.35Å; K94-Q98 WeakPolarHBondContact O-CG 3.44Å; K94-Q98 PolarHBondContact O-N 2.73Å; K95-Q98 PolarHBondContact O-N 2.98Å; E96-Q98 PolarHBondContact O-N 2.97Å; Q98-S101 PolarHBondContact O-OG 3.39Å; Q98-S102 VanDerWaalsContact O-CB 3.26Å; Q98-S102 WeakPolarHBondContact O-CB 3.41Å; Q98-S102 PolarHBondContact O-N 3.05Å; Q98-S102 VanDerWaalsContact O-N 3.12Å; Q98-S102 PolarHBondContact O-OG 3.35Å
99	M	95	Very high	93.4	Very high	131 Å²	131	61.5 Å²	61.5	65%	0.645	30%	0.297	S	S	*	.	H	α-helix	trans	-64.9	-45	174.9	-69.8	-62.4	-62.8	0	0	111.2	K95 E96 S102 Q103	K95-M99 WeakPolarHBondContact O-CG 3.33Å; K95-M99 PolarHBondContact O-N 3.33Å; E96-M99 PolarHBondContact O-N 3.13Å; M99-S102 PolarHBondContact O-N 3.3Å; M99-Q103 WeakPolarHBondContact O-CB 3.48Å; M99-Q103 PolarHBondContact O-N 2.92Å
100	F	95.6	Very high	93.7	Very high	24 Å²	24	60.5 Å²	60.5	11%	0.105	29%	0.292	C	S	.	.	H	α-helix	trans	-61.9	-46.5	-179.9	175.7	-102.2	0	0	0	112.8	E96 L97 R104 A184 L187 K188 I197 F199	E96-F100 WeakPolarHBondContact O-CB 3.19Å; E96-F100 PolarHBondContact O-N 3.44Å; L97-F100 PolarHBondContact O-N 3.02Å; F100-R104 WeakPolarHBondContact O-CB 3.47Å; F100-R104 WeakPolarHBondContact O-CD 3.31Å; F100-R104 WeakPolarHBondContact O-CG 3.31Å; F100-R104 PolarHBondContact O-N 2.86Å; F100-R104 VanDerWaalsContact O-N 3.1Å; F100-A184 HydrophobicContact CE1-CB 4.25Å; F100-A184 HydrophobicContact CZ-CB 4.05Å; F100-L187 HydrophobicContact CE2-CB 3.82Å; F100-L187 HydrophobicContact CE2-CD1 4.19Å; F100-L187 HydrophobicContact CZ-CB 4.45Å; F100-K188 HydrophobicContact CD2-CG 4.41Å; F100-K188 HydrophobicContact CE2-CB 4.23Å; F100-K188 HydrophobicContact CE2-CG 3.94Å; F100-K188 HydrophobicContact CZ-CB 4.38Å; F100-I197 HydrophobicContact CE1-CG1 4.45Å; F100-I197 HydrophobicContact CE1-CG2 4.42Å; F100-I197 HydrophobicContact CZ-CG2 4.37Å; F100-F199 HydrophobicContact CB-CE1 3.78Å; F100-F199 HydrophobicContact CB-CZ 4.27Å; F100-F199 AromaticContact CD1-CE1 3.91Å; F100-F199 HydrophobicContact CD1-CE1 3.91Å; F100-F199 AromaticContact CD1-CZ 3.71Å; F100-F199 HydrophobicContact CD1-CZ 3.71Å; F100-F199 HydrophobicContact CD2-CE1 4.25Å; F100-F199 HydrophobicContact CE1-CE1 4.47Å; F100-F199 HydrophobicContact CE1-CZ 4.14Å; F100-F199 AromaticContact CG-CE1 3.76Å; F100-F199 HydrophobicContact CG-CE1 3.76Å; F100-F199 HydrophobicContact CG-CZ 4.07Å
101	S	93.5	Very high	93.7	Very high	9 Å²	9	60.1 Å²	60.1	6%	0.063	28%	0.284	C	S	.	.	H	α-helix	trans	-68.2	-45.6	178.5	68.3	0	0	0	0	111	N81 L97 Q98 Q103 R104 K105	N81-S101 WeakPolarHBondContact O-CB 3.49Å; N81-S101 PolarHBondContact O-OG 3.34Å; L97-S101 WeakPolarHBondContact O-CB 3.37Å; L97-S101 PolarHBondContact O-N 2.87Å; L97-S101 PolarHBondContact O-OG 3.07Å; Q98-S101 PolarHBondContact O-OG 3.39Å; S101-Q103 PolarHBondContact O-N 2.89Å; S101-R104 PolarHBondContact O-N 3.09Å; S101-K105 VanDerWaalsContact O-CG 3.28Å; S101-K105 WeakPolarHBondContact O-CG 3.28Å; S101-K105 PolarHBondContact O-N 3.22Å
102	S	93	Very high	93.7	Very high	63 Å²	63	55.2 Å²	55.2	44%	0.441	26%	0.261	S	S	.	.	H	α-helix	trans	-60.5	-46.3	176.9	-53.3	0	0	0	0	112.6	Q98 M99 R104 K105 K106	Q98-S102 VanDerWaalsContact O-CB 3.26Å; Q98-S102 WeakPolarHBondContact O-CB 3.41Å; Q98-S102 PolarHBondContact O-N 3.05Å; Q98-S102 VanDerWaalsContact O-N 3.12Å; Q98-S102 PolarHBondContact O-OG 3.35Å; M99-S102 PolarHBondContact O-N 3.3Å; S102-R104 PolarHBondContact O-N 3.06Å; S102-K105 PolarHBondContact O-N 3.32Å; S102-K106 WeakPolarHBondContact O-CB 3.36Å; S102-K106 PolarHBondContact O-N 2.67Å
103	Q	94.6	Very high	93.7	Very high	83 Å²	83	51.7 Å²	51.7	39%	0.388	25%	0.248	S	C	.	.	H	α-helix	trans	-60	-47	178.2	-170.9	75.8	-2	0	0	110.9	M99 S101 K106 E107	M99-Q103 WeakPolarHBondContact O-CB 3.48Å; M99-Q103 PolarHBondContact O-N 2.92Å; S101-Q103 PolarHBondContact O-N 2.89Å; Q103-K106 PolarHBondContact O-N 3.49Å; Q103-E107 WeakPolarHBondContact CG-OE2 3.36Å; Q103-E107 PolarHBondContact NE2-OE1 3.16Å; Q103-E107 PolarHBondContact NE2-OE2 3.35Å; Q103-E107 WeakPolarHBondContact O-CB 3.44Å; Q103-E107 WeakPolarHBondContact O-CG 3.48Å; Q103-E107 PolarHBondContact O-N 2.89Å
104	R	94.6	Very high	93.6	Very high	10 Å²	10	50.8 Å²	50.8	4%	0.038	24%	0.244	C	C	.	.	H	α-helix	trans	-67.9	-36.2	-179.6	-71.3	174.3	58.4	-144.8	-9.6	113.3	F100 S101 S102 A108 L109 F171 G180 H183 L187	F100-R104 WeakPolarHBondContact O-CB 3.47Å; F100-R104 WeakPolarHBondContact O-CD 3.31Å; F100-R104 WeakPolarHBondContact O-CG 3.31Å; F100-R104 PolarHBondContact O-N 2.86Å; F100-R104 VanDerWaalsContact O-N 3.1Å; S101-R104 PolarHBondContact O-N 3.09Å; S102-R104 PolarHBondContact O-N 3.06Å; R104-A108 PolarHBondContact O-N 3.35Å; R104-L109 PolarHBondContact O-N 3.41Å; R104-F171 HydrophobicContact CB-CE1 4.12Å; R104-G180 PolarHBondContact NH2-O 3.32Å; R104-H183 PolarHBondContact NE-ND1 3.37Å; R104-L187 HydrophobicContact CG-CD1 3.81Å
105	K	91.5	Very high	93.4	Very high	25 Å²	25	53.7 Å²	53.7	11%	0.109	26%	0.257	C	S	.	.	H	α-helix	trans	-62.4	-50.9	171.8	-70.8	179.4	175.8	-170.1	0	110.3	S101 S102 E107 L109 E412 T416	S101-K105 VanDerWaalsContact O-CG 3.28Å; S101-K105 WeakPolarHBondContact O-CG 3.28Å; S101-K105 PolarHBondContact O-N 3.22Å; S102-K105 PolarHBondContact O-N 3.32Å; K105-E107 PolarHBondContact O-N 3.41Å; K105-L109 HydrophobicContact CB-CD2 4.15Å; K105-L109 HydrophobicContact CG-CD2 3.98Å; K105-L109 WeakPolarHBondContact O-CB 3.43Å; K105-E412 HydrophobicContact CB-CG 4.04Å; K105-E412 VanDerWaalsContact CB-OE1 3.25Å; K105-E412 WeakPolarHBondContact CB-OE1 3.47Å; K105-E412 HydrophobicContact CD-CB 4.34Å; K105-E412 VanDerWaalsContact CD-CD 3.46Å; K105-E412 HydrophobicContact CD-CG 3.84Å; K105-E412 WeakPolarHBondContact CD-OE2 3.27Å; K105-E412 HydrophobicContact CG-CG 4.39Å; K105-E412 IonicContact NZ-OE2 3.87Å; K105-T416 PolarHBondContact NZ-OG1 3.08Å
106	K	91.9	Very high	93.1	Very high	149 Å²	149	51.8 Å²	51.8	65%	0.648	25%	0.251	S	S	*	.	H	α-helix	trans	-63.5	-40.2	179.7	-173.6	-179.8	177.9	-174	0	114.4	S102 Q103 R144	S102-K106 WeakPolarHBondContact O-CB 3.36Å; S102-K106 PolarHBondContact O-N 2.67Å; Q103-K106 PolarHBondContact O-N 3.49Å; K106-R144 PolarHBondContact O-NH2 2.81Å
107	E	92.6	Very high	92.6	Very high	115 Å²	115	49.1 Å²	49.1	54%	0.537	24%	0.239	S	C	.	.	H	α-helix	trans	-101.7	-20.1	-168.3	-65.1	-170.3	155	0	0	115.2	Q103 K105 R144	Q103-E107 WeakPolarHBondContact CG-OE2 3.36Å; Q103-E107 PolarHBondContact NE2-OE1 3.16Å; Q103-E107 PolarHBondContact NE2-OE2 3.35Å; Q103-E107 WeakPolarHBondContact O-CB 3.44Å; Q103-E107 WeakPolarHBondContact O-CG 3.48Å; Q103-E107 PolarHBondContact O-N 2.89Å; K105-E107 PolarHBondContact O-N 3.41Å; E107-R144 VanDerWaalsContact C-NH1 3.25Å; E107-R144 PolarHBondContact O-NH1 3.16Å
108	A	94.1	Very high	92.1	Very high	2 Å²	2	52.6 Å²	52.6	2%	0.017	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.4	-29.7	-174.7	0	0	0	0	0	115.7	R104 R144 F171 Y172 H183	R104-A108 PolarHBondContact O-N 3.35Å; A108-R144 WeakPolarHBondContact O-CD 3.47Å; A108-R144 PolarHBondContact O-NE 3.45Å; A108-F171 HydrophobicContact CB-CB 4.28Å; A108-F171 HydrophobicContact CB-CD1 4.06Å; A108-F171 CarbonylContact O-C 3.59Å; A108-F171 VanDerWaalsContact O-CA 3.27Å; A108-F171 WeakPolarHBondContact O-CA 3.43Å; A108-Y172 PolarHBondContact O-N 3.29Å; A108-H183 WeakPolarHBondContact CB-NE2 3.39Å
109	L	94.5	Very high	91.4	Very high	5 Å²	5	57.4 Å²	57.4	3%	0.026	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	133.7	-180	173.2	67.7	0	0	0	111.9	R104 K105 R144 I169 Y170 F171 W408 M415	R104-L109 PolarHBondContact O-N 3.41Å; K105-L109 HydrophobicContact CB-CD2 4.15Å; K105-L109 HydrophobicContact CG-CD2 3.98Å; K105-L109 WeakPolarHBondContact O-CB 3.43Å; L109-R144 PolarHBondContact O-NE 2.91Å; L109-R144 PolarHBondContact O-NH2 3.41Å; L109-I169 HydrophobicContact CD1-CG2 3.62Å; L109-Y170 CarbonylContact C-O 3.57Å; L109-Y170 WeakPolarHBondContact CA-O 3.3Å; L109-F171 HydrophobicContact CB-CD1 4.17Å; L109-F171 HydrophobicContact CB-CE1 3.86Å; L109-F171 HydrophobicContact CB-CZ 4.15Å; L109-F171 HydrophobicContact CD1-CD2 4.36Å; L109-F171 HydrophobicContact CD1-CE1 4.42Å; L109-F171 HydrophobicContact CD1-CE2 3.83Å; L109-F171 HydrophobicContact CD1-CZ 3.88Å; L109-W408 WeakPolarHBondContact O-CZ3 3.41Å; L109-M415 HydrophobicContact CD1-CG 4.3Å; L109-M415 HydrophobicContact CD2-CG 3.92Å
110	G	93.1	Very high	90.5	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.01	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	173.4	166.2	0	0	0	0	0	111.7	Y170	G110-Y170 VanDerWaalsContact C-CD1 3.49Å; G110-Y170 PolarHBondContact N-O 3.27Å; G110-Y170 VanDerWaalsContact O-CD1 3.25Å; G110-Y170 WeakPolarHBondContact O-CD1 3.47Å; G110-Y170 PolarHBondContact O-N 2.91Å; G110-Y170 VanDerWaalsContact O-O 3.11Å
111	R	92.1	Very high	89.4	Confident	38 Å²	38	56.7 Å²	56.7	14%	0.143	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	135.1	175.4	-161.8	178.6	-173.5	-179.9	0.5	110.5	T113 L168 Y170 H411 Y414	R111-T113 PolarHBondContact O-N 3.47Å; R111-L168 CarbonylContact C-O 3.59Å; R111-L168 WeakPolarHBondContact CA-O 3.27Å; R111-Y170 VanDerWaalsContact C-CE1 3.42Å; R111-H411 VanDerWaalsContact CB-CD2 3.41Å; R111-H411 WeakPolarHBondContact CB-CD2 3.18Å; R111-H411 WeakPolarHBondContact CB-NE2 3.44Å; R111-H411 PolarHBondContact N-CD2 3.43Å; R111-Y414 PolarHBondContact NH2-OH 3.29Å
112	G	92.6	Very high	87.8	Confident	2 Å²	2	63.4 Å²	63.4	2%	0.021	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	128.6	177.3	0	0	0	0	0	110.3	F141 L168	G112-F141 CarbonylContact C-O 3.6Å; G112-F141 WeakPolarHBondContact CA-O 3.47Å; G112-L168 PolarHBondContact N-O 3.43Å; G112-L168 VanDerWaalsContact O-CD1 3.27Å; G112-L168 WeakPolarHBondContact O-CD1 3.29Å
113	T	92.3	Very high	86.7	Confident	46 Å²	46	67.7 Å²	67.7	28%	0.282	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	127.8	173.4	59.9	0	0	0	0	109.3	R111 K115 F141	R111-T113 PolarHBondContact O-N 3.47Å; T113-K115 WeakPolarHBondContact OG1-CE 3.48Å; T113-F141 PolarHBondContact N-O 3.09Å; T113-F141 PolarHBondContact O-N 3.46Å
114	I	91.9	Very high	86.3	Confident	19 Å²	19	64.3 Å²	64.3	10%	0.097	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	129.3	176	-65.7	162	0	0	0	109.1	P37 L40 Y48 V138 A139 V140 L168	P37-I114 HydrophobicContact CB-CD1 3.54Å; P37-I114 HydrophobicContact CG-CD1 3.5Å; P37-I114 VanDerWaalsContact CG-CD1 3.5Å; L40-I114 HydrophobicContact CD1-CB 4.31Å; L40-I114 HydrophobicContact CD1-CD1 3.91Å; L40-I114 HydrophobicContact CD1-CG2 4.18Å; L40-I114 HydrophobicContact CD2-CB 4.05Å; L40-I114 HydrophobicContact CD2-CG2 3.9Å; Y48-I114 HydrophobicContact CD1-CD1 4.33Å; Y48-I114 HydrophobicContact CD2-CD1 3.28Å; Y48-I114 HydrophobicContact CD2-CG1 4.18Å; Y48-I114 HydrophobicContact CE1-CD1 4.42Å; Y48-I114 HydrophobicContact CE2-CD1 3.39Å; Y48-I114 HydrophobicContact CE2-CG1 4.24Å; Y48-I114 HydrophobicContact CG-CD1 3.77Å; I114-V138 HydrophobicContact CG2-CB 4.36Å; I114-V138 HydrophobicContact CG2-CG1 4.38Å; I114-A139 WeakPolarHBondContact CA-O 3.26Å; I114-V140 HydrophobicContact CG1-CG2 4.17Å; I114-L168 HydrophobicContact CD1-CD1 3.68Å; I114-L168 HydrophobicContact CG1-CD1 3.88Å
115	K	89.4	Confident	86.2	Confident	116 Å²	116	67.1 Å²	67.1	50%	0.504	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	138.6	176.2	-59	175.3	-175.4	172.7	0	108.2	T113 A139 F141	T113-K115 WeakPolarHBondContact OG1-CE 3.48Å; K115-A139 PolarHBondContact N-O 2.81Å; K115-A139 PolarHBondContact O-N 3.24Å; K115-F141 HydrophobicContact CB-CD2 3.98Å; K115-F141 HydrophobicContact CB-CE2 3.88Å; K115-F141 HydrophobicContact CD-CD2 4.11Å; K115-F141 HydrophobicContact CD-CE2 4.47Å; K115-F141 HydrophobicContact CG-CD2 4.2Å
116	L	88.8	Confident	86.3	Confident	67 Å²	67	65.9 Å²	65.9	35%	0.351	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	127.6	167.5	-81.9	70.7	0	0	0	107.5	Q44 S118 E137 V138	Q44-L116 HydrophobicContact CB-CD1 4.27Å; Q44-L116 HydrophobicContact CG-CD1 3.92Å; L116-S118 PolarHBondContact O-N 3.32Å; L116-E137 WeakPolarHBondContact CA-O 3.36Å; L116-V138 HydrophobicContact CD1-CG1 3.72Å; L116-V138 HydrophobicContact CG-CG1 3.97Å
117	L	86	Confident	86.4	Confident	15 Å²	15	64.7 Å²	64.7	8%	0.079	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-65.3	130.9	175.5	-70.3	173.1	0	0	0	109.6	R119 A124 V133 G136 E137 A139 F141	L117-R119 PolarHBondContact O-N 3.12Å; L117-A124 HydrophobicContact CD1-CB 3.7Å; L117-A124 HydrophobicContact CD2-CB 4.14Å; L117-V133 HydrophobicContact CD1-CB 3.54Å; L117-V133 HydrophobicContact CD1-CG1 3.45Å; L117-V133 VanDerWaalsContact CD1-CG1 3.45Å; L117-G136 WeakPolarHBondContact O-CA 3.31Å; L117-G136 PolarHBondContact O-N 3.29Å; L117-E137 PolarHBondContact N-O 3.3Å; L117-A139 HydrophobicContact CD1-CB 4.19Å; L117-A139 HydrophobicContact CD2-CB 4.42Å; L117-A139 HydrophobicContact CG-CB 4.07Å; L117-F141 HydrophobicContact CD2-CE2 4.2Å; L117-F141 HydrophobicContact CD2-CZ 3.74Å
118	S	83	Confident	86.5	Confident	74 Å²	74	62.8 Å²	62.8	52%	0.517	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-61.5	140.2	171.9	174.8	0	0	0	0	110	L116 A120 V121	L116-S118 PolarHBondContact O-N 3.32Å; S118-A120 PolarHBondContact O-N 3.37Å; S118-A120 PolarHBondContact OG-N 2.93Å; S118-V121 WeakPolarHBondContact O-CB 3.36Å; S118-V121 PolarHBondContact O-N 3.23Å
119	R	80	Confident	86.5	Confident	211 Å²	211	65.5 Å²	65.5	80%	0.796	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-10.7	176.2	-69.9	178.1	178.7	-97.3	-0.1	113.8	L117	L117-R119 PolarHBondContact O-N 3.12Å
120	A	74.6	Confident	86.4	Confident	78 Å²	78	68 Å²	68	65%	0.645	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-15.2	171.9	0	0	0	0	0	114.1	S118 M122	S118-A120 PolarHBondContact O-N 3.37Å; S118-A120 PolarHBondContact OG-N 2.93Å; A120-M122 PolarHBondContact O-N 3.42Å
121	V	72.4	Confident	86.4	Confident	62 Å²	62	71.6 Å²	71.6	38%	0.376	39%	0.389	S	S	.	.			trans	-81.4	107.3	178.8	-179.6	0	0	0	0	109.1	S118 A124	S118-V121 WeakPolarHBondContact O-CB 3.36Å; S118-V121 PolarHBondContact O-N 3.23Å; V121-A124 HydrophobicContact CG1-CB 4.05Å
122	M	61.2	Low	86.3	Confident	151 Å²	151	76.3 Å²	76.3	74%	0.744	41%	0.41	S	S	*	.			trans	-93.1	-10.3	-175.8	-62	-165.4	179.2	0	0	114.6	A120	A120-M122 PolarHBondContact O-N 3.42Å
123	H	69.6	Low	86.2	Confident	153 Å²	153	76.4 Å²	76.4	71%	0.708	41%	0.41	S	S	*	.			trans	-136.4	28.6	-165	-58.3	-29.1	0	0	0	114.4
124	A	87.1	Confident	85.9	Confident	12 Å²	12	78.6 Å²	78.6	10%	0.099	42%	0.42	C	S	.	.			trans	-69	133.7	166.2	0	0	0	0	0	109.9	L117 V121 K132 V133	L117-A124 HydrophobicContact CD1-CB 3.7Å; L117-A124 HydrophobicContact CD2-CB 4.14Å; V121-A124 HydrophobicContact CG1-CB 4.05Å; A124-K132 VanDerWaalsContact O-CA 3.31Å; A124-K132 WeakPolarHBondContact O-CA 3.48Å; A124-V133 HydrophobicContact CB-CB 4.2Å; A124-V133 PolarHBondContact O-N 3.08Å
125	V	91.9	Very high	85.5	Confident	68 Å²	68	79 Å²	79	41%	0.412	43%	0.429	S	S	.	.	B	Isolated β-bridge	trans	-128.3	136.6	178.3	-179.4	0	0	0	0	108.3	K132 C150	V125-K132 HydrophobicContact CG2-CG 4.45Å; V125-C150 PolarHBondContact O-SG 2.87Å
126	C	94.1	Very high	85.2	Confident	0 Å²	0	75 Å²	75	0%	0	42%	0.42	C	S	.	.	B	Isolated β-bridge	trans	-81.8	119.9	176.6	171.5	0	0	0	0	110.8	Q128 C129 G130 T131 V133 C150 H152 C155	C126-Q128 VanDerWaalsContact C-N 3.31Å; C126-Q128 PolarHBondContact O-N 2.94Å; C126-C129 VanDerWaalsContact CB-SG 3.59Å; C126-C129 PolarHBondContact O-N 3.4Å; C126-C129 PolarHBondContact SG-SG 2.86Å; C126-G130 WeakPolarHBondContact O-CA 3.26Å; C126-G130 PolarHBondContact O-N 3.37Å; C126-T131 PolarHBondContact N-O 3.28Å; C126-V133 HydrophobicContact CB-CG2 3.97Å; C126-C150 WeakPolarHBondContact CA-O 3.35Å; C126-H152 WeakPolarHBondContact CB-CE1 3.46Å; C126-H152 VanDerWaalsContact CB-ND1 3.29Å; C126-H152 WeakPolarHBondContact CB-ND1 3.38Å; C126-H152 PolarHBondContact SG-ND1 3.21Å; C126-C155 VanDerWaalsContact SG-CB 3.57Å
127	E	94.3	Very high	85.2	Confident	123 Å²	123	75.4 Å²	75.4	58%	0.575	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-42.7	-174.4	-169	59.7	-152	0	0	113	C129 V149 C150 W151	E127-C129 PolarHBondContact O-N 2.89Å; E127-V149 HydrophobicContact CB-CG1 3.97Å; E127-V149 HydrophobicContact CG-CG1 4.1Å; E127-C150 PolarHBondContact N-O 3.2Å; E127-W151 HydrophobicContact CB-CZ2 3.99Å; E127-W151 HydrophobicContact CG-CZ2 4.25Å
128	Q	93.5	Very high	85.4	Confident	76 Å²	76	75.1 Å²	75.1	36%	0.355	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-23.1	-175.3	-179.3	65.3	12.4	0	0	114.7	C126 C155 V157	C126-Q128 VanDerWaalsContact C-N 3.31Å; C126-Q128 PolarHBondContact O-N 2.94Å; Q128-C155 HydrophobicContact CB-CB 4.08Å; Q128-C155 HydrophobicContact CG-CB 4.28Å; Q128-V157 HydrophobicContact CG-CG2 4.15Å
129	C	94.1	Very high	85.9	Confident	58 Å²	58	71.6 Å²	71.6	39%	0.392	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131	-5.8	-173.8	65.5	0	0	0	0	115.2	C126 E127 T131	C126-C129 VanDerWaalsContact CB-SG 3.59Å; C126-C129 PolarHBondContact O-N 3.4Å; C126-C129 PolarHBondContact SG-SG 2.86Å; E127-C129 PolarHBondContact O-N 2.89Å; C129-T131 PolarHBondContact O-N 3.13Å; C129-T131 VanDerWaalsContact O-N 3.07Å; C129-T131 PolarHBondContact SG-OG1 3.02Å
130	G	92.2	Very high	86.6	Confident	57 Å²	57	61.5 Å²	61.5	59%	0.588	36%	0.357	S	S	*	.			trans	67.4	1.1	178.3	0	0	0	0	0	115.5	C126	C126-G130 WeakPolarHBondContact O-CA 3.26Å; C126-G130 PolarHBondContact O-N 3.37Å
131	T	92.7	Very high	87.5	Confident	78 Å²	78	59.6 Å²	59.6	48%	0.479	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-84.5	153.2	176.7	64.8	0	0	0	0	111.3	C126 C129 H152	C126-T131 PolarHBondContact N-O 3.28Å; C129-T131 PolarHBondContact O-N 3.13Å; C129-T131 VanDerWaalsContact O-N 3.07Å; C129-T131 PolarHBondContact SG-OG1 3.02Å; T131-H152 PolarHBondContact OG1-CE1 2.75Å; T131-H152 VanDerWaalsContact OG1-CE1 3.29Å
132	K	91.2	Very high	88.5	Confident	136 Å²	136	56.7 Å²	56.7	59%	0.591	32%	0.317	S	S	*	.	B	Isolated β-bridge	trans	-73.9	135.7	178.3	-63.4	179	-178.1	178.6	0	110.1	A124 V125	A124-K132 VanDerWaalsContact O-CA 3.31Å; A124-K132 WeakPolarHBondContact O-CA 3.48Å; V125-K132 HydrophobicContact CG2-CG 4.45Å
133	V	90.1	Very high	89.8	Confident	4 Å²	4	52 Å²	52	2%	0.024	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-91.8	128.7	169.9	-159.2	0	0	0	0	107.6	L117 A124 C126 E137 A139	L117-V133 HydrophobicContact CD1-CB 3.54Å; L117-V133 HydrophobicContact CD1-CG1 3.45Å; L117-V133 VanDerWaalsContact CD1-CG1 3.45Å; A124-V133 HydrophobicContact CB-CB 4.2Å; A124-V133 PolarHBondContact O-N 3.08Å; C126-V133 HydrophobicContact CB-CG2 3.97Å; V133-E137 HydrophobicContact CG1-CB 4.2Å; V133-A139 HydrophobicContact CG1-CB 4.39Å
134	N	86	Confident	90.9	Very high	93 Å²	93	47.5 Å²	47.5	50%	0.497	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-83	145.6	-171.6	-55.4	-70.9	0	0	0	112.2	G136 E137	N134-G136 PolarHBondContact O-N 3.24Å; N134-G136 VanDerWaalsContact O-N 3.11Å; N134-E137 HydrophobicContact CB-CG 4.17Å; N134-E137 WeakPolarHBondContact CB-OE1 3.32Å; N134-E137 PolarHBondContact N-OE2 3.46Å; N134-E137 PolarHBondContact ND2-OE1 2.83Å; N134-E137 PolarHBondContact ND2-OE2 3.41Å; N134-E137 WeakPolarHBondContact O-CB 3.29Å; N134-E137 PolarHBondContact O-N 3.07Å
135	G	83.9	Confident	91	Very high	26 Å²	26	47.7 Å²	47.7	27%	0.268	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	115.6	173.8	0	0	0	0	0	111.4
136	G	83.1	Confident	90.8	Very high	32 Å²	32	45.6 Å²	45.6	33%	0.33	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	112.3	-12.7	-173.1	0	0	0	0	0	114.6	L117 N134	L117-G136 WeakPolarHBondContact O-CA 3.31Å; L117-G136 PolarHBondContact O-N 3.29Å; N134-G136 PolarHBondContact O-N 3.24Å; N134-G136 VanDerWaalsContact O-N 3.11Å
137	E	87.4	Confident	90.1	Very high	76 Å²	76	52.7 Å²	52.7	36%	0.355	32%	0.315	S	S	.	.	S	Bend	trans	-82.7	161.8	174.8	-67.9	170.6	177.7	0	0	112	L116 L117 V133 N134	L116-E137 WeakPolarHBondContact CA-O 3.36Å; L117-E137 PolarHBondContact N-O 3.3Å; V133-E137 HydrophobicContact CG1-CB 4.2Å; N134-E137 HydrophobicContact CB-CG 4.17Å; N134-E137 WeakPolarHBondContact CB-OE1 3.32Å; N134-E137 PolarHBondContact N-OE2 3.46Å; N134-E137 PolarHBondContact ND2-OE1 2.83Å; N134-E137 PolarHBondContact ND2-OE2 3.41Å; N134-E137 WeakPolarHBondContact O-CB 3.29Å; N134-E137 PolarHBondContact O-N 3.07Å
138	V	91.3	Very high	89.5	Confident	9 Å²	9	49.6 Å²	49.6	6%	0.055	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	130.6	172.1	-77.4	0	0	0	0	110.4	L47 I114 L116 P153	L47-V138 HydrophobicContact CB-CG1 4.24Å; I114-V138 HydrophobicContact CG2-CB 4.36Å; I114-V138 HydrophobicContact CG2-CG1 4.38Å; L116-V138 HydrophobicContact CD1-CG1 3.72Å; L116-V138 HydrophobicContact CG-CG1 3.97Å; V138-P153 HydrophobicContact CG2-CG 3.89Å; V138-P153 WeakPolarHBondContact O-CD 3.48Å
139	A	93.1	Very high	89.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	143.7	173.8	0	0	0	0	0	110.8	I114 K115 L117 V133 F141 C150 W151	I114-A139 WeakPolarHBondContact CA-O 3.26Å; K115-A139 PolarHBondContact N-O 2.81Å; K115-A139 PolarHBondContact O-N 3.24Å; L117-A139 HydrophobicContact CD1-CB 4.19Å; L117-A139 HydrophobicContact CD2-CB 4.42Å; L117-A139 HydrophobicContact CG-CB 4.07Å; V133-A139 HydrophobicContact CG1-CB 4.39Å; A139-F141 HydrophobicContact CB-CD2 4.43Å; A139-F141 HydrophobicContact CB-CE2 3.84Å; A139-F141 HydrophobicContact CB-CZ 4.43Å; A139-C150 HydrophobicContact CB-CB 4.34Å; A139-W151 WeakPolarHBondContact CA-O 3.42Å
140	V	94.4	Very high	89.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	135	168.6	-170.8	0	0	0	0	108.3	I114 C150 W151 F156 L168	I114-V140 HydrophobicContact CG1-CG2 4.17Å; V140-C150 CarbonylContact O-C 3.55Å; V140-C150 VanDerWaalsContact O-CA 3.27Å; V140-C150 WeakPolarHBondContact O-CA 3.38Å; V140-W151 HydrophobicContact CB-CB 4.48Å; V140-W151 PolarHBondContact N-O 3.07Å; V140-W151 PolarHBondContact O-N 3.24Å; V140-F156 HydrophobicContact CB-CB 4.44Å; V140-F156 HydrophobicContact CB-CD2 4.08Å; V140-F156 HydrophobicContact CB-CG 4.19Å; V140-F156 HydrophobicContact CG1-CD1 4.01Å; V140-F156 HydrophobicContact CG1-CD2 3.72Å; V140-F156 HydrophobicContact CG1-CE1 4.1Å; V140-F156 HydrophobicContact CG1-CE2 3.81Å; V140-F156 HydrophobicContact CG1-CG 3.83Å; V140-F156 HydrophobicContact CG1-CZ 4Å; V140-F156 HydrophobicContact CG2-CB 4.22Å; V140-F156 HydrophobicContact CG2-CG 4.36Å; V140-L168 HydrophobicContact CG1-CD2 4.14Å; V140-L168 HydrophobicContact CG2-CD2 4.21Å
141	F	93.4	Very high	89.5	Confident	37 Å²	37	42.8 Å²	42.8	16%	0.162	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	137.8	175	-71.9	-93.9	0	0	0	110.3	G112 T113 K115 L117 A139 V149 C150	G112-F141 CarbonylContact C-O 3.6Å; G112-F141 WeakPolarHBondContact CA-O 3.47Å; T113-F141 PolarHBondContact N-O 3.09Å; T113-F141 PolarHBondContact O-N 3.46Å; K115-F141 HydrophobicContact CB-CD2 3.98Å; K115-F141 HydrophobicContact CB-CE2 3.88Å; K115-F141 HydrophobicContact CD-CD2 4.11Å; K115-F141 HydrophobicContact CD-CE2 4.47Å; K115-F141 HydrophobicContact CG-CD2 4.2Å; L117-F141 HydrophobicContact CD2-CE2 4.2Å; L117-F141 HydrophobicContact CD2-CZ 3.74Å; A139-F141 HydrophobicContact CB-CD2 4.43Å; A139-F141 HydrophobicContact CB-CE2 3.84Å; A139-F141 HydrophobicContact CB-CZ 4.43Å; F141-V149 WeakPolarHBondContact CD1-O 3.41Å; F141-C150 HydrophobicContact CD1-CB 3.89Å; F141-C150 HydrophobicContact CE1-CB 3.64Å; F141-C150 HydrophobicContact CE2-CB 4.39Å; F141-C150 HydrophobicContact CG-CB 4.39Å; F141-C150 HydrophobicContact CZ-CB 3.92Å
142	A	93.3	Very high	89.6	Confident	2 Å²	2	40.5 Å²	40.5	2%	0.017	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	110.7	177.9	0	0	0	0	0	109.6	R144 A145 W151 F156 Y170	A142-R144 VanDerWaalsContact C-N 3.32Å; A142-R144 PolarHBondContact O-N 2.89Å; A142-A145 HydrophobicContact CB-CB 4.1Å; A142-A145 WeakPolarHBondContact O-CB 3.42Å; A142-A145 PolarHBondContact O-N 3.33Å; A142-W151 HydrophobicContact CB-CE3 4.41Å; A142-W151 HydrophobicContact CB-CH2 3.8Å; A142-W151 HydrophobicContact CB-CZ3 3.48Å; A142-W151 VanDerWaalsContact CB-CZ3 3.48Å; A142-F156 HydrophobicContact CB-CE2 4.38Å; A142-Y170 HydrophobicContact CB-CD1 4.47Å; A142-Y170 HydrophobicContact CB-CE1 3.76Å; A142-Y170 HydrophobicContact CB-CE2 4.05Å
143	S	89.8	Confident	89.7	Confident	51 Å²	51	34.2 Å²	34.2	36%	0.357	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-47.7	-49.5	179.9	44.6	0	0	0	0	113.2	A145 G146 Y170	S143-A145 VanDerWaalsContact C-N 3.25Å; S143-A145 PolarHBondContact O-N 3.41Å; S143-G146 PolarHBondContact O-N 3.42Å; S143-Y170 PolarHBondContact N-OH 2.92Å; S143-Y170 PolarHBondContact OG-OH 3.15Å
144	R	91.2	Very high	89.9	Confident	59 Å²	59	36.8 Å²	36.8	22%	0.223	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-65.8	-20.8	-178.8	-64.4	-171.8	171.7	-86.5	-2.1	115.3	K106 E107 A108 L109 A142 G146 Y170 Y172 W408	K106-R144 PolarHBondContact O-NH2 2.81Å; E107-R144 VanDerWaalsContact C-NH1 3.25Å; E107-R144 PolarHBondContact O-NH1 3.16Å; A108-R144 WeakPolarHBondContact O-CD 3.47Å; A108-R144 PolarHBondContact O-NE 3.45Å; L109-R144 PolarHBondContact O-NE 2.91Å; L109-R144 PolarHBondContact O-NH2 3.41Å; A142-R144 VanDerWaalsContact C-N 3.32Å; A142-R144 PolarHBondContact O-N 2.89Å; R144-G146 PolarHBondContact O-N 3.47Å; R144-Y170 HydrophobicContact CB-CE2 4.11Å; R144-Y170 HydrophobicContact CG-CE2 4.41Å; R144-Y170 PolarHBondContact N-OH 3.18Å; R144-Y170 VanDerWaalsContact N-OH 3.16Å; R144-Y172 HydrophobicContact CB-CD1 3.9Å; R144-Y172 HydrophobicContact CB-CG 4.09Å; R144-Y172 WeakPolarHBondContact O-CD1 3.38Å; R144-Y172 WeakPolarHBondContact O-CE1 3.33Å; R144-W408 HydrophobicContact CG-CH2 3.54Å; R144-W408 HydrophobicContact CG-CZ3 3.79Å; R144-W408 VanDerWaalsContact NE-CZ3 3.3Å
145	A	90.4	Very high	90.4	Very high	16 Å²	16	33.4 Å²	33.4	13%	0.132	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-78	-11.4	176	0	0	0	0	0	112.8	A142 S143 V149 W151 Y172	A142-A145 HydrophobicContact CB-CB 4.1Å; A142-A145 WeakPolarHBondContact O-CB 3.42Å; A142-A145 PolarHBondContact O-N 3.33Å; S143-A145 VanDerWaalsContact C-N 3.25Å; S143-A145 PolarHBondContact O-N 3.41Å; A145-V149 HydrophobicContact CB-CB 3.94Å; A145-V149 HydrophobicContact CB-CG1 4.1Å; A145-V149 HydrophobicContact CB-CG2 4.26Å; A145-V149 VanDerWaalsContact O-CG2 3.3Å; A145-V149 WeakPolarHBondContact O-CG2 3.22Å; A145-W151 HydrophobicContact CB-CH2 3.68Å; A145-W151 HydrophobicContact CB-CZ3 4.4Å; A145-Y172 HydrophobicContact CB-CD2 4.32Å; A145-Y172 HydrophobicContact CB-CE2 3.83Å
146	G	86.3	Confident	91	Very high	25 Å²	25	32.3 Å²	32.3	26%	0.258	21%	0.212	S	C	.	.			trans	102.1	158.7	179.2	0	0	0	0	0	113.4	S143 R144 G148 V149	S143-G146 PolarHBondContact O-N 3.42Å; R144-G146 PolarHBondContact O-N 3.47Å; G146-G148 PolarHBondContact O-N 2.63Å; G146-G148 VanDerWaalsContact O-N 3.13Å; G146-V149 PolarHBondContact O-N 2.87Å
147	P	80.8	Confident	91.7	Very high	149 Å²	149	31.5 Å²	31.5	97%	0.968	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	114.8	-174.7	25.9	-34.4	0	0	0	111.4
148	G	81.3	Confident	92.2	Very high	57 Å²	57	27.9 Å²	27.9	59%	0.588	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	109.7	-13.7	175.2	0	0	0	0	0	115.4	G146 C150	G146-G148 PolarHBondContact O-N 2.63Å; G146-G148 VanDerWaalsContact O-N 3.13Å; G148-C150 PolarHBondContact O-N 3.31Å
149	V	91.3	Very high	92.4	Very high	39 Å²	39	32 Å²	32	24%	0.236	20%	0.201	C	C	.	.			trans	-71.1	129.2	173.9	-168.9	0	0	0	0	109.5	E127 F141 A145 G146 W151	E127-V149 HydrophobicContact CB-CG1 3.97Å; E127-V149 HydrophobicContact CG-CG1 4.1Å; F141-V149 WeakPolarHBondContact CD1-O 3.41Å; A145-V149 HydrophobicContact CB-CB 3.94Å; A145-V149 HydrophobicContact CB-CG1 4.1Å; A145-V149 HydrophobicContact CB-CG2 4.26Å; A145-V149 VanDerWaalsContact O-CG2 3.3Å; A145-V149 WeakPolarHBondContact O-CG2 3.22Å; G146-V149 PolarHBondContact O-N 2.87Å; V149-W151 HydrophobicContact CB-CH2 4.19Å; V149-W151 HydrophobicContact CB-CZ3 4.32Å; V149-W151 HydrophobicContact CG1-CH2 3.43Å; V149-W151 VanDerWaalsContact CG1-CH2 3.43Å; V149-W151 HydrophobicContact CG1-CZ2 3.95Å; V149-W151 HydrophobicContact CG1-CZ3 3.87Å
150	C	93.3	Very high	92.6	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.007	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	162.3	-172.1	80	0	0	0	0	113.6	V125 C126 E127 A139 V140 F141 G148	V125-C150 PolarHBondContact O-SG 2.87Å; C126-C150 WeakPolarHBondContact CA-O 3.35Å; E127-C150 PolarHBondContact N-O 3.2Å; A139-C150 HydrophobicContact CB-CB 4.34Å; V140-C150 CarbonylContact O-C 3.55Å; V140-C150 VanDerWaalsContact O-CA 3.27Å; V140-C150 WeakPolarHBondContact O-CA 3.38Å; F141-C150 HydrophobicContact CD1-CB 3.89Å; F141-C150 HydrophobicContact CE1-CB 3.64Å; F141-C150 HydrophobicContact CE2-CB 4.39Å; F141-C150 HydrophobicContact CG-CB 4.39Å; F141-C150 HydrophobicContact CZ-CB 3.92Å; G148-C150 PolarHBondContact O-N 3.31Å
151	W	95.1	Very high	92.7	Very high	8 Å²	8	37.1 Å²	37.1	3%	0.03	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	147	177.5	-63.4	-105.4	0	0	0	111.1	E127 A139 V140 A142 A145 V149 C155 F156 I177	E127-W151 HydrophobicContact CB-CZ2 3.99Å; E127-W151 HydrophobicContact CG-CZ2 4.25Å; A139-W151 WeakPolarHBondContact CA-O 3.42Å; V140-W151 HydrophobicContact CB-CB 4.48Å; V140-W151 PolarHBondContact N-O 3.07Å; V140-W151 PolarHBondContact O-N 3.24Å; A142-W151 HydrophobicContact CB-CE3 4.41Å; A142-W151 HydrophobicContact CB-CH2 3.8Å; A142-W151 HydrophobicContact CB-CZ3 3.48Å; A142-W151 VanDerWaalsContact CB-CZ3 3.48Å; A145-W151 HydrophobicContact CB-CH2 3.68Å; A145-W151 HydrophobicContact CB-CZ3 4.4Å; V149-W151 HydrophobicContact CB-CH2 4.19Å; V149-W151 HydrophobicContact CB-CZ3 4.32Å; V149-W151 HydrophobicContact CG1-CH2 3.43Å; V149-W151 VanDerWaalsContact CG1-CH2 3.43Å; V149-W151 HydrophobicContact CG1-CZ2 3.95Å; V149-W151 HydrophobicContact CG1-CZ3 3.87Å; W151-C155 HydrophobicContact CB-CB 4.49Å; W151-F156 HydrophobicContact CB-CB 4.26Å; W151-F156 HydrophobicContact CB-CD2 3.94Å; W151-F156 AromaticContact CD2-CD2 3.8Å; W151-F156 HydrophobicContact CD2-CD2 3.8Å; W151-F156 HydrophobicContact CD2-CE2 4.09Å; W151-F156 HydrophobicContact CE3-CD2 4.01Å; W151-F156 AromaticContact CE3-CE2 3.94Å; W151-F156 HydrophobicContact CE3-CE2 3.94Å; W151-F156 AromaticContact CG-CD2 3.77Å; W151-F156 HydrophobicContact CG-CD2 3.77Å; W151-F156 HydrophobicContact CZ3-CE2 4.4Å; W151-I177 HydrophobicContact CD2-CD1 4.34Å; W151-I177 HydrophobicContact CZ2-CD1 4.03Å; W151-I177 HydrophobicContact CZ2-CG2 4.3Å
152	H	94.6	Very high	92.8	Very high	30 Å²	30	40.1 Å²	40.1	14%	0.139	25%	0.251	C	S	.	.			trans	-61.4	149.3	157.7	-54.6	103.4	0	0	0	109.3	C126 T131 S154 C155 F156	C126-H152 WeakPolarHBondContact CB-CE1 3.46Å; C126-H152 VanDerWaalsContact CB-ND1 3.29Å; C126-H152 WeakPolarHBondContact CB-ND1 3.38Å; C126-H152 PolarHBondContact SG-ND1 3.21Å; T131-H152 PolarHBondContact OG1-CE1 2.75Å; T131-H152 VanDerWaalsContact OG1-CE1 3.29Å; H152-S154 VanDerWaalsContact C-N 3.27Å; H152-S154 PolarHBondContact O-N 2.84Å; H152-C155 HydrophobicContact CB-CB 4.02Å; H152-C155 CarbonylContact O-C 3.58Å; H152-C155 WeakPolarHBondContact O-CA 3.47Å; H152-C155 WeakPolarHBondContact O-CB 3.33Å; H152-C155 PolarHBondContact O-N 3.17Å; H152-F156 PolarHBondContact O-N 3.07Å
153	P	94.4	Very high	93	Very high	4 Å²	4	42.3 Å²	42.3	3%	0.026	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-49.1	-44.7	174.6	-32.9	38.8	0	0	0	114.1	Y48 C51 L52 V138 C155 F156 L164	Y48-P153 HydrophobicContact CD2-CB 3.81Å; Y48-P153 HydrophobicContact CD2-CG 3.78Å; Y48-P153 HydrophobicContact CE2-CB 3.62Å; Y48-P153 HydrophobicContact CE2-CG 4.03Å; C51-P153 HydrophobicContact CB-CB 3.74Å; C51-P153 HydrophobicContact CB-CG 3.76Å; L52-P153 HydrophobicContact CD2-CB 3.83Å; V138-P153 HydrophobicContact CG2-CG 3.89Å; V138-P153 WeakPolarHBondContact O-CD 3.48Å; P153-C155 PolarHBondContact O-N 3.4Å; P153-F156 PolarHBondContact O-N 3.15Å; P153-L164 WeakPolarHBondContact O-CD2 3.33Å
154	S	94.6	Very high	93.3	Very high	59 Å²	59	41.4 Å²	41.4	41%	0.413	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-71.2	-14.4	177	49	0	0	0	0	114.7	C51 H152	C51-S154 WeakPolarHBondContact O-CB 3.5Å; H152-S154 VanDerWaalsContact C-N 3.27Å; H152-S154 PolarHBondContact O-N 2.84Å
155	C	95.6	Very high	93.5	Very high	21 Å²	21	38.9 Å²	38.9	14%	0.142	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-100.8	-2.8	179.5	-66.1	0	0	0	0	113.2	C126 Q128 W151 H152 P153 V157	C126-C155 VanDerWaalsContact SG-CB 3.57Å; Q128-C155 HydrophobicContact CB-CB 4.08Å; Q128-C155 HydrophobicContact CG-CB 4.28Å; W151-C155 HydrophobicContact CB-CB 4.49Å; H152-C155 HydrophobicContact CB-CB 4.02Å; H152-C155 CarbonylContact O-C 3.58Å; H152-C155 WeakPolarHBondContact O-CA 3.47Å; H152-C155 WeakPolarHBondContact O-CB 3.33Å; H152-C155 PolarHBondContact O-N 3.17Å; P153-C155 PolarHBondContact O-N 3.4Å; C155-V157 PolarHBondContact O-N 3.42Å
156	F	96.6	Very high	93.6	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.018	24%	0.24	C	C	.	.			trans	-82.1	69.1	177.6	-159.8	-111.3	0	0	0	110.7	V140 A142 W151 H152 P153 L165 L168 Y170 I177	V140-F156 HydrophobicContact CB-CB 4.44Å; V140-F156 HydrophobicContact CB-CD2 4.08Å; V140-F156 HydrophobicContact CB-CG 4.19Å; V140-F156 HydrophobicContact CG1-CD1 4.01Å; V140-F156 HydrophobicContact CG1-CD2 3.72Å; V140-F156 HydrophobicContact CG1-CE1 4.1Å; V140-F156 HydrophobicContact CG1-CE2 3.81Å; V140-F156 HydrophobicContact CG1-CG 3.83Å; V140-F156 HydrophobicContact CG1-CZ 4Å; V140-F156 HydrophobicContact CG2-CB 4.22Å; V140-F156 HydrophobicContact CG2-CG 4.36Å; A142-F156 HydrophobicContact CB-CE2 4.38Å; W151-F156 HydrophobicContact CB-CB 4.26Å; W151-F156 HydrophobicContact CB-CD2 3.94Å; W151-F156 AromaticContact CD2-CD2 3.8Å; W151-F156 HydrophobicContact CD2-CD2 3.8Å; W151-F156 HydrophobicContact CD2-CE2 4.09Å; W151-F156 HydrophobicContact CE3-CD2 4.01Å; W151-F156 AromaticContact CE3-CE2 3.94Å; W151-F156 HydrophobicContact CE3-CE2 3.94Å; W151-F156 AromaticContact CG-CD2 3.77Å; W151-F156 HydrophobicContact CG-CD2 3.77Å; W151-F156 HydrophobicContact CZ3-CE2 4.4Å; H152-F156 PolarHBondContact O-N 3.07Å; P153-F156 PolarHBondContact O-N 3.15Å; F156-L165 HydrophobicContact CD1-CB 3.8Å; F156-L165 HydrophobicContact CD1-CD1 3.88Å; F156-L165 HydrophobicContact CD1-CG 4.44Å; F156-L165 HydrophobicContact CE1-CB 3.89Å; F156-L165 HydrophobicContact CE1-CD1 3.77Å; F156-L165 HydrophobicContact CE1-CG 4.48Å; F156-L165 HydrophobicContact CE2-CD1 4.5Å; F156-L165 HydrophobicContact CG-CD1 4.29Å; F156-L165 HydrophobicContact CZ-CD1 4.1Å; F156-L165 PolarHBondContact O-N 2.82Å; F156-L168 HydrophobicContact CD1-CD2 3.87Å; F156-L168 HydrophobicContact CE1-CB 4.3Å; F156-L168 HydrophobicContact CE1-CD2 4.26Å; F156-Y170 HydrophobicContact CE1-CD1 4.31Å; F156-Y170 AromaticContact CZ-CD1 3.64Å; F156-Y170 HydrophobicContact CZ-CD1 3.64Å; F156-Y170 HydrophobicContact CZ-CE1 4.38Å; F156-Y170 HydrophobicContact CZ-CG 4.06Å; F156-I177 HydrophobicContact CD2-CD1 3.7Å; F156-I177 HydrophobicContact CE2-CD1 3.67Å; F156-I177 HydrophobicContact CG-CD1 4.44Å; F156-I177 HydrophobicContact CZ-CD1 4.38Å
157	V	97	Very high	94	Very high	14 Å²	14	37.7 Å²	37.7	9%	0.085	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-113.3	152.1	-173.3	-62.9	0	0	0	0	112.3	Q128 C155 F159 E163 L164	Q128-V157 HydrophobicContact CG-CG2 4.15Å; C155-V157 PolarHBondContact O-N 3.42Å; V157-F159 PolarHBondContact O-N 3.29Å; V157-E163 CarbonylContact C-O 3.44Å; V157-E163 VanDerWaalsContact CA-O 3.22Å; V157-E163 WeakPolarHBondContact CA-O 3.46Å; V157-E163 WeakPolarHBondContact CB-O 3.48Å; V157-L164 HydrophobicContact CG1-CD2 3.86Å; V157-L164 HydrophobicContact CG1-CG 4.39Å
158	C	97.6	Very high	94.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.183	C	C	.	.			trans	-67.6	126.5	170.8	170.3	0	0	0	0	110.6	T160 C161 N162 E163 L165 C179	C158-T160 PolarHBondContact O-N 2.91Å; C158-T160 VanDerWaalsContact O-N 3.09Å; C158-C161 PolarHBondContact O-N 3.04Å; C158-C161 VanDerWaalsContact SG-SG 3.64Å; C158-N162 VanDerWaalsContact O-CA 3.27Å; C158-N162 WeakPolarHBondContact O-CA 3.39Å; C158-N162 PolarHBondContact O-N 3.45Å; C158-E163 PolarHBondContact N-O 3.27Å; C158-L165 HydrophobicContact CB-CD2 3.88Å; C158-L165 HydrophobicContact CB-CG 4.46Å; C158-C179 HydrophobicContact CB-CB 4.09Å; C158-C179 PolarHBondContact SG-N 2.98Å
159	F	97.1	Very high	95.2	Very high	95 Å²	95	28.2 Å²	28.2	42%	0.417	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-32.4	-179.9	-178.2	-91.4	0	0	0	114.2	V157 K176 I177 H178	V157-F159 PolarHBondContact O-N 3.29Å; F159-K176 HydrophobicContact CB-CB 4.37Å; F159-K176 HydrophobicContact CD1-CD 3.94Å; F159-K176 HydrophobicContact CD2-CD 3.86Å; F159-K176 HydrophobicContact CD2-CG 4.07Å; F159-K176 HydrophobicContact CE1-CD 3.99Å; F159-K176 HydrophobicContact CE2-CD 3.91Å; F159-K176 HydrophobicContact CE2-CG 4.4Å; F159-K176 HydrophobicContact CG-CB 4.42Å; F159-K176 HydrophobicContact CG-CD 3.89Å; F159-K176 HydrophobicContact CG-CG 4.3Å; F159-K176 HydrophobicContact CZ-CD 3.98Å; F159-I177 PolarHBondContact N-O 3.2Å; F159-H178 AromaticContact CD1-CE1 3.83Å
160	T	96.8	Very high	95.4	Very high	69 Å²	69	26.4 Å²	26.4	42%	0.423	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-45.9	-174.9	-44.9	0	0	0	0	113.4	C158 H178 H182	C158-T160 PolarHBondContact O-N 2.91Å; C158-T160 VanDerWaalsContact O-N 3.09Å; T160-H178 PolarHBondContact OG1-ND1 3.43Å; T160-H182 HydrophobicContact CG2-CB 4.3Å; T160-H182 VanDerWaalsContact CG2-CD2 3.44Å; T160-H182 WeakPolarHBondContact CG2-CD2 3.36Å
161	C	95.9	Very high	95.6	Very high	40 Å²	40	26.5 Å²	26.5	27%	0.27	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-9.7	-176.7	57	0	0	0	0	114.8	C158 E163 H182	C158-C161 PolarHBondContact O-N 3.04Å; C158-C161 VanDerWaalsContact SG-SG 3.64Å; C161-E163 PolarHBondContact O-N 3.25Å; C161-H182 VanDerWaalsContact CB-CE1 3.48Å; C161-H182 WeakPolarHBondContact CB-CE1 3.31Å; C161-H182 VanDerWaalsContact SG-CE1 3.51Å
162	N	96	Very high	95.6	Very high	100 Å²	100	29.2 Å²	29.2	54%	0.535	16%	0.156	S	C	.	.			trans	57.9	20.4	-176	-56.6	-85.1	0	0	0	114.5	C158	C158-N162 VanDerWaalsContact O-CA 3.27Å; C158-N162 WeakPolarHBondContact O-CA 3.39Å; C158-N162 PolarHBondContact O-N 3.45Å
163	E	96.7	Very high	95.6	Very high	48 Å²	48	30.8 Å²	30.8	22%	0.224	16%	0.164	C	C	.	.			trans	-89.2	150.2	171	-86.7	-65.2	174.3	0	0	112	K56 V157 C158 C161	K56-E163 IonicContact NZ-OE1 3.22Å; K56-E163 PolarHBondContact NZ-OE1 3.24Å; K56-E163 IonicContact NZ-OE2 3.44Å; K56-E163 PolarHBondContact NZ-OE2 3.05Å; V157-E163 CarbonylContact C-O 3.44Å; V157-E163 VanDerWaalsContact CA-O 3.22Å; V157-E163 WeakPolarHBondContact CA-O 3.46Å; V157-E163 WeakPolarHBondContact CB-O 3.48Å; C158-E163 PolarHBondContact N-O 3.27Å; C161-E163 PolarHBondContact O-N 3.25Å
164	L	96.1	Very high	95.5	Very high	31 Å²	31	37 Å²	37	16%	0.162	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-61.1	134.4	179.7	-69.9	170.1	0	0	0	110.5	L52 K56 Q75 P153 V157 V166	L52-L164 HydrophobicContact CD2-CD1 4.06Å; L52-L164 HydrophobicContact CD2-CD2 4.37Å; K56-L164 HydrophobicContact CD-CD1 3.96Å; Q75-L164 PolarHBondContact NE2-O 3.29Å; Q75-L164 PolarHBondContact OE1-O 3.02Å; P153-L164 WeakPolarHBondContact O-CD2 3.33Å; V157-L164 HydrophobicContact CG1-CD2 3.86Å; V157-L164 HydrophobicContact CG1-CG 4.39Å; L164-V166 PolarHBondContact O-N 3.36Å
165	L	96.4	Very high	95.3	Very high	7 Å²	7	36.4 Å²	36.4	4%	0.037	20%	0.2	C	C	.	.			trans	-71.1	111.6	-178.3	-72.5	160.1	0	0	0	110.2	F156 C158 D167 L168 I177 C179	F156-L165 HydrophobicContact CD1-CB 3.8Å; F156-L165 HydrophobicContact CD1-CD1 3.88Å; F156-L165 HydrophobicContact CD1-CG 4.44Å; F156-L165 HydrophobicContact CE1-CB 3.89Å; F156-L165 HydrophobicContact CE1-CD1 3.77Å; F156-L165 HydrophobicContact CE1-CG 4.48Å; F156-L165 HydrophobicContact CE2-CD1 4.5Å; F156-L165 HydrophobicContact CG-CD1 4.29Å; F156-L165 HydrophobicContact CZ-CD1 4.1Å; F156-L165 PolarHBondContact O-N 2.82Å; C158-L165 HydrophobicContact CB-CD2 3.88Å; C158-L165 HydrophobicContact CB-CG 4.46Å; L165-D167 PolarHBondContact O-N 2.79Å; L165-L168 PolarHBondContact O-N 2.79Å; L165-I177 HydrophobicContact CD1-CB 4.07Å; L165-I177 HydrophobicContact CD1-CD1 3.66Å; L165-I177 HydrophobicContact CD1-CG1 3.98Å; L165-C179 HydrophobicContact CD2-CB 3.84Å
166	V	93.1	Very high	95.3	Very high	9 Å²	9	39.5 Å²	39.5	6%	0.055	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-61.5	134.6	-171	66	0	0	0	0	111.6	R68 Q71 L72 Q75 L76 L164 L168 I169	R68-V166 HydrophobicContact CG-CG2 4.22Å; Q71-V166 HydrophobicContact CB-CB 4.31Å; Q71-V166 HydrophobicContact CB-CG2 4.32Å; L72-V166 HydrophobicContact CB-CG2 4.05Å; L72-V166 HydrophobicContact CD1-CG1 4.08Å; L72-V166 HydrophobicContact CD1-CG2 3.83Å; Q75-V166 HydrophobicContact CB-CG1 3.91Å; Q75-V166 HydrophobicContact CG-CG1 4.47Å; Q75-V166 VanDerWaalsContact OE1-N 3.14Å; L76-V166 HydrophobicContact CD1-CG1 3.8Å; L76-V166 HydrophobicContact CG-CG1 4.19Å; L164-V166 PolarHBondContact O-N 3.36Å; V166-L168 PolarHBondContact O-N 2.96Å; V166-I169 WeakPolarHBondContact O-CB 3.43Å; V166-I169 PolarHBondContact O-N 2.89Å
167	D	93.3	Very high	95.3	Very high	6 Å²	6	39.6 Å²	39.6	3%	0.032	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	51.5	22.9	-176.6	-63.9	10.4	0	0	0	115.1	W35 R68 L165 I169 Y414	W35-D167 VanDerWaalsContact CZ2-CA 3.41Å; W35-D167 HydrophobicContact CZ2-CB 3.8Å; W35-D167 VanDerWaalsContact NE1-CG 3.27Å; W35-D167 PolarHBondContact NE1-OD2 3.22Å; R68-D167 IonicContact CZ-OD1 2.97Å; R68-D167 IonicContact CZ-OD2 3.59Å; R68-D167 IonicContact NE-OD1 3.53Å; R68-D167 PolarHBondContact NE-OD1 3.22Å; R68-D167 IonicContact NE-OD2 3.5Å; R68-D167 IonicContact NH2-OD1 2.65Å; R68-D167 PolarHBondContact NH2-OD1 2.86Å; R68-D167 IonicContact NH2-OD2 3.84Å; R68-D167 PolarHBondContact NH2-OD2 3.42Å; L165-D167 PolarHBondContact O-N 2.79Å; D167-I169 HydrophobicContact CB-CD1 3.99Å; D167-I169 HydrophobicContact CB-CG1 4.34Å; D167-I169 PolarHBondContact O-N 3.46Å; D167-Y414 HydrophobicContact CB-CE1 4.4Å; D167-Y414 PolarHBondContact OD2-OH 3.35Å
168	L	94.1	Very high	95.3	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.016	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	63.2	16.8	-171.3	-52.8	168.7	0	0	0	114.4	W35 P37 R111 G112 I114 V140 F156 L165 V166	W35-L168 HydrophobicContact CH2-CD1 4.31Å; W35-L168 HydrophobicContact CH2-CG 4.14Å; P37-L168 HydrophobicContact CB-CD1 4.09Å; R111-L168 CarbonylContact C-O 3.59Å; R111-L168 WeakPolarHBondContact CA-O 3.27Å; G112-L168 PolarHBondContact N-O 3.43Å; G112-L168 VanDerWaalsContact O-CD1 3.27Å; G112-L168 WeakPolarHBondContact O-CD1 3.29Å; I114-L168 HydrophobicContact CD1-CD1 3.68Å; I114-L168 HydrophobicContact CG1-CD1 3.88Å; V140-L168 HydrophobicContact CG1-CD2 4.14Å; V140-L168 HydrophobicContact CG2-CD2 4.21Å; F156-L168 HydrophobicContact CD1-CD2 3.87Å; F156-L168 HydrophobicContact CE1-CB 4.3Å; F156-L168 HydrophobicContact CE1-CD2 4.26Å; L165-L168 PolarHBondContact O-N 2.79Å; V166-L168 PolarHBondContact O-N 2.96Å
169	I	94.1	Very high	95.3	Very high	5 Å²	5	39.5 Å²	39.5	3%	0.026	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	125.3	179.3	-64.8	163	0	0	0	109.4	L76 L109 V166 D167 Y414 M415 L418	L76-I169 HydrophobicContact CD1-CB 4.26Å; L76-I169 HydrophobicContact CD1-CD1 3.75Å; L76-I169 HydrophobicContact CD1-CG2 4.05Å; L76-I169 HydrophobicContact CD2-CG2 3.9Å; L109-I169 HydrophobicContact CD1-CG2 3.62Å; V166-I169 WeakPolarHBondContact O-CB 3.43Å; V166-I169 PolarHBondContact O-N 2.89Å; D167-I169 HydrophobicContact CB-CD1 3.99Å; D167-I169 HydrophobicContact CB-CG1 4.34Å; D167-I169 PolarHBondContact O-N 3.46Å; I169-Y414 HydrophobicContact CD1-CD1 4.34Å; I169-Y414 HydrophobicContact CD1-CE1 4.02Å; I169-M415 HydrophobicContact CD1-SD 3.83Å; I169-M415 HydrophobicContact CG2-SD 3.82Å; I169-L418 HydrophobicContact CD1-CD1 3.61Å
170	Y	95.7	Very high	95.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	157.7	-178.1	72.6	-90.7	0	0	0	111.3	L109 G110 R111 A142 S143 R144 F156 I177	L109-Y170 CarbonylContact C-O 3.57Å; L109-Y170 WeakPolarHBondContact CA-O 3.3Å; G110-Y170 VanDerWaalsContact C-CD1 3.49Å; G110-Y170 PolarHBondContact N-O 3.27Å; G110-Y170 VanDerWaalsContact O-CD1 3.25Å; G110-Y170 WeakPolarHBondContact O-CD1 3.47Å; G110-Y170 PolarHBondContact O-N 2.91Å; G110-Y170 VanDerWaalsContact O-O 3.11Å; R111-Y170 VanDerWaalsContact C-CE1 3.42Å; A142-Y170 HydrophobicContact CB-CD1 4.47Å; A142-Y170 HydrophobicContact CB-CE1 3.76Å; A142-Y170 HydrophobicContact CB-CE2 4.05Å; S143-Y170 PolarHBondContact N-OH 2.92Å; S143-Y170 PolarHBondContact OG-OH 3.15Å; R144-Y170 HydrophobicContact CB-CE2 4.11Å; R144-Y170 HydrophobicContact CG-CE2 4.41Å; R144-Y170 PolarHBondContact N-OH 3.18Å; R144-Y170 VanDerWaalsContact N-OH 3.16Å; F156-Y170 HydrophobicContact CE1-CD1 4.31Å; F156-Y170 AromaticContact CZ-CD1 3.64Å; F156-Y170 HydrophobicContact CZ-CD1 3.64Å; F156-Y170 HydrophobicContact CZ-CE1 4.38Å; F156-Y170 HydrophobicContact CZ-CG 4.06Å; Y170-I177 HydrophobicContact CD2-CG2 3.88Å; Y170-I177 HydrophobicContact CG-CG2 4.32Å
171	F	96.1	Very high	95.2	Very high	3 Å²	3	32.9 Å²	32.9	1%	0.013	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	126.3	166.3	-68.7	-108.9	0	0	0	108.4	L76 R104 A108 L109 H178 G180 H183	L76-F171 HydrophobicContact CD2-CE2 4.04Å; R104-F171 HydrophobicContact CB-CE1 4.12Å; A108-F171 HydrophobicContact CB-CB 4.28Å; A108-F171 HydrophobicContact CB-CD1 4.06Å; A108-F171 CarbonylContact O-C 3.59Å; A108-F171 VanDerWaalsContact O-CA 3.27Å; A108-F171 WeakPolarHBondContact O-CA 3.43Å; L109-F171 HydrophobicContact CB-CD1 4.17Å; L109-F171 HydrophobicContact CB-CE1 3.86Å; L109-F171 HydrophobicContact CB-CZ 4.15Å; L109-F171 HydrophobicContact CD1-CD2 4.36Å; L109-F171 HydrophobicContact CD1-CE1 4.42Å; L109-F171 HydrophobicContact CD1-CE2 3.83Å; L109-F171 HydrophobicContact CD1-CZ 3.88Å; F171-H178 PolarHBondContact N-O 2.84Å; F171-H178 PolarHBondContact O-N 3.28Å; F171-G180 VanDerWaalsContact CD2-CA 3.43Å; F171-H183 HydrophobicContact CB-CB 3.78Å; F171-H183 WeakPolarHBondContact CB-CD2 3.5Å; F171-H183 HydrophobicContact CD1-CB 4.41Å; F171-H183 HydrophobicContact CG-CB 4.08Å
172	Y	96.1	Very high	95.2	Very high	65 Å²	65	31.7 Å²	31.7	26%	0.255	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	123.1	-176.8	-178	-106.5	0	0	0	111.6	A108 R144 A145 G175 K176 I177	A108-Y172 PolarHBondContact O-N 3.29Å; R144-Y172 HydrophobicContact CB-CD1 3.9Å; R144-Y172 HydrophobicContact CB-CG 4.09Å; R144-Y172 WeakPolarHBondContact O-CD1 3.38Å; R144-Y172 WeakPolarHBondContact O-CE1 3.33Å; A145-Y172 HydrophobicContact CB-CD2 4.32Å; A145-Y172 HydrophobicContact CB-CE2 3.83Å; Y172-G175 VanDerWaalsContact CE2-C 3.5Å; Y172-K176 WeakPolarHBondContact CA-O 3.27Å; Y172-K176 WeakPolarHBondContact CD2-O 3.41Å; Y172-I177 HydrophobicContact CD2-CG2 4.06Å
173	Q	95	Very high	95.3	Very high	64 Å²	64	27.1 Å²	27.1	30%	0.299	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	136.1	-178.6	-175.2	65.7	56.9	0	0	108.7	G175 K176	Q173-G175 VanDerWaalsContact C-N 3.27Å; Q173-G175 PolarHBondContact O-N 3.49Å; Q173-G175 VanDerWaalsContact O-N 3.1Å; Q173-K176 PolarHBondContact N-O 3.1Å; Q173-K176 PolarHBondContact O-N 3.21Å
174	D	91.8	Very high	95.3	Very high	134 Å²	134	24.8 Å²	24.8	72%	0.717	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.4	42.3	172.1	-52.3	-22.2	0	0	0	115.3
175	G	90.7	Very high	95.3	Very high	46 Å²	46	26.4 Å²	26.4	47%	0.474	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	8.7	-179.9	0	0	0	0	0	115.2	Y172 Q173	Y172-G175 VanDerWaalsContact CE2-C 3.5Å; Q173-G175 VanDerWaalsContact C-N 3.27Å; Q173-G175 PolarHBondContact O-N 3.49Å; Q173-G175 VanDerWaalsContact O-N 3.1Å
176	K	94.6	Very high	95.2	Very high	87 Å²	87	30.8 Å²	30.8	38%	0.378	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	149.4	-170.5	-65.8	165.5	-175.3	170.3	0	112.5	F159 Y172 Q173	F159-K176 HydrophobicContact CB-CB 4.37Å; F159-K176 HydrophobicContact CD1-CD 3.94Å; F159-K176 HydrophobicContact CD2-CD 3.86Å; F159-K176 HydrophobicContact CD2-CG 4.07Å; F159-K176 HydrophobicContact CE1-CD 3.99Å; F159-K176 HydrophobicContact CE2-CD 3.91Å; F159-K176 HydrophobicContact CE2-CG 4.4Å; F159-K176 HydrophobicContact CG-CB 4.42Å; F159-K176 HydrophobicContact CG-CD 3.89Å; F159-K176 HydrophobicContact CG-CG 4.3Å; F159-K176 HydrophobicContact CZ-CD 3.98Å; Y172-K176 WeakPolarHBondContact CA-O 3.27Å; Y172-K176 WeakPolarHBondContact CD2-O 3.41Å; Q173-K176 PolarHBondContact N-O 3.1Å; Q173-K176 PolarHBondContact O-N 3.21Å
177	I	96.6	Very high	95.3	Very high	6 Å²	6	34.8 Å²	34.8	3%	0.031	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	126.3	172.6	55.3	-179.9	0	0	0	110.7	W151 F156 F159 L165 Y170 Y172	W151-I177 HydrophobicContact CD2-CD1 4.34Å; W151-I177 HydrophobicContact CZ2-CD1 4.03Å; W151-I177 HydrophobicContact CZ2-CG2 4.3Å; F156-I177 HydrophobicContact CD2-CD1 3.7Å; F156-I177 HydrophobicContact CE2-CD1 3.67Å; F156-I177 HydrophobicContact CG-CD1 4.44Å; F156-I177 HydrophobicContact CZ-CD1 4.38Å; F159-I177 PolarHBondContact N-O 3.2Å; L165-I177 HydrophobicContact CD1-CB 4.07Å; L165-I177 HydrophobicContact CD1-CD1 3.66Å; L165-I177 HydrophobicContact CD1-CG1 3.98Å; Y170-I177 HydrophobicContact CD2-CG2 3.88Å; Y170-I177 HydrophobicContact CG-CG2 4.32Å; Y172-I177 HydrophobicContact CD2-CG2 4.06Å
178	H	97.5	Very high	95.4	Very high	10 Å²	10	36.7 Å²	36.7	5%	0.046	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	155.1	178.1	-65.5	-93.9	0	0	0	109.7	F159 T160 F171 H183	F159-H178 AromaticContact CD1-CE1 3.83Å; T160-H178 PolarHBondContact OG1-ND1 3.43Å; F171-H178 PolarHBondContact N-O 2.84Å; F171-H178 PolarHBondContact O-N 3.28Å; H178-H183 HydrophobicContact CB-CB 4.22Å
179	C	97	Very high	95.5	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.007	20%	0.2	C	C	.	.			trans	-79.4	161.9	166.1	72.9	0	0	0	0	110.7	Q75 C158 L165 R181 H182 H183	Q75-C179 HydrophobicContact CB-CB 3.82Å; Q75-C179 HydrophobicContact CG-CB 3.9Å; C158-C179 HydrophobicContact CB-CB 4.09Å; C158-C179 PolarHBondContact SG-N 2.98Å; L165-C179 HydrophobicContact CD2-CB 3.84Å; C179-R181 VanDerWaalsContact C-N 3.27Å; C179-R181 PolarHBondContact O-N 2.98Å; C179-H182 PolarHBondContact O-N 2.82Å; C179-H182 PolarHBondContact SG-ND1 3.35Å; C179-H183 PolarHBondContact O-N 3.01Å
180	G	94.9	Very high	95.6	Very high	3 Å²	3	38.9 Å²	38.9	3%	0.031	20%	0.202	C	C	.	.	H	α-helix	trans	-55.4	-39.1	-175.8	0	0	0	0	0	113.9	Q75 R104 F171 A184	Q75-G180 CarbonylContact O-C 3.6Å; Q75-G180 VanDerWaalsContact O-CA 3.3Å; Q75-G180 WeakPolarHBondContact O-CA 3.36Å; Q75-G180 PolarHBondContact O-N 3.19Å; Q75-G180 VanDerWaalsContact O-N 3.08Å; R104-G180 PolarHBondContact NH2-O 3.32Å; F171-G180 VanDerWaalsContact CD2-CA 3.43Å; G180-A184 WeakPolarHBondContact O-CB 3.46Å; G180-A184 PolarHBondContact O-N 3.38Å
181	R	96.9	Very high	95.6	Very high	22 Å²	22	38.9 Å²	38.9	8%	0.083	20%	0.202	C	C	.	.	H	α-helix	trans	-60.3	-52.8	177.3	-171.1	-157.1	170	92.5	5.9	112.7	Y74 Q75 P77 C179 A184 E185 R190 D195	Y74-R181 VanDerWaalsContact O-CB 3.31Å; Y74-R181 WeakPolarHBondContact O-CB 3.45Å; Y74-R181 WeakPolarHBondContact O-CD 3.31Å; Q75-R181 PolarHBondContact O-N 2.82Å; P77-R181 HydrophobicContact CG-CB 4.25Å; P77-R181 HydrophobicContact CG-CG 4.21Å; C179-R181 VanDerWaalsContact C-N 3.27Å; C179-R181 PolarHBondContact O-N 2.98Å; R181-A184 WeakPolarHBondContact O-CB 3.12Å; R181-A184 PolarHBondContact O-N 3.48Å; R181-E185 IonicContact CZ-OE1 2.7Å; R181-E185 IonicContact NE-OE1 3.63Å; R181-E185 PolarHBondContact NE-OE1 2.85Å; R181-E185 IonicContact NH2-OE1 2.85Å; R181-E185 PolarHBondContact NH2-OE1 3.14Å; R181-E185 WeakPolarHBondContact O-CG 3.49Å; R181-E185 PolarHBondContact O-N 3.13Å; R181-E185 VanDerWaalsContact O-N 3.1Å; R181-R190 PolarHBondContact O-NH2 2.75Å; R181-D195 IonicContact CZ-OD1 2.67Å; R181-D195 IonicContact CZ-OD2 3.02Å; R181-D195 IonicContact NH1-OD1 3.37Å; R181-D195 PolarHBondContact NH1-OD1 3.48Å; R181-D195 IonicContact NH1-OD2 3.2Å; R181-D195 PolarHBondContact NH1-OD2 3.25Å; R181-D195 IonicContact NH2-OD1 2.87Å; R181-D195 PolarHBondContact NH2-OD1 3.27Å; R181-D195 IonicContact NH2-OD2 2.63Å
182	H	97.6	Very high	95.5	Very high	16 Å²	16	41.1 Å²	41.1	7%	0.074	22%	0.218	C	C	.	.	H	α-helix	trans	-72.7	-31.3	-177.4	-67.5	107.9	0	0	0	111.9	T160 C161 C179 A184 E185 L186	T160-H182 HydrophobicContact CG2-CB 4.3Å; T160-H182 VanDerWaalsContact CG2-CD2 3.44Å; T160-H182 WeakPolarHBondContact CG2-CD2 3.36Å; C161-H182 VanDerWaalsContact CB-CE1 3.48Å; C161-H182 WeakPolarHBondContact CB-CE1 3.31Å; C161-H182 VanDerWaalsContact SG-CE1 3.51Å; C179-H182 PolarHBondContact O-N 2.82Å; C179-H182 PolarHBondContact SG-ND1 3.35Å; H182-A184 VanDerWaalsContact C-N 3.29Å; H182-A184 PolarHBondContact O-N 2.69Å; H182-E185 IonicContact CD2-OE2 3.75Å; H182-E185 PolarHBondContact CD2-OE2 2.97Å; H182-E185 IonicContact CG-OE2 3.9Å; H182-E185 IonicContact NE2-OE2 2.67Å; H182-E185 PolarHBondContact O-N 2.81Å; H182-L186 WeakPolarHBondContact O-CG 3.41Å; H182-L186 PolarHBondContact O-N 3.18Å
183	H	97.1	Very high	95.2	Very high	3 Å²	3	40.8 Å²	40.8	1%	0.014	23%	0.229	C	C	.	.	H	α-helix	trans	-67	-30.2	170.7	-171.9	-64.5	0	0	0	112.4	R104 A108 F171 H178 C179	R104-H183 PolarHBondContact NE-ND1 3.37Å; A108-H183 WeakPolarHBondContact CB-NE2 3.39Å; F171-H183 HydrophobicContact CB-CB 3.78Å; F171-H183 WeakPolarHBondContact CB-CD2 3.5Å; F171-H183 HydrophobicContact CD1-CB 4.41Å; F171-H183 HydrophobicContact CG-CB 4.08Å; H178-H183 HydrophobicContact CB-CB 4.22Å; C179-H183 PolarHBondContact O-N 3.01Å
184	A	96.6	Very high	95.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-66.5	-46.5	171	0	0	0	0	0	110.6	D80 F100 G180 R181 H182 L186 L187 K188 I197	D80-A184 WeakPolarHBondContact OD2-CB 3.37Å; F100-A184 HydrophobicContact CE1-CB 4.25Å; F100-A184 HydrophobicContact CZ-CB 4.05Å; G180-A184 WeakPolarHBondContact O-CB 3.46Å; G180-A184 PolarHBondContact O-N 3.38Å; R181-A184 WeakPolarHBondContact O-CB 3.12Å; R181-A184 PolarHBondContact O-N 3.48Å; H182-A184 VanDerWaalsContact C-N 3.29Å; H182-A184 PolarHBondContact O-N 2.69Å; A184-L186 VanDerWaalsContact C-N 3.26Å; A184-L186 PolarHBondContact O-N 3.09Å; A184-L187 PolarHBondContact O-N 2.98Å; A184-K188 PolarHBondContact O-N 3.43Å; A184-I197 HydrophobicContact CB-CD1 3.65Å; A184-I197 HydrophobicContact CB-CG1 4.04Å
185	E	95.9	Very high	95.3	Very high	65 Å²	65	35.3 Å²	35.3	30%	0.304	20%	0.203	S	C	.	.	H	α-helix	trans	-66	-20	-179.5	-68.7	165.2	-178.1	0	0	114.1	R181 H182 L187 K188 R190	R181-E185 IonicContact CZ-OE1 2.7Å; R181-E185 IonicContact NE-OE1 3.63Å; R181-E185 PolarHBondContact NE-OE1 2.85Å; R181-E185 IonicContact NH2-OE1 2.85Å; R181-E185 PolarHBondContact NH2-OE1 3.14Å; R181-E185 WeakPolarHBondContact O-CG 3.49Å; R181-E185 PolarHBondContact O-N 3.13Å; R181-E185 VanDerWaalsContact O-N 3.1Å; H182-E185 IonicContact CD2-OE2 3.75Å; H182-E185 PolarHBondContact CD2-OE2 2.97Å; H182-E185 IonicContact CG-OE2 3.9Å; H182-E185 IonicContact NE2-OE2 2.67Å; H182-E185 PolarHBondContact O-N 2.81Å; E185-L187 VanDerWaalsContact C-N 3.34Å; E185-K188 WeakPolarHBondContact CA-O 3.43Å; E185-R190 HydrophobicContact CG-CB 4.03Å; E185-R190 WeakPolarHBondContact OE1-CD 3.39Å; E185-R190 IonicContact OE1-CZ 2.72Å; E185-R190 IonicContact OE1-NE 2.91Å; E185-R190 PolarHBondContact OE1-NE 3.07Å; E185-R190 IonicContact OE1-NH2 3.33Å
186	L	94.8	Very high	95.5	Very high	99 Å²	99	33.5 Å²	33.5	52%	0.518	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-22.7	169.6	-74.8	175.4	0	0	0	113.5	H182 A184	H182-L186 WeakPolarHBondContact O-CG 3.41Å; H182-L186 PolarHBondContact O-N 3.18Å; A184-L186 VanDerWaalsContact C-N 3.26Å; A184-L186 PolarHBondContact O-N 3.09Å
187	L	94.8	Very high	95.5	Very high	93 Å²	93	29.6 Å²	29.6	49%	0.487	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-36.4	-171.2	-65.8	177.3	0	0	0	113.4	F100 R104 A184 E185	F100-L187 HydrophobicContact CE2-CB 3.82Å; F100-L187 HydrophobicContact CE2-CD1 4.19Å; F100-L187 HydrophobicContact CZ-CB 4.45Å; R104-L187 HydrophobicContact CG-CD1 3.81Å; A184-L187 PolarHBondContact O-N 2.98Å; E185-L187 VanDerWaalsContact C-N 3.34Å
188	K	95.6	Very high	95.5	Very high	46 Å²	46	29.4 Å²	29.4	20%	0.2	16%	0.164	C	C	.	.	S	Bend	trans	-141	144.6	177.4	-78.6	-80.7	-162.4	163.1	0	109.8	E96 F100 A184 E185 I197 F199	E96-K188 WeakPolarHBondContact OE1-CE 3.14Å; E96-K188 IonicContact OE1-NZ 3.27Å; E96-K188 PolarHBondContact OE1-NZ 3Å; E96-K188 IonicContact OE2-NZ 2.82Å; E96-K188 PolarHBondContact OE2-NZ 2.78Å; F100-K188 HydrophobicContact CD2-CG 4.41Å; F100-K188 HydrophobicContact CE2-CB 4.23Å; F100-K188 HydrophobicContact CE2-CG 3.94Å; F100-K188 HydrophobicContact CZ-CB 4.38Å; A184-K188 PolarHBondContact O-N 3.43Å; E185-K188 WeakPolarHBondContact CA-O 3.43Å; K188-I197 HydrophobicContact CB-CG2 3.43Å; K188-I197 VanDerWaalsContact CB-CG2 3.43Å; K188-I197 HydrophobicContact CG-CG2 4.18Å; K188-F199 PolarHBondContact NZ-O 3.37Å
189	P	96.4	Very high	95.4	Very high	38 Å²	38	29.2 Å²	29.2	25%	0.247	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-68.4	143.9	179.9	25.6	-30.5	0	0	0	112.1	I198 H210	P189-I198 HydrophobicContact CG-CB 4.31Å; P189-I198 WeakPolarHBondContact O-CB 3.48Å; P189-I198 WeakPolarHBondContact O-CG1 3.4Å; P189-I198 PolarHBondContact O-N 3.39Å; P189-H210 HydrophobicContact CB-CB 3.66Å; P189-H210 VanDerWaalsContact CB-CG 3.41Å
190	R	96.3	Very high	95.2	Very high	15 Å²	15	31.1 Å²	31.1	6%	0.057	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-99.9	135.9	174.4	-167.7	-175.5	-65	-74.7	-6.1	111.7	D80 R181 E185 S192 D195 E196 I197	D80-R190 IonicContact OD1-CZ 2.67Å; D80-R190 IonicContact OD1-NH1 3.73Å; D80-R190 PolarHBondContact OD1-NH1 2.72Å; D80-R190 IonicContact OD1-NH2 3.98Å; D80-R190 PolarHBondContact OD1-NH2 3.32Å; D80-R190 IonicContact OD2-CZ 3.22Å; D80-R190 IonicContact OD2-NH1 3.87Å; D80-R190 IonicContact OD2-NH2 3.15Å; D80-R190 PolarHBondContact OD2-NH2 2.88Å; R181-R190 PolarHBondContact O-NH2 2.75Å; E185-R190 HydrophobicContact CG-CB 4.03Å; E185-R190 WeakPolarHBondContact OE1-CD 3.39Å; E185-R190 IonicContact OE1-CZ 2.72Å; E185-R190 IonicContact OE1-NE 2.91Å; E185-R190 PolarHBondContact OE1-NE 3.07Å; E185-R190 IonicContact OE1-NH2 3.33Å; R190-S192 PolarHBondContact O-N 3.49Å; R190-D195 VanDerWaalsContact CD-O 3.27Å; R190-D195 WeakPolarHBondContact CD-O 3.3Å; R190-D195 WeakPolarHBondContact CD-OD1 3.27Å; R190-D195 WeakPolarHBondContact CG-O 3.39Å; R190-D195 PolarHBondContact NH1-O 3.31Å; R190-E196 CarbonylContact C-O 3.56Å; R190-E196 WeakPolarHBondContact CA-O 3.3Å; R190-E196 VanDerWaalsContact CG-O 3.29Å; R190-E196 WeakPolarHBondContact CG-O 3.36Å; R190-I197 HydrophobicContact CB-CD1 4.08Å; R190-I197 HydrophobicContact CG-CD1 4.41Å
191	C	95.1	Very high	94.9	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-73.2	120.9	176.8	176.9	0	0	0	0	111.7	A193 C194 D195 E196 I198 H210 H212	C191-A193 PolarHBondContact O-N 3.37Å; C191-C194 VanDerWaalsContact CB-SG 3.59Å; C191-D195 VanDerWaalsContact O-CA 3.3Å; C191-D195 WeakPolarHBondContact O-CA 3.36Å; C191-D195 PolarHBondContact O-N 3.09Å; C191-E196 PolarHBondContact N-O 3.28Å; C191-I198 HydrophobicContact CB-CD1 4.01Å; C191-I198 HydrophobicContact CB-CG1 3.86Å; C191-H210 CarbonylContact C-O 3.51Å; C191-H210 WeakPolarHBondContact CA-O 3.42Å; C191-H212 WeakPolarHBondContact CB-ND1 3.49Å; C191-H212 PolarHBondContact SG-N 3.39Å; C191-H212 VanDerWaalsContact SG-N 3.38Å
192	S	93.6	Very high	94.7	Very high	51 Å²	51	44.6 Å²	44.6	36%	0.357	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	9.3	-179.3	-67.3	0	0	0	0	115.9	R190 H210	R190-S192 PolarHBondContact O-N 3.49Å; S192-H210 PolarHBondContact N-O 3.2Å
193	A	91.6	Very high	94.5	Very high	58 Å²	58	46.3 Å²	46.3	48%	0.479	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-51.3	177.6	0	0	0	0	0	113	C191 W211 H215	C191-A193 PolarHBondContact O-N 3.37Å; A193-W211 HydrophobicContact CB-CE3 3.94Å; A193-W211 HydrophobicContact CB-CZ3 3.95Å; A193-H215 HydrophobicContact CB-CB 3.73Å
194	C	92.8	Very high	94.4	Very high	21 Å²	21	47 Å²	47	14%	0.142	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-8.8	178.3	59	0	0	0	0	113.8	C191 E196 H212 H215	C191-C194 VanDerWaalsContact CB-SG 3.59Å; C194-E196 HydrophobicContact CB-CG 4.28Å; C194-E196 WeakPolarHBondContact CB-OE2 3.35Å; C194-E196 PolarHBondContact O-N 3.02Å; C194-E196 PolarHBondContact SG-OE2 2.85Å; C194-H212 PolarHBondContact SG-ND1 3.22Å; C194-H212 VanDerWaalsContact SG-ND1 3.37Å; C194-H215 PolarHBondContact SG-CE1 3.26Å; C194-H215 PolarHBondContact SG-ND1 2.76Å; C194-H215 VanDerWaalsContact SG-ND1 3.37Å
195	D	94.3	Very high	94.3	Very high	61 Å²	61	53.6 Å²	53.6	33%	0.326	30%	0.296	S	S	.	.			trans	65.5	15	-176.6	-150.4	45.4	0	0	0	115.2	H79 R181 R190 C191	H79-D195 PolarHBondContact NE2-O 2.84Å; R181-D195 IonicContact CZ-OD1 2.67Å; R181-D195 IonicContact CZ-OD2 3.02Å; R181-D195 IonicContact NH1-OD1 3.37Å; R181-D195 PolarHBondContact NH1-OD1 3.48Å; R181-D195 IonicContact NH1-OD2 3.2Å; R181-D195 PolarHBondContact NH1-OD2 3.25Å; R181-D195 IonicContact NH2-OD1 2.87Å; R181-D195 PolarHBondContact NH2-OD1 3.27Å; R181-D195 IonicContact NH2-OD2 2.63Å; R190-D195 VanDerWaalsContact CD-O 3.27Å; R190-D195 WeakPolarHBondContact CD-O 3.3Å; R190-D195 WeakPolarHBondContact CD-OD1 3.27Å; R190-D195 WeakPolarHBondContact CG-O 3.39Å; R190-D195 PolarHBondContact NH1-O 3.31Å; C191-D195 VanDerWaalsContact O-CA 3.3Å; C191-D195 WeakPolarHBondContact O-CA 3.36Å; C191-D195 PolarHBondContact O-N 3.09Å
196	E	95.1	Very high	94.1	Very high	9 Å²	9	50.7 Å²	50.7	4%	0.042	28%	0.283	C	S	.	.			trans	-94.1	154.8	179.2	-60.6	167.4	137.1	0	0	112.6	C86 Q87 R190 C191 C194	C86-E196 WeakPolarHBondContact CA-OE1 3.44Å; Q87-E196 WeakPolarHBondContact CB-OE1 3.43Å; Q87-E196 PolarHBondContact N-OE1 3.13Å; R190-E196 CarbonylContact C-O 3.56Å; R190-E196 WeakPolarHBondContact CA-O 3.3Å; R190-E196 VanDerWaalsContact CG-O 3.29Å; R190-E196 WeakPolarHBondContact CG-O 3.36Å; C191-E196 PolarHBondContact N-O 3.28Å; C194-E196 HydrophobicContact CB-CG 4.28Å; C194-E196 WeakPolarHBondContact CB-OE2 3.35Å; C194-E196 PolarHBondContact O-N 3.02Å; C194-E196 PolarHBondContact SG-OE2 2.85Å
197	I	95.8	Very high	94	Very high	5 Å²	5	52 Å²	52	3%	0.026	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-70.8	133.1	171.3	-65.5	-64.8	0	0	0	110	F100 A184 K188 R190 F199	F100-I197 HydrophobicContact CE1-CG1 4.45Å; F100-I197 HydrophobicContact CE1-CG2 4.42Å; F100-I197 HydrophobicContact CZ-CG2 4.37Å; A184-I197 HydrophobicContact CB-CD1 3.65Å; A184-I197 HydrophobicContact CB-CG1 4.04Å; K188-I197 HydrophobicContact CB-CG2 3.43Å; K188-I197 VanDerWaalsContact CB-CG2 3.43Å; K188-I197 HydrophobicContact CG-CG2 4.18Å; R190-I197 HydrophobicContact CB-CD1 4.08Å; R190-I197 HydrophobicContact CG-CD1 4.41Å; I197-F199 HydrophobicContact CB-CE2 3.85Å; I197-F199 HydrophobicContact CB-CZ 4.06Å; I197-F199 HydrophobicContact CG2-CD2 4.22Å; I197-F199 HydrophobicContact CG2-CE1 4.02Å; I197-F199 HydrophobicContact CG2-CE2 3.7Å; I197-F199 HydrophobicContact CG2-CZ 3.59Å; I197-F199 WeakPolarHBondContact O-CD2 3.49Å; I197-F199 PolarHBondContact O-N 3.47Å
198	I	95.5	Very high	93.8	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.01	30%	0.295	C	S	.	.			trans	-86.6	110.8	178.2	-51.5	171.7	0	0	0	108.3	P189 C191 C203 H210	P189-I198 HydrophobicContact CG-CB 4.31Å; P189-I198 WeakPolarHBondContact O-CB 3.48Å; P189-I198 WeakPolarHBondContact O-CG1 3.4Å; P189-I198 PolarHBondContact O-N 3.39Å; C191-I198 HydrophobicContact CB-CD1 4.01Å; C191-I198 HydrophobicContact CB-CG1 3.86Å; I198-C203 HydrophobicContact CD1-CB 3.87Å; I198-C203 HydrophobicContact CG2-CB 3.95Å; I198-H210 HydrophobicContact CD1-CB 3.96Å
199	F	95.1	Very high	93.7	Very high	5 Å²	5	55 Å²	55	2%	0.022	31%	0.31	C	S	.	.			trans	-86.9	-42	177.4	-73.1	-75.2	0	0	0	112.1	E93 E96 L97 F100 K188 I197	E93-F199 HydrophobicContact CB-CB 4.12Å; E93-F199 HydrophobicContact CG-CB 3.98Å; E96-F199 HydrophobicContact CB-CD1 4.02Å; E96-F199 HydrophobicContact CG-CD1 3.81Å; E96-F199 HydrophobicContact CG-CE1 4.42Å; E96-F199 WeakPolarHBondContact OE2-CB 3.45Å; L97-F199 HydrophobicContact CB-CD2 4.37Å; L97-F199 HydrophobicContact CB-CE1 4.42Å; L97-F199 HydrophobicContact CB-CE2 3.84Å; L97-F199 HydrophobicContact CB-CZ 3.88Å; L97-F199 HydrophobicContact CD1-CE2 3.8Å; L97-F199 HydrophobicContact CD1-CZ 3.63Å; L97-F199 HydrophobicContact CG-CE2 4.28Å; L97-F199 HydrophobicContact CG-CZ 4.33Å; F100-F199 HydrophobicContact CB-CE1 3.78Å; F100-F199 HydrophobicContact CB-CZ 4.27Å; F100-F199 AromaticContact CD1-CE1 3.91Å; F100-F199 HydrophobicContact CD1-CE1 3.91Å; F100-F199 AromaticContact CD1-CZ 3.71Å; F100-F199 HydrophobicContact CD1-CZ 3.71Å; F100-F199 HydrophobicContact CD2-CE1 4.25Å; F100-F199 HydrophobicContact CE1-CE1 4.47Å; F100-F199 HydrophobicContact CE1-CZ 4.14Å; F100-F199 AromaticContact CG-CE1 3.76Å; F100-F199 HydrophobicContact CG-CE1 3.76Å; F100-F199 HydrophobicContact CG-CZ 4.07Å; K188-F199 PolarHBondContact NZ-O 3.37Å; I197-F199 HydrophobicContact CB-CE2 3.85Å; I197-F199 HydrophobicContact CB-CZ 4.06Å; I197-F199 HydrophobicContact CG2-CD2 4.22Å; I197-F199 HydrophobicContact CG2-CE1 4.02Å; I197-F199 HydrophobicContact CG2-CE2 3.7Å; I197-F199 HydrophobicContact CG2-CZ 3.59Å; I197-F199 WeakPolarHBondContact O-CD2 3.49Å; I197-F199 PolarHBondContact O-N 3.47Å
200	A	92.4	Very high	93.7	Very high	41 Å²	41	56.2 Å²	56.2	34%	0.339	31%	0.313	S	S	.	.	S	Bend	trans	-46.7	141.8	177.5	0	0	0	0	0	115	E202	A200-E202 PolarHBondContact O-N 2.88Å
201	D	90.3	Very high	93.6	Very high	174 Å²	174	56.3 Å²	56.3	93%	0.93	31%	0.313	S	S	*	.	S	Bend	trans	-59.8	-29.1	-179.7	-63.3	-50.3	0	0	0	113.8
202	E	91.4	Very high	93.5	Very high	135 Å²	135	57.6 Å²	57.6	63%	0.631	32%	0.319	S	S	*	.			trans	-109.3	122.9	179.1	-67.4	-169.2	-176.9	0	0	111.8	A200 M213	A200-E202 PolarHBondContact O-N 2.88Å; E202-M213 HydrophobicContact CB-CE 4.29Å; E202-M213 HydrophobicContact CB-SD 3.89Å; E202-M213 VanDerWaalsContact OE2-CE 3.26Å; E202-M213 WeakPolarHBondContact OE2-CE 3.3Å
203	C	93.9	Very high	93.4	Very high	51 Å²	51	59 Å²	59	35%	0.345	32%	0.321	S	S	.	.			trans	-130.5	162.6	169.7	76.4	0	0	0	0	110.7	I198	I198-C203 HydrophobicContact CD1-CB 3.87Å; I198-C203 HydrophobicContact CG2-CB 3.95Å
204	T	94.8	Very high	93.4	Very high	17 Å²	17	63.2 Å²	63.2	10%	0.104	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	127.7	171.5	-58.9	0	0	0	0	110	H210 W211 F216	T204-H210 CarbonylContact O-C 3.55Å; T204-H210 WeakPolarHBondContact O-CA 3.25Å; T204-W211 PolarHBondContact N-O 2.81Å; T204-W211 PolarHBondContact O-N 3.44Å; T204-F216 HydrophobicContact CG2-CB 4.2Å; T204-F216 HydrophobicContact CG2-CD1 3.53Å; T204-F216 HydrophobicContact CG2-CE1 4.08Å; T204-F216 HydrophobicContact CG2-CG 3.89Å
205	E	94.9	Very high	93.5	Very high	139 Å²	139	65.1 Å²	65.1	65%	0.65	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	127.5	166.8	-164.3	-167.1	156.9	0	0	109.7	R209	E205-R209 CarbonylContact C-O 3.53Å; E205-R209 WeakPolarHBondContact CA-O 3.38Å
206	A	92.6	Very high	93.5	Very high	5 Å²	5	62.2 Å²	62.2	4%	0.041	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	135.6	179.2	0	0	0	0	0	110.3	G208 R209 W211 F216 Y230	A206-G208 PolarHBondContact O-N 3.06Å; A206-R209 PolarHBondContact N-O 2.61Å; A206-R209 WeakPolarHBondContact O-CA 3.45Å; A206-R209 WeakPolarHBondContact O-CB 3.43Å; A206-R209 PolarHBondContact O-N 3.1Å; A206-R209 VanDerWaalsContact O-O 3.11Å; A206-W211 PolarHBondContact O-NE1 3.43Å; A206-F216 HydrophobicContact CB-CD2 4.17Å; A206-F216 HydrophobicContact CB-CE1 4.14Å; A206-F216 HydrophobicContact CB-CE2 3.46Å; A206-F216 VanDerWaalsContact CB-CE2 3.46Å; A206-F216 HydrophobicContact CB-CZ 3.44Å; A206-F216 VanDerWaalsContact CB-CZ 3.44Å; A206-Y230 WeakPolarHBondContact CB-OH 3.38Å
207	E	91.8	Very high	93.5	Very high	125 Å²	125	63.4 Å²	63.4	58%	0.584	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	33.4	-175.8	-59.1	-60	153.7	0	0	114.5	R209 M232	E207-R209 PolarHBondContact O-N 3.41Å; E207-M232 HydrophobicContact CG-CE 4.1Å; E207-M232 HydrophobicContact CG-CG 3.73Å; E207-M232 HydrophobicContact CG-SD 4.4Å
208	G	90.8	Very high	93.6	Very high	65 Å²	65	63.2 Å²	63.2	67%	0.67	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	23.1	-174.8	0	0	0	0	0	113.8	A206	A206-G208 PolarHBondContact O-N 3.06Å
209	R	93.4	Very high	93.5	Very high	137 Å²	137	67 Å²	67	52%	0.517	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	151.4	179	-59.7	-176.9	-169.1	-164.3	2	110.7	E205 A206 E207 W211	E205-R209 CarbonylContact C-O 3.53Å; E205-R209 WeakPolarHBondContact CA-O 3.38Å; A206-R209 PolarHBondContact N-O 2.61Å; A206-R209 WeakPolarHBondContact O-CA 3.45Å; A206-R209 WeakPolarHBondContact O-CB 3.43Å; A206-R209 PolarHBondContact O-N 3.1Å; A206-R209 VanDerWaalsContact O-O 3.11Å; E207-R209 PolarHBondContact O-N 3.41Å; R209-W211 HydrophobicContact CB-CZ2 4.23Å; R209-W211 VanDerWaalsContact O-CD1 3.3Å; R209-W211 PolarHBondContact O-NE1 2.9Å
210	H	95.6	Very high	93.5	Very high	65 Å²	65	72.2 Å²	72.2	30%	0.301	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	149.4	177.6	-55.6	94.1	0	0	0	111.6	P189 C191 S192 I198 T204	P189-H210 HydrophobicContact CB-CB 3.66Å; P189-H210 VanDerWaalsContact CB-CG 3.41Å; C191-H210 CarbonylContact C-O 3.51Å; C191-H210 WeakPolarHBondContact CA-O 3.42Å; S192-H210 PolarHBondContact N-O 3.2Å; I198-H210 HydrophobicContact CD1-CB 3.96Å; T204-H210 CarbonylContact O-C 3.55Å; T204-H210 WeakPolarHBondContact O-CA 3.25Å
211	W	94.9	Very high	93.7	Very high	17 Å²	17	72.7 Å²	72.7	6%	0.064	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	137.8	-175.8	-48.8	83.8	0	0	0	110.6	A193 T204 A206 R209 F216	A193-W211 HydrophobicContact CB-CE3 3.94Å; A193-W211 HydrophobicContact CB-CZ3 3.95Å; T204-W211 PolarHBondContact N-O 2.81Å; T204-W211 PolarHBondContact O-N 3.44Å; A206-W211 PolarHBondContact O-NE1 3.43Å; R209-W211 HydrophobicContact CB-CZ2 4.23Å; R209-W211 VanDerWaalsContact O-CD1 3.3Å; R209-W211 PolarHBondContact O-NE1 2.9Å; W211-F216 HydrophobicContact CB-CB 3.76Å; W211-F216 HydrophobicContact CB-CD2 4.37Å; W211-F216 HydrophobicContact CB-CG 4.41Å; W211-F216 AromaticContact CD1-CD2 3.81Å; W211-F216 AromaticContact CD2-CD2 3.84Å; W211-F216 HydrophobicContact CD2-CD2 3.84Å; W211-F216 AromaticContact CE2-CD2 3.96Å; W211-F216 HydrophobicContact CE3-CD2 4.44Å; W211-F216 HydrophobicContact CG-CB 4.11Å; W211-F216 AromaticContact CG-CD2 3.77Å; W211-F216 HydrophobicContact CG-CD2 3.77Å; W211-F216 HydrophobicContact CG-CG 4.27Å; W211-F216 AromaticContact NE1-CD2 3.94Å
212	H	93.8	Very high	93.9	Very high	26 Å²	26	72.2 Å²	72.2	12%	0.12	36%	0.364	C	S	.	.			trans	-57	141.3	161.8	-73.6	125.1	0	0	0	109.3	C191 C194 K214 H215 F216	C191-H212 WeakPolarHBondContact CB-ND1 3.49Å; C191-H212 PolarHBondContact SG-N 3.39Å; C191-H212 VanDerWaalsContact SG-N 3.38Å; C194-H212 PolarHBondContact SG-ND1 3.22Å; C194-H212 VanDerWaalsContact SG-ND1 3.37Å; H212-K214 PolarHBondContact O-N 3.35Å; H212-K214 VanDerWaalsContact O-N 3.14Å; H212-H215 HydrophobicContact CB-CB 4.25Å; H212-H215 AromaticContact ND1-CE1 3.81Å; H212-H215 AromaticContact ND1-ND1 3.63Å; H212-H215 PolarHBondContact O-N 3.46Å; H212-F216 PolarHBondContact O-N 2.75Å; H212-F216 VanDerWaalsContact O-N 3.16Å
213	M	91.8	Very high	94.1	Very high	82 Å²	82	69.5 Å²	69.5	40%	0.404	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-38.8	-177	-57.1	174.3	91.2	0	0	112.6	E202 H215 I224	E202-M213 HydrophobicContact CB-CE 4.29Å; E202-M213 HydrophobicContact CB-SD 3.89Å; E202-M213 VanDerWaalsContact OE2-CE 3.26Å; E202-M213 WeakPolarHBondContact OE2-CE 3.3Å; M213-H215 VanDerWaalsContact C-N 3.3Å; M213-H215 PolarHBondContact O-N 3.21Å; M213-I224 WeakPolarHBondContact O-CG2 3.45Å
214	K	91.6	Very high	94.1	Very high	146 Å²	146	71 Å²	71	64%	0.635	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-27.2	176.5	-61.6	174.7	-174.5	166.9	0	113.6	H212	H212-K214 PolarHBondContact O-N 3.35Å; H212-K214 VanDerWaalsContact O-N 3.14Å
215	H	93.1	Very high	94.1	Very high	60 Å²	60	70.3 Å²	70.3	28%	0.278	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-14.3	-172.7	-58.2	167.1	0	0	0	113.4	A193 C194 H212 M213 C217	A193-H215 HydrophobicContact CB-CB 3.73Å; C194-H215 PolarHBondContact SG-CE1 3.26Å; C194-H215 PolarHBondContact SG-ND1 2.76Å; C194-H215 VanDerWaalsContact SG-ND1 3.37Å; H212-H215 HydrophobicContact CB-CB 4.25Å; H212-H215 AromaticContact ND1-CE1 3.81Å; H212-H215 AromaticContact ND1-ND1 3.63Å; H212-H215 PolarHBondContact O-N 3.46Å; M213-H215 VanDerWaalsContact C-N 3.3Å; M213-H215 PolarHBondContact O-N 3.21Å; H215-C217 VanDerWaalsContact C-N 3.29Å; H215-C217 PolarHBondContact O-N 3.29Å
216	F	95.6	Very high	94	Very high	1 Å²	1	65 Å²	65	0%	0.004	34%	0.339	C	S	.	.	S	Bend	trans	-89	71.5	166.9	-163.6	-108.1	0	0	0	110.1	T204 A206 W211 H212 L225 Y230 P237	T204-F216 HydrophobicContact CG2-CB 4.2Å; T204-F216 HydrophobicContact CG2-CD1 3.53Å; T204-F216 HydrophobicContact CG2-CE1 4.08Å; T204-F216 HydrophobicContact CG2-CG 3.89Å; A206-F216 HydrophobicContact CB-CD2 4.17Å; A206-F216 HydrophobicContact CB-CE1 4.14Å; A206-F216 HydrophobicContact CB-CE2 3.46Å; A206-F216 VanDerWaalsContact CB-CE2 3.46Å; A206-F216 HydrophobicContact CB-CZ 3.44Å; A206-F216 VanDerWaalsContact CB-CZ 3.44Å; W211-F216 HydrophobicContact CB-CB 3.76Å; W211-F216 HydrophobicContact CB-CD2 4.37Å; W211-F216 HydrophobicContact CB-CG 4.41Å; W211-F216 AromaticContact CD1-CD2 3.81Å; W211-F216 AromaticContact CD2-CD2 3.84Å; W211-F216 HydrophobicContact CD2-CD2 3.84Å; W211-F216 AromaticContact CE2-CD2 3.96Å; W211-F216 HydrophobicContact CE3-CD2 4.44Å; W211-F216 HydrophobicContact CG-CB 4.11Å; W211-F216 AromaticContact CG-CD2 3.77Å; W211-F216 HydrophobicContact CG-CD2 3.77Å; W211-F216 HydrophobicContact CG-CG 4.27Å; W211-F216 AromaticContact NE1-CD2 3.94Å; H212-F216 PolarHBondContact O-N 2.75Å; H212-F216 VanDerWaalsContact O-N 3.16Å; F216-L225 HydrophobicContact CD1-CB 3.53Å; F216-L225 HydrophobicContact CE1-CB 3.47Å; F216-L225 VanDerWaalsContact CE1-CB 3.47Å; F216-L225 HydrophobicContact CZ-CB 4.44Å; F216-L225 PolarHBondContact O-N 3.23Å; F216-Y230 AromaticContact CE1-CD1 3.79Å; F216-Y230 HydrophobicContact CE1-CD1 3.79Å; F216-Y230 AromaticContact CE1-CE1 3.92Å; F216-Y230 HydrophobicContact CE1-CE1 3.92Å; F216-Y230 HydrophobicContact CE1-CG 4.11Å; F216-Y230 AromaticContact CZ-CD1 3.85Å; F216-Y230 HydrophobicContact CZ-CD1 3.85Å; F216-Y230 AromaticContact CZ-CD2 3.8Å; F216-Y230 HydrophobicContact CZ-CD2 3.8Å; F216-Y230 AromaticContact CZ-CE1 3.81Å; F216-Y230 HydrophobicContact CZ-CE1 3.81Å; F216-Y230 AromaticContact CZ-CE2 3.76Å; F216-Y230 HydrophobicContact CZ-CE2 3.76Å; F216-Y230 AromaticContact CZ-CG 3.86Å; F216-Y230 HydrophobicContact CZ-CG 3.86Å; F216-Y230 AromaticContact CZ-CZ 3.76Å; F216-P237 HydrophobicContact CD2-CG 4.35Å; F216-P237 HydrophobicContact CE2-CB 3.93Å; F216-P237 HydrophobicContact CE2-CG 4.08Å; F216-P237 HydrophobicContact CZ-CB 4.1Å
217	C	95.6	Very high	93.7	Very high	34 Å²	34	68.8 Å²	68.8	23%	0.23	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-122.6	155	-175.8	59.3	0	0	0	0	111.8	H215 L219 E222 T223 P237	H215-C217 VanDerWaalsContact C-N 3.29Å; H215-C217 PolarHBondContact O-N 3.29Å; C217-L219 PolarHBondContact O-N 3.36Å; C217-E222 WeakPolarHBondContact CB-O 3.5Å; C217-T223 CarbonylContact C-O 3.59Å; C217-T223 VanDerWaalsContact CA-O 3.31Å; C217-T223 WeakPolarHBondContact CA-O 3.4Å; C217-P237 WeakPolarHBondContact O-CG 3.43Å
218	C	95.9	Very high	93.7	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	38%	0.379	C	S	.	.			trans	-63.1	127.6	176.1	178.4	0	0	0	0	110.8	E220 C221 E222 T223 L225 C239	C218-E220 PolarHBondContact O-N 2.82Å; C218-E220 VanDerWaalsContact O-N 3.13Å; C218-C221 VanDerWaalsContact CB-SG 3.56Å; C218-C221 PolarHBondContact O-N 3.33Å; C218-E222 VanDerWaalsContact O-CA 3.31Å; C218-E222 WeakPolarHBondContact O-CA 3.39Å; C218-E222 PolarHBondContact O-N 2.87Å; C218-T223 PolarHBondContact N-O 3.47Å; C218-L225 HydrophobicContact CB-CD1 4.15Å; C218-L225 HydrophobicContact CB-CD2 4.47Å; C218-L225 HydrophobicContact CB-CG 4.43Å; C218-C239 HydrophobicContact CB-CB 4.08Å; C218-C239 PolarHBondContact SG-N 3.5Å
219	L	94.1	Very high	93.8	Very high	83 Å²	83	72.6 Å²	72.6	44%	0.435	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-34.2	179.9	-172.5	72.7	0	0	0	114.2	C217 R236 P237 F238	C217-L219 PolarHBondContact O-N 3.36Å; L219-R236 HydrophobicContact CD2-CB 4.28Å; L219-P237 PolarHBondContact N-O 3.21Å; L219-F238 HydrophobicContact CB-CD1 4.39Å; L219-F238 HydrophobicContact CB-CE1 4.02Å; L219-F238 HydrophobicContact CB-CZ 4.18Å; L219-F238 HydrophobicContact CD2-CE1 3.97Å; L219-F238 HydrophobicContact CD2-CE2 4.32Å; L219-F238 HydrophobicContact CD2-CZ 3.55Å
220	E	95.6	Very high	93.8	Very high	114 Å²	114	69.5 Å²	69.5	53%	0.533	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-27.8	-172	-170.4	65.8	-157.9	0	0	113.5	C218 C242 L246	C218-E220 PolarHBondContact O-N 2.82Å; C218-E220 VanDerWaalsContact O-N 3.13Å; E220-C242 HydrophobicContact CB-CB 3.85Å; E220-C242 HydrophobicContact CG-CB 4.14Å; E220-L246 HydrophobicContact CB-CD1 4.36Å; E220-L246 HydrophobicContact CG-CD1 4.04Å
221	C	95.7	Very high	93.7	Very high	51 Å²	51	68.1 Å²	68.1	35%	0.345	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.5	12.1	-169.3	74.7	0	0	0	0	114.5	C218 T223 C242	C218-C221 VanDerWaalsContact CB-SG 3.56Å; C218-C221 PolarHBondContact O-N 3.33Å; C221-T223 PolarHBondContact O-N 3.1Å; C221-T223 PolarHBondContact O-OG1 2.99Å; C221-T223 PolarHBondContact SG-OG1 2.99Å; C221-C242 VanDerWaalsContact SG-SG 3.6Å
222	E	94.6	Very high	93.6	Very high	163 Å²	163	69.9 Å²	69.9	76%	0.762	37%	0.366	S	S	*	.			trans	51.7	10.3	175.3	-60	-178.2	177.8	0	0	115.8	C217 C218 I224	C217-E222 WeakPolarHBondContact CB-O 3.5Å; C218-E222 VanDerWaalsContact O-CA 3.31Å; C218-E222 WeakPolarHBondContact O-CA 3.39Å; C218-E222 PolarHBondContact O-N 2.87Å; E222-I224 PolarHBondContact O-N 2.97Å
223	T	95.3	Very high	93.4	Very high	79 Å²	79	71.6 Å²	71.6	49%	0.485	37%	0.373	S	S	.	.			trans	-73.3	126.2	-176.7	-57.8	0	0	0	0	109.4	C217 C218 C221 L225	C217-T223 CarbonylContact C-O 3.59Å; C217-T223 VanDerWaalsContact CA-O 3.31Å; C217-T223 WeakPolarHBondContact CA-O 3.4Å; C218-T223 PolarHBondContact N-O 3.47Å; C221-T223 PolarHBondContact O-N 3.1Å; C221-T223 PolarHBondContact O-OG1 2.99Å; C221-T223 PolarHBondContact SG-OG1 2.99Å; T223-L225 PolarHBondContact O-N 2.98Å
224	I	95	Very high	93.3	Very high	81 Å²	81	74.6 Å²	74.6	42%	0.415	39%	0.391	S	S	.	.	B	Isolated β-bridge	trans	-59.3	130	178.5	-66	172.9	0	0	0	110.2	M213 E222	M213-I224 WeakPolarHBondContact O-CG2 3.45Å; E222-I224 PolarHBondContact O-N 2.97Å
225	L	95.3	Very high	93	Very high	3 Å²	3	70.2 Å²	70.2	2%	0.016	39%	0.387	C	S	.	.			trans	-102.8	0.8	-174.8	-66.3	170.9	0	0	0	113.3	F216 C218 T223 G227 Q228 P237 C239	F216-L225 HydrophobicContact CD1-CB 3.53Å; F216-L225 HydrophobicContact CE1-CB 3.47Å; F216-L225 VanDerWaalsContact CE1-CB 3.47Å; F216-L225 HydrophobicContact CZ-CB 4.44Å; F216-L225 PolarHBondContact O-N 3.23Å; C218-L225 HydrophobicContact CB-CD1 4.15Å; C218-L225 HydrophobicContact CB-CD2 4.47Å; C218-L225 HydrophobicContact CB-CG 4.43Å; T223-L225 PolarHBondContact O-N 2.98Å; L225-G227 PolarHBondContact O-N 3.11Å; L225-Q228 HydrophobicContact CD2-CB 4.44Å; L225-Q228 PolarHBondContact O-N 2.82Å; L225-P237 HydrophobicContact CD1-CB 3.73Å; L225-P237 HydrophobicContact CD1-CG 4.35Å; L225-C239 HydrophobicContact CD2-CB 3.7Å
226	G	91.3	Very high	92.8	Very high	28 Å²	28	74.2 Å²	74.2	29%	0.289	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	119.9	174	0	0	0	0	0	111.5	Q228	G226-Q228 PolarHBondContact O-N 2.84Å
227	G	87.6	Confident	92.7	Very high	84 Å²	84	74.8 Å²	74.8	87%	0.866	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.3	2.4	-175.4	0	0	0	0	0	115.7	L225	L225-G227 PolarHBondContact O-N 3.11Å
228	Q	91	Very high	92.7	Very high	127 Å²	127	73.5 Å²	73.5	59%	0.593	39%	0.394	S	S	*	.	S	Bend	trans	-99.2	168.4	177.6	-59.1	-57.3	-34.1	0	0	111.8	L225 G226	L225-Q228 HydrophobicContact CD2-CB 4.44Å; L225-Q228 PolarHBondContact O-N 2.82Å; G226-Q228 PolarHBondContact O-N 2.84Å
229	R	93.2	Very high	92.7	Very high	143 Å²	143	74.3 Å²	74.3	54%	0.54	40%	0.4	S	S	.	.			trans	-82.5	124.2	170.8	-66.2	-177.2	63.4	-151.5	0.3	110.4	C240 D261	R229-C240 PolarHBondContact O-SG 3.5Å; R229-D261 IonicContact CZ-OD1 3.62Å; R229-D261 IonicContact CZ-OD2 3.43Å; R229-D261 IonicContact NH1-OD1 2.82Å; R229-D261 PolarHBondContact NH1-OD1 2.86Å; R229-D261 IonicContact NH1-OD2 3.29Å; R229-D261 PolarHBondContact NH1-OD2 3.13Å; R229-D261 IonicContact NH2-OD1 3.7Å; R229-D261 PolarHBondContact NH2-OD1 3.02Å; R229-D261 IonicContact NH2-OD2 2.72Å
230	Y	94.3	Very high	92.6	Very high	72 Å²	72	71.1 Å²	71.1	28%	0.282	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	166.8	178.7	66.2	-86.5	0	0	0	111	A206 F216 M232 F238	A206-Y230 WeakPolarHBondContact CB-OH 3.38Å; F216-Y230 AromaticContact CE1-CD1 3.79Å; F216-Y230 HydrophobicContact CE1-CD1 3.79Å; F216-Y230 AromaticContact CE1-CE1 3.92Å; F216-Y230 HydrophobicContact CE1-CE1 3.92Å; F216-Y230 HydrophobicContact CE1-CG 4.11Å; F216-Y230 AromaticContact CZ-CD1 3.85Å; F216-Y230 HydrophobicContact CZ-CD1 3.85Å; F216-Y230 AromaticContact CZ-CD2 3.8Å; F216-Y230 HydrophobicContact CZ-CD2 3.8Å; F216-Y230 AromaticContact CZ-CE1 3.81Å; F216-Y230 HydrophobicContact CZ-CE1 3.81Å; F216-Y230 AromaticContact CZ-CE2 3.76Å; F216-Y230 HydrophobicContact CZ-CE2 3.76Å; F216-Y230 AromaticContact CZ-CG 3.86Å; F216-Y230 HydrophobicContact CZ-CG 3.86Å; F216-Y230 AromaticContact CZ-CZ 3.76Å; Y230-M232 HydrophobicContact CD2-CG 3.97Å; Y230-M232 HydrophobicContact CD2-SD 4.14Å; Y230-M232 HydrophobicContact CE2-CG 3.69Å; Y230-M232 HydrophobicContact CE2-SD 4.08Å; Y230-F238 CarbonylContact C-O 3.58Å; Y230-F238 WeakPolarHBondContact CA-O 3.42Å; Y230-F238 WeakPolarHBondContact CB-O 3.12Å
231	I	92.8	Very high	92.4	Very high	36 Å²	36	71.4 Å²	71.4	19%	0.185	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	127	174.2	-59.1	167.6	0	0	0	107.8	F238 F243 V260	I231-F238 PolarHBondContact N-O 2.97Å; I231-F238 PolarHBondContact O-N 2.86Å; I231-F243 HydrophobicContact CB-CD2 3.82Å; I231-F243 HydrophobicContact CB-CE2 4.18Å; I231-F243 HydrophobicContact CB-CG 4.17Å; I231-F243 HydrophobicContact CD1-CB 3.93Å; I231-F243 HydrophobicContact CD1-CD1 3.57Å; I231-F243 HydrophobicContact CD1-CD2 4.08Å; I231-F243 HydrophobicContact CD1-CE1 4.09Å; I231-F243 HydrophobicContact CD1-CG 3.58Å; I231-F243 HydrophobicContact CG1-CG 4.46Å; I231-F243 HydrophobicContact CG2-CD2 3.62Å; I231-F243 HydrophobicContact CG2-CE2 3.43Å; I231-F243 VanDerWaalsContact CG2-CE2 3.43Å; I231-F243 HydrophobicContact CG2-CG 4.25Å; I231-F243 HydrophobicContact CG2-CZ 3.92Å; I231-V260 HydrophobicContact CD1-CB 4.27Å; I231-V260 HydrophobicContact CD1-CG1 3.96Å; I231-V260 HydrophobicContact CD1-CG2 3.7Å
232	M	92.4	Very high	92.3	Very high	54 Å²	54	69.9 Å²	69.9	27%	0.266	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	126	174.3	-67.7	-64.8	-74.9	0	0	110	E207 Y230 G235 P237	E207-M232 HydrophobicContact CG-CE 4.1Å; E207-M232 HydrophobicContact CG-CG 3.73Å; E207-M232 HydrophobicContact CG-SD 4.4Å; Y230-M232 HydrophobicContact CD2-CG 3.97Å; Y230-M232 HydrophobicContact CD2-SD 4.14Å; Y230-M232 HydrophobicContact CE2-CG 3.69Å; Y230-M232 HydrophobicContact CE2-SD 4.08Å; M232-G235 WeakPolarHBondContact CE-O 3.3Å; M232-P237 HydrophobicContact SD-CB 3.64Å; M232-P237 HydrophobicContact SD-CG 4.43Å
233	K	89.6	Confident	92.3	Very high	63 Å²	63	64.1 Å²	64.1	27%	0.274	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	128.3	173.8	-178.9	177.3	177.6	175.4	0	109.4	G235 R236 F238 F243 Y247	K233-G235 PolarHBondContact O-N 2.83Å; K233-G235 VanDerWaalsContact O-N 3.09Å; K233-R236 PolarHBondContact N-O 2.81Å; K233-R236 PolarHBondContact O-N 3.25Å; K233-F238 HydrophobicContact CB-CD2 4.16Å; K233-F238 HydrophobicContact CB-CE2 3.98Å; K233-F243 HydrophobicContact CB-CE2 4.23Å; K233-F243 HydrophobicContact CD-CE2 4.02Å; K233-Y247 HydrophobicContact CD-CD2 4Å; K233-Y247 HydrophobicContact CD-CE2 3.57Å; K233-Y247 VanDerWaalsContact NZ-CZ 3.25Å
234	D	88.8	Confident	92.1	Very high	145 Å²	145	62.5 Å²	62.5	78%	0.775	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	34.5	-179.9	-51	-41.3	0	0	0	113.1	R236	D234-R236 VanDerWaalsContact C-N 3.33Å; D234-R236 PolarHBondContact O-N 2.97Å
235	G	86.5	Confident	91.8	Very high	54 Å²	54	62.7 Å²	62.7	56%	0.557	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	4.2	-177.3	0	0	0	0	0	115.7	M232 K233	M232-G235 WeakPolarHBondContact CE-O 3.3Å; K233-G235 PolarHBondContact O-N 2.83Å; K233-G235 VanDerWaalsContact O-N 3.09Å
236	R	89	Confident	91.5	Very high	143 Å²	143	66.1 Å²	66.1	54%	0.54	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	137.3	-176.9	-59.8	179.3	179.8	-95.8	-3.3	111.4	L219 K233 D234 F238	L219-R236 HydrophobicContact CD2-CB 4.28Å; K233-R236 PolarHBondContact N-O 2.81Å; K233-R236 PolarHBondContact O-N 3.25Å; D234-R236 VanDerWaalsContact C-N 3.33Å; D234-R236 PolarHBondContact O-N 2.97Å; R236-F238 HydrophobicContact CB-CE2 4.16Å; R236-F238 WeakPolarHBondContact O-CD2 3.15Å
237	P	93.8	Very high	91.3	Very high	14 Å²	14	69.1 Å²	69.1	9%	0.091	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	138.6	178.1	32.9	-34.1	0	0	0	112.2	F216 C217 L219 L225 M232	F216-P237 HydrophobicContact CD2-CG 4.35Å; F216-P237 HydrophobicContact CE2-CB 3.93Å; F216-P237 HydrophobicContact CE2-CG 4.08Å; F216-P237 HydrophobicContact CZ-CB 4.1Å; C217-P237 WeakPolarHBondContact O-CG 3.43Å; L219-P237 PolarHBondContact N-O 3.21Å; L225-P237 HydrophobicContact CD1-CB 3.73Å; L225-P237 HydrophobicContact CD1-CG 4.35Å; M232-P237 HydrophobicContact SD-CB 3.64Å; M232-P237 HydrophobicContact SD-CG 4.43Å
238	F	94.8	Very high	91.3	Very high	7 Å²	7	65.9 Å²	65.9	3%	0.031	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	144.8	172.3	-66.3	-98.2	0	0	0	110	L219 Y230 I231 K233 R236 F243 L246 Y247	L219-F238 HydrophobicContact CB-CD1 4.39Å; L219-F238 HydrophobicContact CB-CE1 4.02Å; L219-F238 HydrophobicContact CB-CZ 4.18Å; L219-F238 HydrophobicContact CD2-CE1 3.97Å; L219-F238 HydrophobicContact CD2-CE2 4.32Å; L219-F238 HydrophobicContact CD2-CZ 3.55Å; Y230-F238 CarbonylContact C-O 3.58Å; Y230-F238 WeakPolarHBondContact CA-O 3.42Å; Y230-F238 WeakPolarHBondContact CB-O 3.12Å; I231-F238 PolarHBondContact N-O 2.97Å; I231-F238 PolarHBondContact O-N 2.86Å; K233-F238 HydrophobicContact CB-CD2 4.16Å; K233-F238 HydrophobicContact CB-CE2 3.98Å; R236-F238 HydrophobicContact CB-CE2 4.16Å; R236-F238 WeakPolarHBondContact O-CD2 3.15Å; F238-F243 HydrophobicContact CB-CB 4.08Å; F238-F243 HydrophobicContact CB-CD2 4.31Å; F238-L246 HydrophobicContact CD1-CD1 4.3Å; F238-L246 HydrophobicContact CE1-CD1 4Å; F238-Y247 HydrophobicContact CE1-CE2 4.3Å; F238-Y247 HydrophobicContact CZ-CE2 4.32Å
239	C	95.3	Very high	91.3	Very high	17 Å²	17	64.2 Å²	64.2	12%	0.115	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	155.4	163.8	77.4	0	0	0	0	109.7	C218 L225 N241 C242 F243	C218-C239 HydrophobicContact CB-CB 4.08Å; C218-C239 PolarHBondContact SG-N 3.5Å; L225-C239 HydrophobicContact CD2-CB 3.7Å; C239-N241 VanDerWaalsContact C-N 3.32Å; C239-N241 PolarHBondContact O-N 2.81Å; C239-C242 PolarHBondContact O-N 2.99Å; C239-C242 VanDerWaalsContact SG-CB 3.58Å; C239-C242 PolarHBondContact SG-N 2.73Å; C239-F243 WeakPolarHBondContact O-CB 3.49Å; C239-F243 PolarHBondContact O-N 2.97Å
240	C	92.1	Very high	91.2	Very high	16 Å²	16	63.8 Å²	63.8	11%	0.108	33%	0.325	C	S	.	.	H	α-helix	trans	-56	-46	-178.7	-60.9	0	0	0	0	111.7	R229 C242 F243 E244	R229-C240 PolarHBondContact O-SG 3.5Å; C240-C242 PolarHBondContact O-N 3.18Å; C240-F243 PolarHBondContact O-N 3.26Å; C240-E244 WeakPolarHBondContact O-CB 2.95Å; C240-E244 VanDerWaalsContact O-CG 3.3Å; C240-E244 WeakPolarHBondContact O-CG 3.39Å; C240-E244 PolarHBondContact O-N 3.43Å
241	N	92.1	Very high	91.2	Very high	119 Å²	119	60.5 Å²	60.5	64%	0.636	31%	0.312	S	S	*	.	H	α-helix	trans	-61	-40.7	-178.6	-59.8	50	0	0	0	113.9	C239 S245	C239-N241 VanDerWaalsContact C-N 3.32Å; C239-N241 PolarHBondContact O-N 2.81Å; N241-S245 WeakPolarHBondContact O-CB 3.39Å; N241-S245 PolarHBondContact O-N 3.42Å; N241-S245 PolarHBondContact O-OG 3.08Å
242	C	94.6	Very high	91.1	Very high	20 Å²	20	64.9 Å²	64.9	14%	0.135	33%	0.332	C	S	.	.	H	α-helix	trans	-74.5	-38.8	176.5	-71.3	0	0	0	0	111.2	E220 C221 C239 C240 E244 S245 L246	E220-C242 HydrophobicContact CB-CB 3.85Å; E220-C242 HydrophobicContact CG-CB 4.14Å; C221-C242 VanDerWaalsContact SG-SG 3.6Å; C239-C242 PolarHBondContact O-N 2.99Å; C239-C242 VanDerWaalsContact SG-CB 3.58Å; C239-C242 PolarHBondContact SG-N 2.73Å; C240-C242 PolarHBondContact O-N 3.18Å; C242-E244 VanDerWaalsContact C-N 3.31Å; C242-E244 PolarHBondContact O-N 3.39Å; C242-S245 PolarHBondContact O-N 2.71Å; C242-L246 VanDerWaalsContact O-CB 3.31Å; C242-L246 WeakPolarHBondContact O-CB 3.47Å; C242-L246 WeakPolarHBondContact O-CG 3.34Å; C242-L246 PolarHBondContact O-N 2.8Å
243	F	93.3	Very high	91	Very high	41 Å²	41	65.4 Å²	65.4	18%	0.18	34%	0.338	C	S	.	.	H	α-helix	trans	-60.6	-42.1	174.2	-172.3	-81.4	0	0	0	111.5	I231 K233 F238 C239 C240 Y247 V260	I231-F243 HydrophobicContact CB-CD2 3.82Å; I231-F243 HydrophobicContact CB-CE2 4.18Å; I231-F243 HydrophobicContact CB-CG 4.17Å; I231-F243 HydrophobicContact CD1-CB 3.93Å; I231-F243 HydrophobicContact CD1-CD1 3.57Å; I231-F243 HydrophobicContact CD1-CD2 4.08Å; I231-F243 HydrophobicContact CD1-CE1 4.09Å; I231-F243 HydrophobicContact CD1-CG 3.58Å; I231-F243 HydrophobicContact CG1-CG 4.46Å; I231-F243 HydrophobicContact CG2-CD2 3.62Å; I231-F243 HydrophobicContact CG2-CE2 3.43Å; I231-F243 VanDerWaalsContact CG2-CE2 3.43Å; I231-F243 HydrophobicContact CG2-CG 4.25Å; I231-F243 HydrophobicContact CG2-CZ 3.92Å; K233-F243 HydrophobicContact CB-CE2 4.23Å; K233-F243 HydrophobicContact CD-CE2 4.02Å; F238-F243 HydrophobicContact CB-CB 4.08Å; F238-F243 HydrophobicContact CB-CD2 4.31Å; C239-F243 WeakPolarHBondContact O-CB 3.49Å; C239-F243 PolarHBondContact O-N 2.97Å; C240-F243 PolarHBondContact O-N 3.26Å; F243-Y247 HydrophobicContact CD1-CD2 4.26Å; F243-Y247 AromaticContact CD2-CD2 3.58Å; F243-Y247 HydrophobicContact CD2-CD2 3.58Å; F243-Y247 HydrophobicContact CD2-CE2 4.01Å; F243-Y247 HydrophobicContact CE1-CD2 4.33Å; F243-Y247 AromaticContact CE2-CD2 3.67Å; F243-Y247 HydrophobicContact CE2-CD2 3.67Å; F243-Y247 HydrophobicContact CE2-CE2 4.22Å; F243-Y247 AromaticContact CG-CD2 3.89Å; F243-Y247 HydrophobicContact CG-CD2 3.89Å; F243-Y247 HydrophobicContact CZ-CD2 4.05Å; F243-Y247 WeakPolarHBondContact O-CA 3.17Å; F243-Y247 WeakPolarHBondContact O-CB 3.38Å; F243-Y247 WeakPolarHBondContact O-CD2 3.25Å; F243-Y247 PolarHBondContact O-N 3.42Å; F243-V260 HydrophobicContact CD1-CG2 3.87Å; F243-V260 HydrophobicContact CE1-CG2 4.17Å
244	E	90.9	Very high	91.1	Very high	45 Å²	45	65.2 Å²	65.2	21%	0.21	34%	0.344	C	S	.	.	H	α-helix	trans	-66.3	-49.7	175.8	-71.7	175.6	-176.8	0	0	111.7	C240 C242 L246 Y247 A248 G259 V260	C240-E244 WeakPolarHBondContact O-CB 2.95Å; C240-E244 VanDerWaalsContact O-CG 3.3Å; C240-E244 WeakPolarHBondContact O-CG 3.39Å; C240-E244 PolarHBondContact O-N 3.43Å; C242-E244 VanDerWaalsContact C-N 3.31Å; C242-E244 PolarHBondContact O-N 3.39Å; E244-L246 PolarHBondContact O-N 3.28Å; E244-Y247 PolarHBondContact O-N 3.02Å; E244-A248 HydrophobicContact CB-CB 4.14Å; E244-A248 HydrophobicContact CG-CB 4.45Å; E244-A248 WeakPolarHBondContact O-CB 3.27Å; E244-A248 PolarHBondContact O-N 2.99Å; E244-G259 VanDerWaalsContact OE1-CA 3.28Å; E244-G259 WeakPolarHBondContact OE1-CA 3.27Å; E244-V260 HydrophobicContact CG-CG2 3.88Å; E244-V260 PolarHBondContact OE1-N 3.05Å
245	S	89.4	Confident	91.1	Very high	86 Å²	86	60.7 Å²	60.7	60%	0.601	33%	0.332	S	S	*	.	H	α-helix	trans	-56.6	-32.6	176.9	-59.5	0	0	0	0	113.5	N241 C242	N241-S245 WeakPolarHBondContact O-CB 3.39Å; N241-S245 PolarHBondContact O-N 3.42Å; N241-S245 PolarHBondContact O-OG 3.08Å; C242-S245 PolarHBondContact O-N 2.71Å
246	L	88.4	Confident	91.3	Very high	74 Å²	74	64.2 Å²	64.2	39%	0.387	33%	0.334	S	S	.	.	H	α-helix	trans	-93.8	-29.3	-177.7	-66.7	172.1	0	0	0	114.1	E220 F238 C242 E244	E220-L246 HydrophobicContact CB-CD1 4.36Å; E220-L246 HydrophobicContact CG-CD1 4.04Å; F238-L246 HydrophobicContact CD1-CD1 4.3Å; F238-L246 HydrophobicContact CE1-CD1 4Å; C242-L246 VanDerWaalsContact O-CB 3.31Å; C242-L246 WeakPolarHBondContact O-CB 3.47Å; C242-L246 WeakPolarHBondContact O-CG 3.34Å; C242-L246 PolarHBondContact O-N 2.8Å; E244-L246 PolarHBondContact O-N 3.28Å
247	Y	87.8	Confident	91.3	Very high	92 Å²	92	60.4 Å²	60.4	36%	0.361	32%	0.322	S	S	.	.	H	α-helix	trans	-138.8	-1.3	-165.5	-46	-53	0	0	0	116	K233 F238 F243 E244	K233-Y247 HydrophobicContact CD-CD2 4Å; K233-Y247 HydrophobicContact CD-CE2 3.57Å; K233-Y247 VanDerWaalsContact NZ-CZ 3.25Å; F238-Y247 HydrophobicContact CE1-CE2 4.3Å; F238-Y247 HydrophobicContact CZ-CE2 4.32Å; F243-Y247 HydrophobicContact CD1-CD2 4.26Å; F243-Y247 AromaticContact CD2-CD2 3.58Å; F243-Y247 HydrophobicContact CD2-CD2 3.58Å; F243-Y247 HydrophobicContact CD2-CE2 4.01Å; F243-Y247 HydrophobicContact CE1-CD2 4.33Å; F243-Y247 AromaticContact CE2-CD2 3.67Å; F243-Y247 HydrophobicContact CE2-CD2 3.67Å; F243-Y247 HydrophobicContact CE2-CE2 4.22Å; F243-Y247 AromaticContact CG-CD2 3.89Å; F243-Y247 HydrophobicContact CG-CD2 3.89Å; F243-Y247 HydrophobicContact CZ-CD2 4.05Å; F243-Y247 WeakPolarHBondContact O-CA 3.17Å; F243-Y247 WeakPolarHBondContact O-CB 3.38Å; F243-Y247 WeakPolarHBondContact O-CD2 3.25Å; F243-Y247 PolarHBondContact O-N 3.42Å; E244-Y247 PolarHBondContact O-N 3.02Å
248	A	87.4	Confident	91.1	Very high	16 Å²	16	60.2 Å²	60.2	13%	0.132	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-77.2	126.2	174.8	0	0	0	0	0	111.5	E244 H257	E244-A248 HydrophobicContact CB-CB 4.14Å; E244-A248 HydrophobicContact CG-CB 4.45Å; E244-A248 WeakPolarHBondContact O-CB 3.27Å; E244-A248 PolarHBondContact O-N 2.99Å; A248-H257 HydrophobicContact CB-CB 4.11Å; A248-H257 PolarHBondContact O-ND1 2.95Å
249	E	90.2	Very high	90.7	Very high	92 Å²	92	60 Å²	60	43%	0.43	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-65.8	149.4	171	-58.1	-71.9	-175.9	0	0	110.7	I258 H271	E249-I258 WeakPolarHBondContact O-CB 3.48Å; E249-I258 PolarHBondContact O-N 3.08Å; E249-H271 HydrophobicContact CB-CB 4.17Å
250	Y	91.7	Very high	90.2	Very high	134 Å²	134	62.5 Å²	62.5	53%	0.525	34%	0.335	S	S	.	.	B	Isolated β-bridge	trans	-87.7	148.6	-178.3	-65	-86.5	0	0	0	112.3	G255 H257	Y250-G255 WeakPolarHBondContact CD1-O 3.16Å; Y250-H257 AromaticContact CE1-CD2 3.65Å; Y250-H257 AromaticContact CE1-CE1 3.38Å; Y250-H257 WeakPolarHBondContact CE1-CE1 3.43Å; Y250-H257 AromaticContact CE1-CG 3.85Å; Y250-H257 AromaticContact CE1-ND1 3.67Å; Y250-H257 AromaticContact CE1-NE2 3.33Å; Y250-H257 VanDerWaalsContact CE1-NE2 3.33Å; Y250-H257 WeakPolarHBondContact CE1-NE2 3.36Å; Y250-H257 AromaticContact CZ-CE1 3.31Å; Y250-H257 AromaticContact CZ-ND1 3.83Å; Y250-H257 AromaticContact CZ-NE2 3.63Å; Y250-H257 PolarHBondContact OH-CE1 2.79Å; Y250-H257 PolarHBondContact OH-NE2 2.74Å
251	C	93.4	Very high	89.8	Confident	2 Å²	2	66.8 Å²	66.8	1%	0.014	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-83.7	117.4	174.7	178.7	0	0	0	0	111.9	T253 C254 G255 E256 I258 H271 H273	C251-T253 PolarHBondContact O-N 3.29Å; C251-T253 VanDerWaalsContact O-N 3.1Å; C251-C254 PolarHBondContact O-N 3.29Å; C251-G255 WeakPolarHBondContact O-CA 3.17Å; C251-G255 PolarHBondContact O-N 2.72Å; C251-E256 WeakPolarHBondContact CB-O 3.47Å; C251-E256 PolarHBondContact N-O 3.41Å; C251-I258 HydrophobicContact CB-CD1 3.99Å; C251-I258 HydrophobicContact CB-CG1 3.86Å; C251-H271 WeakPolarHBondContact CA-O 3.36Å; C251-H273 WeakPolarHBondContact CB-CE1 3.36Å; C251-H273 VanDerWaalsContact CB-ND1 3.26Å; C251-H273 WeakPolarHBondContact CB-ND1 3.44Å; C251-H273 PolarHBondContact SG-ND1 3.44Å
252	E	91.6	Very high	89.5	Confident	129 Å²	129	66.1 Å²	66.1	60%	0.603	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-25.2	-177.9	-168.4	69.8	-141.9	0	0	113.1	H271 W272	E252-H271 PolarHBondContact N-O 3.22Å; E252-W272 HydrophobicContact CB-CZ2 4.4Å
253	T	90.8	Very high	89.2	Confident	64 Å²	64	68.6 Å²	68.6	39%	0.393	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-26.9	-179.1	-62.1	0	0	0	0	114.2	C251 W272 C278	C251-T253 PolarHBondContact O-N 3.29Å; C251-T253 VanDerWaalsContact O-N 3.1Å; T253-W272 PolarHBondContact OG1-NE1 2.85Å; T253-C278 VanDerWaalsContact CB-O 3.27Å; T253-C278 WeakPolarHBondContact CB-O 3.49Å; T253-C278 PolarHBondContact OG1-O 2.86Å
254	C	91.9	Very high	89.1	Confident	59 Å²	59	70.3 Å²	70.3	40%	0.399	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.6	-7.2	-175.6	73.2	0	0	0	0	115.7	C251 E256 H273	C251-C254 PolarHBondContact O-N 3.29Å; C254-E256 PolarHBondContact O-N 3.11Å; C254-H273 VanDerWaalsContact SG-CE1 3.56Å
255	G	89	Confident	89.2	Confident	51 Å²	51	70.8 Å²	70.8	53%	0.526	38%	0.383	S	S	.	.			trans	76.4	-10.7	179.6	0	0	0	0	0	115.7	Y250 C251	Y250-G255 WeakPolarHBondContact CD1-O 3.16Å; C251-G255 WeakPolarHBondContact O-CA 3.17Å; C251-G255 PolarHBondContact O-N 2.72Å
256	E	89.8	Confident	89.3	Confident	127 Å²	127	70.7 Å²	70.7	59%	0.593	38%	0.379	S	S	*	.			trans	-80.4	154.2	-178.9	-63.2	-62.3	161.8	0	0	112.8	C251 C254	C251-E256 WeakPolarHBondContact CB-O 3.47Å; C251-E256 PolarHBondContact N-O 3.41Å; C254-E256 PolarHBondContact O-N 3.11Å
257	H	89.3	Confident	89.5	Confident	64 Å²	64	72.1 Å²	72.1	30%	0.296	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-61.5	141.3	173.7	-70.5	-95.1	0	0	0	111.8	A248 Y250 G259 H273	A248-H257 HydrophobicContact CB-CB 4.11Å; A248-H257 PolarHBondContact O-ND1 2.95Å; Y250-H257 AromaticContact CE1-CD2 3.65Å; Y250-H257 AromaticContact CE1-CE1 3.38Å; Y250-H257 WeakPolarHBondContact CE1-CE1 3.43Å; Y250-H257 AromaticContact CE1-CG 3.85Å; Y250-H257 AromaticContact CE1-ND1 3.67Å; Y250-H257 AromaticContact CE1-NE2 3.33Å; Y250-H257 VanDerWaalsContact CE1-NE2 3.33Å; Y250-H257 WeakPolarHBondContact CE1-NE2 3.36Å; Y250-H257 AromaticContact CZ-CE1 3.31Å; Y250-H257 AromaticContact CZ-ND1 3.83Å; Y250-H257 AromaticContact CZ-NE2 3.63Å; Y250-H257 PolarHBondContact OH-CE1 2.79Å; Y250-H257 PolarHBondContact OH-NE2 2.74Å; H257-G259 PolarHBondContact O-N 3.44Å; H257-H273 PolarHBondContact O-NE2 3.5Å
258	I	90.2	Very high	89.6	Confident	9 Å²	9	74.3 Å²	74.3	5%	0.046	40%	0.397	C	S	.	.			trans	-92.3	85.3	172.4	-55.9	162.6	0	0	0	107.9	E249 C251 H262 Q264 H271	E249-I258 WeakPolarHBondContact O-CB 3.48Å; E249-I258 PolarHBondContact O-N 3.08Å; C251-I258 HydrophobicContact CB-CD1 3.99Å; C251-I258 HydrophobicContact CB-CG1 3.86Å; I258-H262 HydrophobicContact CG2-CB 4.17Å; I258-Q264 HydrophobicContact CD1-CG 4.11Å; I258-Q264 HydrophobicContact CG2-CB 3.97Å; I258-Q264 HydrophobicContact CG2-CG 4.07Å; I258-H271 HydrophobicContact CD1-CB 3.65Å
259	G	85.3	Confident	89.6	Confident	2 Å²	2	76.6 Å²	76.6	2%	0.021	42%	0.423	C	S	.	.			trans	-60.7	160.9	-179.5	0	0	0	0	0	113.4	E244 H257 D261 H262	E244-G259 VanDerWaalsContact OE1-CA 3.28Å; E244-G259 WeakPolarHBondContact OE1-CA 3.27Å; H257-G259 PolarHBondContact O-N 3.44Å; G259-D261 PolarHBondContact O-N 2.82Å; G259-D261 VanDerWaalsContact O-N 3.17Å; G259-H262 PolarHBondContact N-ND1 2.72Å; G259-H262 WeakPolarHBondContact O-CB 3.48Å; G259-H262 PolarHBondContact O-N 3.06Å; G259-H262 PolarHBondContact O-ND1 2.92Å
260	V	84.2	Confident	89.7	Confident	71 Å²	71	73.8 Å²	73.8	43%	0.43	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-25.4	-165.8	175.9	0	0	0	0	113.3	I231 F243 E244 H262	I231-V260 HydrophobicContact CD1-CB 4.27Å; I231-V260 HydrophobicContact CD1-CG1 3.96Å; I231-V260 HydrophobicContact CD1-CG2 3.7Å; F243-V260 HydrophobicContact CD1-CG2 3.87Å; F243-V260 HydrophobicContact CE1-CG2 4.17Å; E244-V260 HydrophobicContact CG-CG2 3.88Å; E244-V260 PolarHBondContact OE1-N 3.05Å; V260-H262 VanDerWaalsContact C-N 3.34Å
261	D	84.4	Confident	89.8	Confident	106 Å²	106	69.1 Å²	69.1	57%	0.567	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-12.5	173.7	-71.7	-28.5	0	0	0	114.1	R229 G259	R229-D261 IonicContact CZ-OD1 3.62Å; R229-D261 IonicContact CZ-OD2 3.43Å; R229-D261 IonicContact NH1-OD1 2.82Å; R229-D261 PolarHBondContact NH1-OD1 2.86Å; R229-D261 IonicContact NH1-OD2 3.29Å; R229-D261 PolarHBondContact NH1-OD2 3.13Å; R229-D261 IonicContact NH2-OD1 3.7Å; R229-D261 PolarHBondContact NH2-OD1 3.02Å; R229-D261 IonicContact NH2-OD2 2.72Å; G259-D261 PolarHBondContact O-N 2.82Å; G259-D261 VanDerWaalsContact O-N 3.17Å
262	H	86.3	Confident	89.9	Confident	105 Å²	105	69.2 Å²	69.2	49%	0.486	39%	0.393	S	S	.	.	S	Bend	trans	-90.5	120.4	-178.3	-56.4	96.6	0	0	0	110.3	I258 G259 V260 Q264	I258-H262 HydrophobicContact CG2-CB 4.17Å; G259-H262 PolarHBondContact N-ND1 2.72Å; G259-H262 WeakPolarHBondContact O-CB 3.48Å; G259-H262 PolarHBondContact O-N 3.06Å; G259-H262 PolarHBondContact O-ND1 2.92Å; V260-H262 VanDerWaalsContact C-N 3.34Å; H262-Q264 PolarHBondContact O-N 3.49Å
263	A	88.6	Confident	90	Very high	72 Å²	72	64 Å²	64	60%	0.595	37%	0.368	S	S	*	.			trans	-55.6	137.9	166.5	0	0	0	0	0	109.9	A274	A263-A274 HydrophobicContact CB-CB 3.79Å; A263-A274 VanDerWaalsContact O-CB 3.26Å; A263-A274 WeakPolarHBondContact O-CB 3.42Å; A263-A274 PolarHBondContact O-N 3.4Å
264	Q	91.6	Very high	90.1	Very high	76 Å²	76	62.3 Å²	62.3	36%	0.355	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	136.5	-173.2	-176.4	176.3	92.6	0	0	110.6	I258 H262 T266 H271 W272	I258-Q264 HydrophobicContact CD1-CG 4.11Å; I258-Q264 HydrophobicContact CG2-CB 3.97Å; I258-Q264 HydrophobicContact CG2-CG 4.07Å; H262-Q264 PolarHBondContact O-N 3.49Å; Q264-T266 HydrophobicContact CG-CG2 3.78Å; Q264-H271 VanDerWaalsContact CD-ND1 3.34Å; Q264-H271 HydrophobicContact CG-CB 4.46Å; Q264-H271 PolarHBondContact OE1-ND1 3.4Å; Q264-W272 WeakPolarHBondContact CA-O 3.37Å
265	M	91.4	Very high	90.2	Very high	56 Å²	56	62.3 Å²	62.3	28%	0.276	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	138.3	164	-61.9	-60.8	-67.2	0	0	108.9	H271 W272 A274 F279 L289	M265-H271 WeakPolarHBondContact O-CA 3.45Å; M265-W272 HydrophobicContact CB-CB 4.39Å; M265-W272 PolarHBondContact N-O 2.67Å; M265-W272 PolarHBondContact O-N 2.89Å; M265-A274 HydrophobicContact CG-CB 3.8Å; M265-A274 HydrophobicContact SD-CB 4.19Å; M265-F279 HydrophobicContact CB-CD1 4.47Å; M265-F279 HydrophobicContact CB-CD2 3.48Å; M265-F279 VanDerWaalsContact CB-CD2 3.48Å; M265-F279 HydrophobicContact CB-CE2 3.71Å; M265-F279 HydrophobicContact CB-CG 3.91Å; M265-F279 HydrophobicContact CB-CZ 4.31Å; M265-F279 HydrophobicContact CE-CD1 4.08Å; M265-F279 HydrophobicContact CE-CE1 3.67Å; M265-F279 HydrophobicContact CE-CE2 4.42Å; M265-F279 HydrophobicContact CE-CZ 3.86Å; M265-F279 HydrophobicContact CG-CB 4.09Å; M265-F279 HydrophobicContact CG-CD1 3.98Å; M265-F279 HydrophobicContact CG-CD2 3.84Å; M265-F279 HydrophobicContact CG-CE1 4.4Å; M265-F279 HydrophobicContact CG-CE2 4.26Å; M265-F279 HydrophobicContact CG-CG 3.69Å; M265-L289 HydrophobicContact CG-CD2 3.85Å; M265-L289 HydrophobicContact SD-CD2 4.05Å
266	T	93	Very high	90.3	Very high	84 Å²	84	67 Å²	67	52%	0.515	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	141.9	179	61.7	0	0	0	0	111.5	Q264 Q270 H271	Q264-T266 HydrophobicContact CG-CG2 3.78Å; T266-Q270 WeakPolarHBondContact CA-O 3.39Å; T266-H271 VanDerWaalsContact CG2-ND1 3.32Å; T266-H271 WeakPolarHBondContact CG2-ND1 3.25Å
267	Y	91.1	Very high	90.5	Very high	104 Å²	104	65.9 Å²	65.9	41%	0.408	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	131	173.7	-173.8	-88.7	0	0	0	110.3	G269 Q270 F293 P295	Y267-G269 PolarHBondContact O-N 2.9Å; Y267-G269 VanDerWaalsContact O-N 3.11Å; Y267-Q270 PolarHBondContact N-O 2.99Å; Y267-Q270 WeakPolarHBondContact O-CB 3.26Å; Y267-Q270 PolarHBondContact O-N 3.36Å; Y267-F293 AromaticContact CD2-CE2 3.95Å; Y267-F293 HydrophobicContact CD2-CE2 3.95Å; Y267-F293 AromaticContact CD2-CZ 3.75Å; Y267-F293 HydrophobicContact CD2-CZ 3.75Å; Y267-F293 HydrophobicContact CE2-CE2 4.44Å; Y267-F293 HydrophobicContact CE2-CZ 4.43Å; Y267-F293 HydrophobicContact CG-CE2 4.01Å; Y267-F293 HydrophobicContact CG-CZ 4.09Å; Y267-P295 HydrophobicContact CD1-CB 3.9Å; Y267-P295 HydrophobicContact CD1-CG 4.17Å; Y267-P295 HydrophobicContact CE1-CB 3.48Å; Y267-P295 VanDerWaalsContact CE1-CB 3.48Å; Y267-P295 HydrophobicContact CE1-CG 3.42Å; Y267-P295 VanDerWaalsContact CE1-CG 3.42Å; Y267-P295 HydrophobicContact CE2-CG 4.13Å; Y267-P295 VanDerWaalsContact CZ-CG 3.41Å; Y267-P295 WeakPolarHBondContact OH-CG 3.33Å
268	D	89.7	Confident	90.7	Very high	137 Å²	137	63.3 Å²	63.3	73%	0.733	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.3	42.7	176.9	-163.4	30.2	0	0	0	114.3	Q270	D268-Q270 PolarHBondContact O-N 3.22Å; D268-Q270 PolarHBondContact O-NE2 3.27Å
269	G	89.1	Confident	90.9	Very high	65 Å²	65	63 Å²	63	67%	0.67	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	10.9	-179.2	0	0	0	0	0	115.9	Y267	Y267-G269 PolarHBondContact O-N 2.9Å; Y267-G269 VanDerWaalsContact O-N 3.11Å
270	Q	92.1	Very high	91.4	Very high	32 Å²	32	63.3 Å²	63.3	15%	0.15	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	152	164.5	-68.1	133.3	81.9	0	0	110.1	T266 Y267 D268 W272 G298	T266-Q270 WeakPolarHBondContact CA-O 3.39Å; Y267-Q270 PolarHBondContact N-O 2.99Å; Y267-Q270 WeakPolarHBondContact O-CB 3.26Å; Y267-Q270 PolarHBondContact O-N 3.36Å; D268-Q270 PolarHBondContact O-N 3.22Å; D268-Q270 PolarHBondContact O-NE2 3.27Å; Q270-W272 HydrophobicContact CB-CE3 4.5Å; Q270-W272 HydrophobicContact CB-CH2 3.35Å; Q270-W272 HydrophobicContact CB-CZ2 3.88Å; Q270-W272 HydrophobicContact CB-CZ3 3.71Å; Q270-W272 HydrophobicContact CG-CH2 4.27Å; Q270-G298 PolarHBondContact OE1-O 3.05Å
271	H	93.9	Very high	91.8	Very high	36 Å²	36	59.9 Å²	59.9	17%	0.167	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	144.8	-174.3	-59.3	-107.3	0	0	0	110.1	E249 C251 E252 I258 Q264 M265 T266	E249-H271 HydrophobicContact CB-CB 4.17Å; C251-H271 WeakPolarHBondContact CA-O 3.36Å; E252-H271 PolarHBondContact N-O 3.22Å; I258-H271 HydrophobicContact CD1-CB 3.65Å; Q264-H271 VanDerWaalsContact CD-ND1 3.34Å; Q264-H271 HydrophobicContact CG-CB 4.46Å; Q264-H271 PolarHBondContact OE1-ND1 3.4Å; M265-H271 WeakPolarHBondContact O-CA 3.45Å; T266-H271 VanDerWaalsContact CG2-ND1 3.32Å; T266-H271 WeakPolarHBondContact CG2-ND1 3.25Å
272	W	94.1	Very high	92.2	Very high	4 Å²	4	56.1 Å²	56.1	2%	0.015	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	149.4	176.3	-61.4	-91.6	0	0	0	110.4	E252 T253 Q264 M265 Q270 F279 I300	E252-W272 HydrophobicContact CB-CZ2 4.4Å; T253-W272 PolarHBondContact OG1-NE1 2.85Å; Q264-W272 WeakPolarHBondContact CA-O 3.37Å; M265-W272 HydrophobicContact CB-CB 4.39Å; M265-W272 PolarHBondContact N-O 2.67Å; M265-W272 PolarHBondContact O-N 2.89Å; Q270-W272 HydrophobicContact CB-CE3 4.5Å; Q270-W272 HydrophobicContact CB-CH2 3.35Å; Q270-W272 HydrophobicContact CB-CZ2 3.88Å; Q270-W272 HydrophobicContact CB-CZ3 3.71Å; Q270-W272 HydrophobicContact CG-CH2 4.27Å; W272-F279 HydrophobicContact CB-CB 4.44Å; W272-F279 HydrophobicContact CB-CD2 4Å; W272-F279 AromaticContact CD2-CD2 3.9Å; W272-F279 HydrophobicContact CD2-CD2 3.9Å; W272-F279 HydrophobicContact CD2-CE2 4.19Å; W272-F279 AromaticContact CE3-CD2 3.95Å; W272-F279 HydrophobicContact CE3-CD2 3.95Å; W272-F279 AromaticContact CE3-CE2 3.84Å; W272-F279 HydrophobicContact CE3-CE2 3.84Å; W272-F279 AromaticContact CG-CD2 3.94Å; W272-F279 HydrophobicContact CG-CD2 3.94Å; W272-F279 HydrophobicContact CZ3-CE2 4.25Å; W272-I300 HydrophobicContact CD2-CD1 4.42Å; W272-I300 HydrophobicContact CH2-CG2 4.02Å; W272-I300 HydrophobicContact CZ2-CD1 4.13Å; W272-I300 HydrophobicContact CZ2-CG1 4.48Å; W272-I300 HydrophobicContact CZ2-CG2 4.16Å
273	H	94.4	Very high	92.3	Very high	19 Å²	19	55.6 Å²	55.6	9%	0.088	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	139.2	160.5	-52.1	92.1	0	0	0	109.1	C251 C254 H257 T275 C278	C251-H273 WeakPolarHBondContact CB-CE1 3.36Å; C251-H273 VanDerWaalsContact CB-ND1 3.26Å; C251-H273 WeakPolarHBondContact CB-ND1 3.44Å; C251-H273 PolarHBondContact SG-ND1 3.44Å; C254-H273 VanDerWaalsContact SG-CE1 3.56Å; H257-H273 PolarHBondContact O-NE2 3.5Å; H273-T275 HydrophobicContact CB-CG2 4.11Å; H273-T275 PolarHBondContact O-N 2.91Å; H273-C278 HydrophobicContact CB-CB 4.02Å; H273-C278 WeakPolarHBondContact O-CB 3.22Å
274	A	93.7	Very high	92.5	Very high	30 Å²	30	54.3 Å²	54.3	25%	0.248	31%	0.306	C	S	.	.	S	Bend	trans	-77.5	52.8	175.5	0	0	0	0	0	111.6	A263 M265 L289	A263-A274 HydrophobicContact CB-CB 3.79Å; A263-A274 VanDerWaalsContact O-CB 3.26Å; A263-A274 WeakPolarHBondContact O-CB 3.42Å; A263-A274 PolarHBondContact O-N 3.4Å; M265-A274 HydrophobicContact CG-CB 3.8Å; M265-A274 HydrophobicContact SD-CB 4.19Å; A274-L289 HydrophobicContact CB-CD2 4.11Å
275	T	93	Very high	92.5	Very high	58 Å²	58	57 Å²	57	36%	0.356	32%	0.316	S	S	.	.	S	Bend	trans	-116.1	152.6	178.9	58.7	0	0	0	0	110.1	H273 T277 C278 F279	H273-T275 HydrophobicContact CB-CG2 4.11Å; H273-T275 PolarHBondContact O-N 2.91Å; T275-T277 PolarHBondContact O-N 2.82Å; T275-T277 VanDerWaalsContact O-N 3.15Å; T275-T277 PolarHBondContact OG1-OG1 3.49Å; T275-C278 PolarHBondContact O-N 2.95Å; T275-C278 WeakPolarHBondContact OG1-CB 3.18Å; T275-C278 PolarHBondContact OG1-N 3.18Å; T275-C278 PolarHBondContact OG1-SG 3.39Å; T275-C278 VanDerWaalsContact OG1-SG 3.38Å; T275-F279 PolarHBondContact O-N 2.87Å
276	E	91.9	Very high	92.6	Very high	149 Å²	149	58.2 Å²	58.2	70%	0.696	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-26.8	-176.8	-67.4	-178.9	-170.9	0	0	113.4	S287 L289	E276-S287 WeakPolarHBondContact CA-OG 3.31Å; E276-L289 HydrophobicContact CG-CD1 4.15Å
277	T	92.4	Very high	92.6	Very high	104 Å²	104	55.6 Å²	55.6	64%	0.638	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-45.8	176.8	53.5	0	0	0	0	112.4	T275 S280	T275-T277 PolarHBondContact O-N 2.82Å; T275-T277 VanDerWaalsContact O-N 3.15Å; T275-T277 PolarHBondContact OG1-OG1 3.49Å; T277-S280 PolarHBondContact O-OG 2.79Å
278	C	94.1	Very high	92.8	Very high	11 Å²	11	50.8 Å²	50.8	7%	0.074	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-46.1	-170.8	-64.7	0	0	0	0	112.3	T253 H273 T275 S280	T253-C278 VanDerWaalsContact CB-O 3.27Å; T253-C278 WeakPolarHBondContact CB-O 3.49Å; T253-C278 PolarHBondContact OG1-O 2.86Å; H273-C278 HydrophobicContact CB-CB 4.02Å; H273-C278 WeakPolarHBondContact O-CB 3.22Å; T275-C278 PolarHBondContact O-N 2.95Å; T275-C278 WeakPolarHBondContact OG1-CB 3.18Å; T275-C278 PolarHBondContact OG1-N 3.18Å; T275-C278 PolarHBondContact OG1-SG 3.39Å; T275-C278 VanDerWaalsContact OG1-SG 3.38Å; C278-S280 VanDerWaalsContact C-N 3.32Å; C278-S280 PolarHBondContact O-N 3.04Å; C278-S280 VanDerWaalsContact O-N 3.16Å
279	F	94.9	Very high	92.9	Very high	3 Å²	3	46.9 Å²	46.9	1%	0.013	27%	0.272	C	S	.	.	S	Bend	trans	-90.9	71.6	175.6	-160.6	-107.4	0	0	0	110	M265 W272 T275 S287 L288 L289 F293 I300	M265-F279 HydrophobicContact CB-CD1 4.47Å; M265-F279 HydrophobicContact CB-CD2 3.48Å; M265-F279 VanDerWaalsContact CB-CD2 3.48Å; M265-F279 HydrophobicContact CB-CE2 3.71Å; M265-F279 HydrophobicContact CB-CG 3.91Å; M265-F279 HydrophobicContact CB-CZ 4.31Å; M265-F279 HydrophobicContact CE-CD1 4.08Å; M265-F279 HydrophobicContact CE-CE1 3.67Å; M265-F279 HydrophobicContact CE-CE2 4.42Å; M265-F279 HydrophobicContact CE-CZ 3.86Å; M265-F279 HydrophobicContact CG-CB 4.09Å; M265-F279 HydrophobicContact CG-CD1 3.98Å; M265-F279 HydrophobicContact CG-CD2 3.84Å; M265-F279 HydrophobicContact CG-CE1 4.4Å; M265-F279 HydrophobicContact CG-CE2 4.26Å; M265-F279 HydrophobicContact CG-CG 3.69Å; W272-F279 HydrophobicContact CB-CB 4.44Å; W272-F279 HydrophobicContact CB-CD2 4Å; W272-F279 AromaticContact CD2-CD2 3.9Å; W272-F279 HydrophobicContact CD2-CD2 3.9Å; W272-F279 HydrophobicContact CD2-CE2 4.19Å; W272-F279 AromaticContact CE3-CD2 3.95Å; W272-F279 HydrophobicContact CE3-CD2 3.95Å; W272-F279 AromaticContact CE3-CE2 3.84Å; W272-F279 HydrophobicContact CE3-CE2 3.84Å; W272-F279 AromaticContact CG-CD2 3.94Å; W272-F279 HydrophobicContact CG-CD2 3.94Å; W272-F279 HydrophobicContact CZ3-CE2 4.25Å; T275-F279 PolarHBondContact O-N 2.87Å; F279-S287 PolarHBondContact O-OG 3.24Å; F279-L288 HydrophobicContact CD1-CB 3.62Å; F279-L288 HydrophobicContact CE1-CB 3.54Å; F279-L288 HydrophobicContact CZ-CB 4.43Å; F279-L288 PolarHBondContact O-N 2.96Å; F279-L289 HydrophobicContact CB-CD2 3.92Å; F279-L289 HydrophobicContact CB-CG 4.39Å; F279-L289 HydrophobicContact CD1-CD2 3.88Å; F279-L289 HydrophobicContact CD1-CG 4.38Å; F279-L289 HydrophobicContact CG-CD2 4.23Å; F279-F293 HydrophobicContact CE1-CD1 4.23Å; F279-F293 HydrophobicContact CE1-CE1 4.35Å; F279-F293 AromaticContact CZ-CD1 3.96Å; F279-F293 HydrophobicContact CZ-CD1 3.96Å; F279-F293 AromaticContact CZ-CE1 3.78Å; F279-F293 HydrophobicContact CZ-CE1 3.78Å; F279-F293 HydrophobicContact CZ-CE2 4.49Å; F279-F293 HydrophobicContact CZ-CG 4.4Å; F279-F293 HydrophobicContact CZ-CZ 4.06Å; F279-I300 HydrophobicContact CD2-CD1 3.55Å; F279-I300 HydrophobicContact CE2-CD1 3.47Å; F279-I300 VanDerWaalsContact CE2-CD1 3.47Å; F279-I300 HydrophobicContact CG-CD1 4.22Å; F279-I300 HydrophobicContact CZ-CD1 4.07Å
280	S	94.6	Very high	92.9	Very high	7 Å²	7	48 Å²	48	5%	0.049	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-129.4	153.9	-174.5	64	0	0	0	0	112.6	T277 C278 A282 T286	T277-S280 PolarHBondContact O-OG 2.79Å; C278-S280 VanDerWaalsContact C-N 3.32Å; C278-S280 PolarHBondContact O-N 3.04Å; C278-S280 VanDerWaalsContact O-N 3.16Å; S280-A282 PolarHBondContact O-N 2.72Å; S280-T286 CarbonylContact C-O 3.6Å; S280-T286 WeakPolarHBondContact CA-O 3.43Å
281	C	94.2	Very high	92.9	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	30%	0.299	C	S	.	.			trans	-62.6	123.2	178.4	169.4	0	0	0	0	110.8	Q283 K285 T286 L288 I300 C302	C281-Q283 CarbonylContact O-C 3.58Å; C281-Q283 PolarHBondContact O-N 2.98Å; C281-K285 VanDerWaalsContact O-CA 3.26Å; C281-K285 WeakPolarHBondContact O-CA 3.24Å; C281-K285 PolarHBondContact O-N 3.13Å; C281-T286 PolarHBondContact N-O 2.6Å; C281-L288 HydrophobicContact CB-CD1 4.32Å; C281-L288 HydrophobicContact CB-CD2 4.25Å; C281-L288 HydrophobicContact CB-CG 4.38Å; C281-I300 WeakPolarHBondContact CA-O 3.41Å; C281-C302 HydrophobicContact CB-CB 4.07Å; C281-C302 PolarHBondContact SG-N 2.67Å; C281-C302 VanDerWaalsContact SG-N 3.41Å
282	A	91.4	Very high	92.7	Very high	26 Å²	26	53.6 Å²	53.6	22%	0.215	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-35.2	-172.8	0	0	0	0	0	114	S280 K285 Q299 I300 Y301	S280-A282 PolarHBondContact O-N 2.72Å; A282-K285 WeakPolarHBondContact O-CE 3.36Å; A282-K285 PolarHBondContact O-NZ 3.36Å; A282-Q299 HydrophobicContact CB-CB 4.05Å; A282-Q299 HydrophobicContact CB-CG 4.43Å; A282-I300 PolarHBondContact N-O 3.39Å; A282-Y301 HydrophobicContact CB-CD1 4.28Å; A282-Y301 HydrophobicContact CB-CE1 3.85Å
283	Q	89.9	Confident	92.6	Very high	94 Å²	94	56.4 Å²	56.4	44%	0.439	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-80.2	174.3	-76.8	-110.4	-16.7	0	0	113.1	C281 K285 Y301 C306	C281-Q283 CarbonylContact O-C 3.58Å; C281-Q283 PolarHBondContact O-N 2.98Å; Q283-K285 VanDerWaalsContact C-N 3.25Å; Q283-K285 PolarHBondContact O-N 3.39Å; Q283-Y301 HydrophobicContact CG-CD1 4.28Å; Q283-Y301 HydrophobicContact CG-CE1 3.93Å; Q283-C306 HydrophobicContact CB-CB 4.22Å; Q283-C306 WeakPolarHBondContact CG-O 3.25Å
284	C	92.1	Very high	92.5	Very high	46 Å²	46	58.6 Å²	58.6	31%	0.311	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	0.2	-170.7	68.8	0	0	0	0	116.1	T286	C284-T286 PolarHBondContact O-N 2.87Å; C284-T286 PolarHBondContact SG-OG1 2.84Å
285	K	91.6	Very high	92.5	Very high	132 Å²	132	59.4 Å²	59.4	57%	0.574	35%	0.354	S	S	*	.			trans	54.8	10	-179.5	-54.2	-51.7	-170.7	-168.2	0	116.7	C281 A282 Q283	C281-K285 VanDerWaalsContact O-CA 3.26Å; C281-K285 WeakPolarHBondContact O-CA 3.24Å; C281-K285 PolarHBondContact O-N 3.13Å; A282-K285 WeakPolarHBondContact O-CE 3.36Å; A282-K285 PolarHBondContact O-NZ 3.36Å; Q283-K285 VanDerWaalsContact C-N 3.25Å; Q283-K285 PolarHBondContact O-N 3.39Å
286	T	92.5	Very high	92.3	Very high	81 Å²	81	60.2 Å²	60.2	50%	0.497	35%	0.353	S	S	.	.			trans	-61.1	135.4	168.9	-46	0	0	0	0	110	S280 C281 C284	S280-T286 CarbonylContact C-O 3.6Å; S280-T286 WeakPolarHBondContact CA-O 3.43Å; C281-T286 PolarHBondContact N-O 2.6Å; C284-T286 PolarHBondContact O-N 2.87Å; C284-T286 PolarHBondContact SG-OG1 2.84Å
287	S	94.4	Very high	91.9	Very high	30 Å²	30	61.6 Å²	61.6	21%	0.21	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-61	145.9	175.6	-174.3	0	0	0	0	111.7	E276 F279 L289	E276-S287 WeakPolarHBondContact CA-OG 3.31Å; F279-S287 PolarHBondContact O-OG 3.24Å; S287-L289 WeakPolarHBondContact OG-CG 3.14Å; S287-L289 PolarHBondContact OG-N 3.41Å
288	L	94	Very high	91.5	Very high	2 Å²	2	58.6 Å²	58.6	1%	0.01	35%	0.349	C	S	.	.			trans	-107.5	5	177.2	-61.6	173.7	0	0	0	112.3	F279 C281 G290 C291 F293 I300 C302	F279-L288 HydrophobicContact CD1-CB 3.62Å; F279-L288 HydrophobicContact CE1-CB 3.54Å; F279-L288 HydrophobicContact CZ-CB 4.43Å; F279-L288 PolarHBondContact O-N 2.96Å; C281-L288 HydrophobicContact CB-CD1 4.32Å; C281-L288 HydrophobicContact CB-CD2 4.25Å; C281-L288 HydrophobicContact CB-CG 4.38Å; L288-G290 PolarHBondContact O-N 3.11Å; L288-C291 PolarHBondContact O-N 3.31Å; L288-C291 VanDerWaalsContact O-N 3.08Å; L288-F293 HydrophobicContact CB-CB 4.35Å; L288-F293 HydrophobicContact CD1-CB 3.86Å; L288-F293 HydrophobicContact CD2-CB 4.08Å; L288-F293 HydrophobicContact CG-CB 4.32Å; L288-I300 HydrophobicContact CD1-CB 3.83Å; L288-I300 HydrophobicContact CD1-CD1 3.77Å; L288-I300 HydrophobicContact CD1-CG1 3.69Å; L288-C302 HydrophobicContact CD2-CB 3.64Å
289	L	93.4	Very high	91.3	Very high	55 Å²	55	62.8 Å²	62.8	29%	0.288	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	122	178.9	-65.8	175.8	0	0	0	110.7	M265 A274 E276 F279 S287 C291	M265-L289 HydrophobicContact CG-CD2 3.85Å; M265-L289 HydrophobicContact SD-CD2 4.05Å; A274-L289 HydrophobicContact CB-CD2 4.11Å; E276-L289 HydrophobicContact CG-CD1 4.15Å; F279-L289 HydrophobicContact CB-CD2 3.92Å; F279-L289 HydrophobicContact CB-CG 4.39Å; F279-L289 HydrophobicContact CD1-CD2 3.88Å; F279-L289 HydrophobicContact CD1-CG 4.38Å; F279-L289 HydrophobicContact CG-CD2 4.23Å; S287-L289 WeakPolarHBondContact OG-CG 3.14Å; S287-L289 PolarHBondContact OG-N 3.41Å; L289-C291 PolarHBondContact O-N 3.02Å; L289-C291 VanDerWaalsContact O-N 3.15Å
290	G	89.1	Confident	91.2	Very high	90 Å²	90	62.9 Å²	62.9	93%	0.928	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	-2.3	-175.5	0	0	0	0	0	115.2	L288	L288-G290 PolarHBondContact O-N 3.11Å
291	C	90.3	Very high	91.2	Very high	67 Å²	67	63.4 Å²	63.4	45%	0.453	37%	0.369	S	S	.	.	S	Bend	trans	-97.4	149	-179.8	-68.3	0	0	0	0	111.3	L288 L289 F293	L288-C291 PolarHBondContact O-N 3.31Å; L288-C291 VanDerWaalsContact O-N 3.08Å; L289-C291 PolarHBondContact O-N 3.02Å; L289-C291 VanDerWaalsContact O-N 3.15Å; C291-F293 PolarHBondContact O-N 3.33Å
292	P	89.9	Confident	91.2	Very high	117 Å²	117	65.7 Å²	65.7	76%	0.76	39%	0.385	S	S	*	.			trans	-63.3	136.3	165	29	-33.8	0	0	0	109.6
293	F	93.5	Very high	91.2	Very high	63 Å²	63	66.2 Å²	66.2	28%	0.276	39%	0.387	S	S	.	.			trans	-129	157.9	177.2	67	-85.9	0	0	0	111.1	Y267 F279 L288 C291 P295 I300 Y301	Y267-F293 AromaticContact CD2-CE2 3.95Å; Y267-F293 HydrophobicContact CD2-CE2 3.95Å; Y267-F293 AromaticContact CD2-CZ 3.75Å; Y267-F293 HydrophobicContact CD2-CZ 3.75Å; Y267-F293 HydrophobicContact CE2-CE2 4.44Å; Y267-F293 HydrophobicContact CE2-CZ 4.43Å; Y267-F293 HydrophobicContact CG-CE2 4.01Å; Y267-F293 HydrophobicContact CG-CZ 4.09Å; F279-F293 HydrophobicContact CE1-CD1 4.23Å; F279-F293 HydrophobicContact CE1-CE1 4.35Å; F279-F293 AromaticContact CZ-CD1 3.96Å; F279-F293 HydrophobicContact CZ-CD1 3.96Å; F279-F293 AromaticContact CZ-CE1 3.78Å; F279-F293 HydrophobicContact CZ-CE1 3.78Å; F279-F293 HydrophobicContact CZ-CE2 4.49Å; F279-F293 HydrophobicContact CZ-CG 4.4Å; F279-F293 HydrophobicContact CZ-CZ 4.06Å; L288-F293 HydrophobicContact CB-CB 4.35Å; L288-F293 HydrophobicContact CD1-CB 3.86Å; L288-F293 HydrophobicContact CD2-CB 4.08Å; L288-F293 HydrophobicContact CG-CB 4.32Å; C291-F293 PolarHBondContact O-N 3.33Å; F293-P295 HydrophobicContact CD2-CB 4.46Å; F293-P295 HydrophobicContact CD2-CG 4.44Å; F293-P295 HydrophobicContact CE2-CB 4.28Å; F293-P295 HydrophobicContact CE2-CG 4.2Å; F293-I300 HydrophobicContact CD2-CB 4.12Å; F293-I300 HydrophobicContact CD2-CG2 3.81Å; F293-I300 HydrophobicContact CE2-CG2 3.93Å; F293-Y301 CarbonylContact C-O 3.53Å; F293-Y301 WeakPolarHBondContact CA-O 3.48Å
294	L	92.3	Very high	91.2	Very high	66 Å²	66	68.8 Å²	68.8	35%	0.346	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	103.9	-178.9	-161.6	166	0	0	0	108.3	K296 Y301 K304	L294-K296 HydrophobicContact CD2-CB 4.34Å; L294-Y301 PolarHBondContact N-O 3.26Å; L294-Y301 WeakPolarHBondContact O-CD2 3.5Å; L294-Y301 PolarHBondContact O-N 3.08Å; L294-K304 HydrophobicContact CD1-CB 4.4Å
295	P	92	Very high	91.2	Very high	47 Å²	47	70.1 Å²	70.1	31%	0.305	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	134	177.4	29.6	-29.7	0	0	0	111.1	Y267 F293 Q299 I300	Y267-P295 HydrophobicContact CD1-CB 3.9Å; Y267-P295 HydrophobicContact CD1-CG 4.17Å; Y267-P295 HydrophobicContact CE1-CB 3.48Å; Y267-P295 VanDerWaalsContact CE1-CB 3.48Å; Y267-P295 HydrophobicContact CE1-CG 3.42Å; Y267-P295 VanDerWaalsContact CE1-CG 3.42Å; Y267-P295 HydrophobicContact CE2-CG 4.13Å; Y267-P295 VanDerWaalsContact CZ-CG 3.41Å; Y267-P295 WeakPolarHBondContact OH-CG 3.33Å; F293-P295 HydrophobicContact CD2-CB 4.46Å; F293-P295 HydrophobicContact CD2-CG 4.44Å; F293-P295 HydrophobicContact CE2-CB 4.28Å; F293-P295 HydrophobicContact CE2-CG 4.2Å; P295-Q299 CarbonylContact C-O 3.55Å; P295-Q299 WeakPolarHBondContact CA-O 3.14Å; P295-I300 HydrophobicContact CB-CG2 4.43Å
296	K	89.6	Confident	91.1	Very high	74 Å²	74	64.2 Å²	64.2	32%	0.322	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	128.2	-179	175.4	-175.6	175.3	-172.8	0	109.6	L294 G298 Q299 Y301 S307	L294-K296 HydrophobicContact CD2-CB 4.34Å; K296-G298 VanDerWaalsContact C-N 3.28Å; K296-G298 PolarHBondContact O-N 3.21Å; K296-Q299 PolarHBondContact N-O 3.25Å; K296-Q299 PolarHBondContact O-N 3.13Å; K296-Q299 VanDerWaalsContact O-O 3.14Å; K296-Y301 HydrophobicContact CB-CD2 4.27Å; K296-Y301 HydrophobicContact CB-CE2 3.96Å; K296-S307 PolarHBondContact NZ-O 3.47Å
297	Q	84.2	Confident	91	Very high	178 Å²	178	60.8 Å²	60.8	83%	0.832	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	35	175	-64.7	175.3	-35.5	0	0	115.1	Q299	Q297-Q299 VanDerWaalsContact C-N 3.34Å
298	G	83.5	Confident	90.6	Very high	42 Å²	42	64 Å²	64	43%	0.433	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	19.2	-177	0	0	0	0	0	114.3	Q270 K296	Q270-G298 PolarHBondContact OE1-O 3.05Å; K296-G298 VanDerWaalsContact C-N 3.28Å; K296-G298 PolarHBondContact O-N 3.21Å
299	Q	90.1	Very high	89.8	Confident	98 Å²	98	65.6 Å²	65.6	46%	0.458	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	150.9	173.3	-65.8	-173.5	8.1	0	0	110.7	A282 P295 K296 Q297 Y301	A282-Q299 HydrophobicContact CB-CB 4.05Å; A282-Q299 HydrophobicContact CB-CG 4.43Å; P295-Q299 CarbonylContact C-O 3.55Å; P295-Q299 WeakPolarHBondContact CA-O 3.14Å; K296-Q299 PolarHBondContact N-O 3.25Å; K296-Q299 PolarHBondContact O-N 3.13Å; K296-Q299 VanDerWaalsContact O-O 3.14Å; Q297-Q299 VanDerWaalsContact C-N 3.34Å; Q299-Y301 HydrophobicContact CB-CE2 3.75Å; Q299-Y301 WeakPolarHBondContact CB-OH 3.36Å; Q299-Y301 PolarHBondContact OE1-OH 3.22Å
300	I	93.2	Very high	88.7	Confident	5 Å²	5	68.1 Å²	68.1	3%	0.026	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	137.2	-179.8	57.1	179.8	0	0	0	110.8	W272 F279 C281 A282 L288 F293 P295	W272-I300 HydrophobicContact CD2-CD1 4.42Å; W272-I300 HydrophobicContact CH2-CG2 4.02Å; W272-I300 HydrophobicContact CZ2-CD1 4.13Å; W272-I300 HydrophobicContact CZ2-CG1 4.48Å; W272-I300 HydrophobicContact CZ2-CG2 4.16Å; F279-I300 HydrophobicContact CD2-CD1 3.55Å; F279-I300 HydrophobicContact CE2-CD1 3.47Å; F279-I300 VanDerWaalsContact CE2-CD1 3.47Å; F279-I300 HydrophobicContact CG-CD1 4.22Å; F279-I300 HydrophobicContact CZ-CD1 4.07Å; C281-I300 WeakPolarHBondContact CA-O 3.41Å; A282-I300 PolarHBondContact N-O 3.39Å; L288-I300 HydrophobicContact CD1-CB 3.83Å; L288-I300 HydrophobicContact CD1-CD1 3.77Å; L288-I300 HydrophobicContact CD1-CG1 3.69Å; F293-I300 HydrophobicContact CD2-CB 4.12Å; F293-I300 HydrophobicContact CD2-CG2 3.81Å; F293-I300 HydrophobicContact CE2-CG2 3.93Å; P295-I300 HydrophobicContact CB-CG2 4.43Å
301	Y	93.5	Very high	87.2	Confident	18 Å²	18	68.6 Å²	68.6	7%	0.071	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	150	-176.9	-55.6	-87.4	0	0	0	111.5	A282 Q283 F293 L294 K296 Q299 S303 C306 S307	A282-Y301 HydrophobicContact CB-CD1 4.28Å; A282-Y301 HydrophobicContact CB-CE1 3.85Å; Q283-Y301 HydrophobicContact CG-CD1 4.28Å; Q283-Y301 HydrophobicContact CG-CE1 3.93Å; F293-Y301 CarbonylContact C-O 3.53Å; F293-Y301 WeakPolarHBondContact CA-O 3.48Å; L294-Y301 PolarHBondContact N-O 3.26Å; L294-Y301 WeakPolarHBondContact O-CD2 3.5Å; L294-Y301 PolarHBondContact O-N 3.08Å; K296-Y301 HydrophobicContact CB-CD2 4.27Å; K296-Y301 HydrophobicContact CB-CE2 3.96Å; Q299-Y301 HydrophobicContact CB-CE2 3.75Å; Q299-Y301 WeakPolarHBondContact CB-OH 3.36Å; Q299-Y301 PolarHBondContact OE1-OH 3.22Å; Y301-S303 VanDerWaalsContact C-N 3.33Å; Y301-C306 HydrophobicContact CD1-CB 4.3Å; Y301-C306 WeakPolarHBondContact CD1-O 3.33Å; Y301-S307 VanDerWaalsContact CD2-CB 3.49Å
302	C	94.2	Very high	85.6	Confident	49 Å²	49	69 Å²	69	33%	0.331	38%	0.381	S	S	.	.	S	Bend	trans	-75.6	-21.4	176.2	61.6	0	0	0	0	113.6	C281 L288 C306	C281-C302 HydrophobicContact CB-CB 4.07Å; C281-C302 PolarHBondContact SG-N 2.67Å; C281-C302 VanDerWaalsContact SG-N 3.41Å; L288-C302 HydrophobicContact CD2-CB 3.64Å; C302-C306 VanDerWaalsContact SG-SG 3.68Å
303	S	92.6	Very high	83.9	Confident	36 Å²	36	71.5 Å²	71.5	25%	0.252	38%	0.383	S	S	.	.	S	Bend	trans	-156.4	169.5	-168.7	76	0	0	0	0	112	Y301 T305 C306 S307	Y301-S303 VanDerWaalsContact C-N 3.33Å; S303-T305 PolarHBondContact OG-N 3.12Å; S303-T305 PolarHBondContact OG-OG1 3.29Å; S303-C306 PolarHBondContact OG-N 3.11Å; S303-C306 VanDerWaalsContact OG-N 3.16Å; S303-S307 PolarHBondContact O-N 2.75Å; S303-S307 VanDerWaalsContact O-N 3.11Å
304	K	90.3	Very high	81.8	Confident	149 Å²	149	72.3 Å²	72.3	65%	0.648	40%	0.401	S	S	*	.	H	α-helix	trans	-70.6	-33.1	173.9	-168.4	-179.8	177.8	-173	0	113	L294 S307 L308	L294-K304 HydrophobicContact CD1-CB 4.4Å; K304-S307 PolarHBondContact O-N 3.37Å; K304-S307 PolarHBondContact O-OG 2.88Å; K304-L308 HydrophobicContact CG-CD1 4.21Å; K304-L308 VanDerWaalsContact O-CG 3.29Å; K304-L308 WeakPolarHBondContact O-CG 3.37Å; K304-L308 PolarHBondContact O-N 3.19Å; K304-L308 VanDerWaalsContact O-N 3.14Å
305	T	90.6	Very high	79.9	Confident	73 Å²	73	73.9 Å²	73.9	45%	0.448	42%	0.417	S	S	.	.	H	α-helix	trans	-65.8	-47.4	177.7	54.2	0	0	0	0	110.3	S303 S307 L308 G309 E310	S303-T305 PolarHBondContact OG-N 3.12Å; S303-T305 PolarHBondContact OG-OG1 3.29Å; T305-S307 VanDerWaalsContact C-N 3.34Å; T305-S307 PolarHBondContact O-N 3.38Å; T305-L308 PolarHBondContact O-N 2.91Å; T305-G309 PolarHBondContact O-N 2.7Å; T305-E310 WeakPolarHBondContact CG2-OE2 3.28Å; T305-E310 PolarHBondContact O-N 3.23Å
306	C	90	Very high	78	Confident	8 Å²	8	78 Å²	78	5%	0.054	44%	0.436	C	S	.	.	H	α-helix	trans	-62.7	-37.1	174.1	-67.9	0	0	0	0	112.5	Q283 Y301 C302 S303 L308 G309	Q283-C306 HydrophobicContact CB-CB 4.22Å; Q283-C306 WeakPolarHBondContact CG-O 3.25Å; Y301-C306 HydrophobicContact CD1-CB 4.3Å; Y301-C306 WeakPolarHBondContact CD1-O 3.33Å; C302-C306 VanDerWaalsContact SG-SG 3.68Å; S303-C306 PolarHBondContact OG-N 3.11Å; S303-C306 VanDerWaalsContact OG-N 3.16Å; C306-L308 PolarHBondContact O-N 3.26Å; C306-G309 PolarHBondContact O-N 3.18Å
307	S	89.6	Confident	75.9	Confident	10 Å²	10	79.7 Å²	79.7	7%	0.07	46%	0.458	C	S	.	.	H	α-helix	trans	-73.9	-7.9	175.9	82.8	0	0	0	0	114.2	K296 Y301 S303 K304 T305	K296-S307 PolarHBondContact NZ-O 3.47Å; Y301-S307 VanDerWaalsContact CD2-CB 3.49Å; S303-S307 PolarHBondContact O-N 2.75Å; S303-S307 VanDerWaalsContact O-N 3.11Å; K304-S307 PolarHBondContact O-N 3.37Å; K304-S307 PolarHBondContact O-OG 2.88Å; T305-S307 VanDerWaalsContact C-N 3.34Å; T305-S307 PolarHBondContact O-N 3.38Å
308	L	87.2	Confident	74.4	Confident	96 Å²	96	77 Å²	77	50%	0.503	46%	0.458	S	S	.	.	H	α-helix	trans	-98	-14.5	171.5	-70.4	169.8	0	0	0	113.4	K304 T305 C306 E310	K304-L308 HydrophobicContact CG-CD1 4.21Å; K304-L308 VanDerWaalsContact O-CG 3.29Å; K304-L308 WeakPolarHBondContact O-CG 3.37Å; K304-L308 PolarHBondContact O-N 3.19Å; K304-L308 VanDerWaalsContact O-N 3.14Å; T305-L308 PolarHBondContact O-N 2.91Å; C306-L308 PolarHBondContact O-N 3.26Å; L308-E310 VanDerWaalsContact C-N 3.31Å; L308-E310 HydrophobicContact CB-CG 4.13Å
309	G	77.3	Confident	72.8	Confident	37 Å²	37	80.1 Å²	80.1	38%	0.381	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.6	24.8	-174.9	0	0	0	0	0	113.5	T305 C306 D311	T305-G309 PolarHBondContact O-N 2.7Å; C306-G309 PolarHBondContact O-N 3.18Å; G309-D311 PolarHBondContact O-N 3.22Å
310	E	68.9	Low	70.9	Confident	108 Å²	108	81.9 Å²	81.9	51%	0.505	49%	0.489	S	S	.	.			trans	-66.4	121.2	169.9	-68.6	172.3	159.8	0	0	108.5	T305 L308 V312	T305-E310 WeakPolarHBondContact CG2-OE2 3.28Å; T305-E310 PolarHBondContact O-N 3.23Å; L308-E310 VanDerWaalsContact C-N 3.31Å; L308-E310 HydrophobicContact CB-CG 4.13Å; E310-V312 PolarHBondContact O-N 3.23Å
311	D	57.6	Low	68.9	Low	99 Å²	99	85.1 Å²	85.1	53%	0.529	52%	0.516	S	S	.	.			trans	-64.6	119	-165.5	-164.4	-27.4	0	0	0	111.6	G309 H313 A314	G309-D311 PolarHBondContact O-N 3.22Å; D311-H313 PolarHBondContact O-N 2.94Å; D311-H313 WeakPolarHBondContact OD1-CB 3.33Å; D311-H313 IonicContact OD1-CD2 3.83Å; D311-H313 IonicContact OD1-CG 3.99Å; D311-H313 PolarHBondContact OD1-N 3.11Å; D311-A314 HydrophobicContact CB-CB 4.11Å; D311-A314 WeakPolarHBondContact O-CB 3.26Å; D311-A314 PolarHBondContact O-N 3.27Å
312	V	56.6	Low	66.7	Low	75 Å²	75	92.5 Å²	92.5	46%	0.455	55%	0.549	S	S	.	.	G	3₁₀ helix	trans	-63.6	-24.6	179.7	-178	0	0	0	0	111	E310 S315	E310-V312 PolarHBondContact O-N 3.23Å; V312-S315 PolarHBondContact O-N 3.48Å
313	H	54.6	Low	64.6	Low	171 Å²	171	98.5 Å²	98.5	79%	0.792	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-83.3	-7.4	173.8	-62.6	-64.1	0	0	0	114.2	D311 S315	D311-H313 PolarHBondContact O-N 2.94Å; D311-H313 WeakPolarHBondContact OD1-CB 3.33Å; D311-H313 IonicContact OD1-CD2 3.83Å; D311-H313 IonicContact OD1-CG 3.99Å; D311-H313 PolarHBondContact OD1-N 3.11Å; H313-S315 PolarHBondContact O-N 3.3Å
314	A	51.1	Low	62.6	Low	79 Å²	79	102.8 Å²	102.8	65%	0.653	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-78.4	-5	167.6	0	0	0	0	0	113.1	D311 D316	D311-A314 HydrophobicContact CB-CB 4.11Å; D311-A314 WeakPolarHBondContact O-CB 3.26Å; D311-A314 PolarHBondContact O-N 3.27Å; A314-D316 PolarHBondContact O-N 3.12Å; A314-D316 VanDerWaalsContact O-N 3.17Å
315	S	51	Low	60.6	Low	100 Å²	100	99.5 Å²	99.5	70%	0.699	60%	0.603	S	S	*	*			trans	-84.6	40.6	176	-62.6	0	0	0	0	113.7	V312 H313 S317	V312-S315 PolarHBondContact O-N 3.48Å; H313-S315 PolarHBondContact O-N 3.3Å; S315-S317 PolarHBondContact O-N 3.43Å
316	D	51.5	Low	58.8	Low	132 Å²	132	107.5 Å²	107.5	71%	0.706	63%	0.625	S	S	*	*			trans	-80	94.7	161.6	-174	8.3	0	0	0	109.3	A314	A314-D316 PolarHBondContact O-N 3.12Å; A314-D316 VanDerWaalsContact O-N 3.17Å
317	S	46.9	Very low	56.6	Low	111 Å²	111	113 Å²	113	78%	0.776	66%	0.663	S	S	*	*			trans	-150.2	92.4	167.7	-81.2	0	0	0	0	110.8	S315 D319	S315-S317 PolarHBondContact O-N 3.43Å; S317-D319 PolarHBondContact O-N 2.82Å
318	S	51.8	Low	54.6	Low	120 Å²	120	123.6 Å²	123.6	84%	0.839	70%	0.702	S	S	*	*			trans	-69.7	89.1	174.7	-66.5	0	0	0	0	112.3
319	D	49.5	Very low	52.4	Low	109 Å²	109	124.2 Å²	124.2	58%	0.583	71%	0.705	S	S	*	*			trans	-134	28.8	167.6	-163.6	23.7	0	0	0	114.7	S317 A321	S317-D319 PolarHBondContact O-N 2.82Å; D319-A321 PolarHBondContact O-N 3.17Å; D319-A321 VanDerWaalsContact O-N 3.14Å
320	S	51.6	Low	50.5	Low	135 Å²	135	127.4 Å²	127.4	94%	0.944	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	33	173	-63.5	0	0	0	0	113.2
321	A	50.2	Low	49.6	Very low	73 Å²	73	131.8 Å²	131.8	60%	0.603	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.9	-29.5	-168.6	0	0	0	0	0	115.6	D319	D319-A321 PolarHBondContact O-N 3.17Å; D319-A321 VanDerWaalsContact O-N 3.14Å
322	F	48.7	Very low	48.8	Very low	172 Å²	172	138.7 Å²	138.7	75%	0.754	75%	0.753	S	S	*	*	S	Bend	trans	-120.6	1.1	-162.9	-82.3	-73.2	0	0	0	118
323	Q	49.8	Very low	48	Very low	175 Å²	175	140 Å²	140	82%	0.818	77%	0.766	S	S	*	*	S	Bend	trans	-86.6	-20	-177.2	-59.3	-160.5	25.1	0	0	115.1	A325	Q323-A325 PolarHBondContact O-N 3.45Å
324	S	49.1	Very low	47.3	Very low	126 Å²	126	138.3 Å²	138.3	88%	0.881	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	12.2	-177.3	-52	0	0	0	0	115.6
325	A	49	Very low	47	Very low	81 Å²	81	144.4 Å²	144.4	67%	0.669	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.8	-0.3	-163.8	0	0	0	0	0	116	Q323	Q323-A325 PolarHBondContact O-N 3.45Å
326	R	52	Low	46.4	Very low	241 Å²	241	147.6 Å²	147.6	91%	0.909	78%	0.779	S	S	*	*			trans	-139.6	63.1	-176.1	-65.6	-166.7	-177.9	-157.7	0.9	115.6
327	S	44.5	Very low	45.4	Very low	122 Å²	122	144.3 Å²	144.3	85%	0.853	78%	0.776	S	S	*	*			trans	-146	64.5	165.4	50.7	0	0	0	0	112.1
328	R	47.9	Very low	44.9	Very low	233 Å²	233	148.6 Å²	148.6	88%	0.879	78%	0.781	S	S	*	*			trans	-138	149.8	174.7	-151.2	177.4	-171.6	-161	1.9	112
329	D	40.4	Very low	43.9	Very low	109 Å²	109	148.4 Å²	148.4	58%	0.583	78%	0.779	S	S	*	*			trans	68.9	143.3	-169.9	-66.3	-65.8	0	0	0	114.3	R331	D329-R331 IonicContact OD1-CZ 3.22Å; D329-R331 VanDerWaalsContact OD1-CZ 3.22Å; D329-R331 IonicContact OD1-NE 2.66Å; D329-R331 PolarHBondContact OD1-NE 3.23Å; D329-R331 IonicContact OD1-NH2 2.89Å; D329-R331 PolarHBondContact OD1-NH2 2.9Å; D329-R331 IonicContact OD2-NH2 3.86Å
330	S	38.4	Very low	43.4	Very low	105 Å²	105	148.8 Å²	148.8	73%	0.734	79%	0.79	S	S	*	*			cis	-143.6	132	4.9	121.4	0	0	0	0	110.2
331	R	48.7	Very low	42.7	Very low	200 Å²	200	153.5 Å²	153.5	76%	0.755	79%	0.787	S	S	*	*				95.3	109.8	61.8	-81.2	-172.5	-158	-148.7	7.9	115.5	D329	D329-R331 IonicContact OD1-CZ 3.22Å; D329-R331 VanDerWaalsContact OD1-CZ 3.22Å; D329-R331 IonicContact OD1-NE 2.66Å; D329-R331 PolarHBondContact OD1-NE 3.23Å; D329-R331 IonicContact OD1-NH2 2.89Å; D329-R331 PolarHBondContact OD1-NH2 2.9Å; D329-R331 IonicContact OD2-NH2 3.86Å
332	R	41.8	Very low	41.7	Very low	243 Å²	243	155.3 Å²	155.3	92%	0.917	80%	0.796	S	S	*	*				-171.7	123.3	125.2	-99	171.4	-176.7	-138	0.8	107
333	S	40.3	Very low	41.2	Very low	104 Å²	104	151.7 Å²	151.7	73%	0.727	80%	0.797	S	S	*	*				70.1	130.1	71.9	-150.8	0	0	0	0	111.4
334	V	39.4	Very low	40.3	Very low	135 Å²	135	151.2 Å²	151.2	82%	0.818	80%	0.801	S	S	*	*			cis	-137.6	175.3	44.6	179.4	0	0	0	0	113.6
335	R	44.9	Very low	39.6	Very low	206 Å²	206	153.8 Å²	153.8	78%	0.777	80%	0.799	S	S	*	*			trans	-85.9	176.5	-175.9	-48.5	170.4	-173.5	173.9	-0.1	111.9
336	M	37.3	Very low	38.5	Very low	168 Å²	168	154.9 Å²	154.9	83%	0.828	80%	0.8	S	S	*	*			cis	-148.7	172.1	22.8	-73.8	-72.6	-163.3	0	0	109.8
337	G	31	Very low	37.5	Very low	62 Å²	62	153.1 Å²	153.1	64%	0.639	79%	0.794	S	S	*	*			cis	152.6	161.1	-7.1	0	0	0	0	0	113.6
338	K	37	Very low	36.7	Very low	202 Å²	202	155 Å²	155	88%	0.878	79%	0.789	S	S	*	*			trans	70.9	104.8	172.5	-58.5	179	179.6	178.9	0	116.2
339	S	30.7	Very low	35.7	Very low	116 Å²	116	148.4 Å²	148.4	81%	0.811	78%	0.779	S	S	*	*				87.7	144	89.4	72.1	0	0	0	0	113.9
340	S	38.8	Very low	35.2	Very low	117 Å²	117	150 Å²	150	82%	0.818	79%	0.786	S	S	*	*			cis	-149.1	179	21.9	60.7	0	0	0	0	115.3
341	R	36.4	Very low	34.6	Very low	233 Å²	233	152 Å²	152	88%	0.879	79%	0.788	S	S	*	*			trans	-58.5	170.1	163.9	-65.9	172.6	164.5	-171.3	-7	112.3
342	S	30.4	Very low	33.6	Very low	112 Å²	112	149.5 Å²	149.5	78%	0.783	79%	0.789	S	S	*	*			cis	-153	170.5	4.9	7.1	0	0	0	0	110.8
343	A	36.8	Very low	33.3	Very low	95 Å²	95	143.5 Å²	143.5	79%	0.785	78%	0.784	S	S	*	*			trans	-75.7	152.9	165.8	0	0	0	0	0	111.9
344	D	32.2	Very low	33	Very low	166 Å²	166	144.4 Å²	144.4	89%	0.888	79%	0.787	S	S	*	*			trans	-151.8	152.4	152	-115.8	-40	0	0	0	110.8
345	Q	33.2	Very low	32.4	Very low	180 Å²	180	142.3 Å²	142.3	84%	0.841	78%	0.784	S	S	*	*			trans	-95.1	158.9	167.2	-61.4	175.1	-6.5	0	0	108.6
346	C	25.6	Very low	31.9	Very low	104 Å²	104	140 Å²	140	70%	0.703	79%	0.787	S	S	*	*				174.4	131.2	113.8	-143.9	0	0	0	0	113.6
347	R	31.6	Very low	31.4	Very low	204 Å²	204	138.9 Å²	138.9	77%	0.77	78%	0.784	S	S	*	*			trans	65.6	139.9	142.1	-88.4	175.5	-174.3	167.6	3.3	123.2
348	Q	28.8	Very low	31.2	Very low	160 Å²	160	145.1 Å²	145.1	75%	0.748	79%	0.79	S	S	*	*			trans	74.2	140.9	138	-76.2	168.4	-20.5	0	0	118.2
349	S	26	Very low	30.8	Very low	96 Å²	96	143.8 Å²	143.8	67%	0.671	78%	0.784	S	S	*	*			cis	-174.1	160.9	-19.4	-125.1	0	0	0	0	109.4
350	L	30.3	Very low	30.7	Very low	142 Å²	142	147.4 Å²	147.4	74%	0.743	79%	0.785	S	S	*	*			trans	65.1	109.8	154.4	-62.9	169.5	0	0	0	119.3
351	L	26.4	Very low	30.5	Very low	146 Å²	146	147.7 Å²	147.7	76%	0.764	78%	0.784	S	S	*	*				90	146.8	119.8	-68.6	176.8	0	0	0	122.4
352	L	26.9	Very low	29.9	Very low	149 Å²	149	139.6 Å²	139.6	78%	0.78	77%	0.773	S	S	*	*			trans	63.9	118.1	159	-93.5	72	0	0	0	119.6
353	S	34.2	Very low	29.9	Very low	117 Å²	117	142.7 Å²	142.7	82%	0.818	78%	0.78	S	S	*	*			trans	-59.6	148.5	150	-23.7	0	0	0	0	111.1
354	P	35.2	Very low	29.5	Very low	122 Å²	122	143 Å²	143	79%	0.792	78%	0.777	S	S	*	*			trans	-139	161.4	132.1	37.2	-25.9	0	0	0	112.6
355	A	25.7	Very low	29.2	Very low	91 Å²	91	139.4 Å²	139.4	75%	0.752	76%	0.764	S	S	*	*			cis	-167	166.9	-24.6	0	0	0	0	0	108.2
356	L	34.8	Very low	29.1	Very low	159 Å²	159	137.8 Å²	137.8	83%	0.832	76%	0.762	S	S	*	*			trans	-66.4	151.2	154.1	-65.9	164.4	0	0	0	109.1
357	N	27.8	Very low	29.4	Very low	143 Å²	143	137.5 Å²	137.5	77%	0.765	77%	0.767	S	S	*	*			trans	-174.3	131.6	136.8	-96.8	-12.9	0	0	0	116.8
358	Y	26.8	Very low	29.4	Very low	193 Å²	193	134.7 Å²	134.7	76%	0.757	77%	0.767	S	S	*	*			trans	64.1	110	133.7	-80.4	-121.2	0	0	0	123.7
359	K	27.5	Very low	29.5	Very low	175 Å²	175	133.5 Å²	133.5	76%	0.761	77%	0.766	S	S	*	*				37	123.3	111.9	-69.3	-172.4	174.1	-174.6	0	120.9
360	F	28.3	Very low	29.8	Very low	192 Å²	192	134 Å²	134	84%	0.842	77%	0.765	S	S	*	*			trans	58.5	136.8	135.5	-94.4	-82.5	0	0	0	122.2
361	P	34.6	Very low	29.8	Very low	122 Å²	122	134.5 Å²	134.5	79%	0.792	77%	0.767	S	S	*	*			trans	-112.4	143.9	137.3	35.3	-26.4	0	0	0	112
362	G	25	Very low	29.9	Very low	63 Å²	63	132.1 Å²	132.1	65%	0.649	76%	0.763	S	S	*	*			trans	-105.4	-156	176.4	0	0	0	0	0	113.8
363	L	29.6	Very low	30.1	Very low	178 Å²	178	136.3 Å²	136.3	93%	0.932	77%	0.768	S	S	*	*			trans	100.3	137.6	-169.1	-63.2	165.6	0	0	0	112.2
364	S	30	Very low	29.9	Very low	102 Å²	102	140.2 Å²	140.2	71%	0.713	77%	0.771	S	S	*	*			cis	-158	141.4	0.8	-177.8	0	0	0	0	113.1
365	S	26	Very low	29.7	Very low	89 Å²	89	141.8 Å²	141.8	62%	0.622	77%	0.771	S	S	*	*			trans	52.7	114.3	144.4	-171.1	0	0	0	0	122.6
366	N	30.3	Very low	29.8	Very low	147 Å²	147	143.9 Å²	143.9	79%	0.786	77%	0.77	S	S	*	*			trans	46.3	127.2	131.8	-47.6	5.3	0	0	0	121.7
367	A	32.3	Very low	29.5	Very low	98 Å²	98	142.9 Å²	142.9	81%	0.81	77%	0.766	S	S	*	*				-168	134.8	107	0	0	0	0	0	112.3
368	D	30.9	Very low	29.5	Very low	145 Å²	145	142.8 Å²	142.8	78%	0.775	76%	0.764	S	S	*	*			trans	-61.4	166.5	176.9	-37.5	-63.6	0	0	0	112.1
369	D	31.6	Very low	29.5	Very low	134 Å²	134	138.2 Å²	138.2	72%	0.717	76%	0.761	S	S	*	*			cis	-175.8	159.9	26.4	-144.4	-31.8	0	0	0	113.3
370	T	32.3	Very low	29.5	Very low	108 Å²	108	137.5 Å²	137.5	66%	0.663	76%	0.764	S	S	*	*			trans	35.4	137.4	149.1	28.8	0	0	0	0	128.2
371	L	29	Very low	29.5	Very low	151 Å²	151	133.5 Å²	133.5	79%	0.791	76%	0.76	S	S	*	*				112.6	125.3	126.7	-82.3	161.4	0	0	0	123.1
372	S	30.1	Very low	29.3	Very low	96 Å²	96	137.1 Å²	137.1	67%	0.671	76%	0.758	S	S	*	*			trans	78.3	105.6	138.1	-70	0	0	0	0	123.9
373	R	31.1	Very low	29.5	Very low	237 Å²	237	142 Å²	142	89%	0.894	76%	0.764	S	S	*	*				15.8	127.1	123	-65.4	173.6	162.5	-176.6	-6.1	118.4
374	K	29.2	Very low	29.4	Very low	200 Å²	200	137 Å²	137	87%	0.87	76%	0.756	S	S	*	*				-175.4	176.5	99.3	-104.8	-165.3	174.4	-164.5	0	113.6
375	L	30.1	Very low	29.4	Very low	154 Å²	154	137.6 Å²	137.6	81%	0.806	77%	0.766	S	S	*	*			trans	-92.2	-174	176.6	-70.3	162.6	0	0	0	111.9
376	D	28.4	Very low	29.4	Very low	136 Å²	136	136.1 Å²	136.1	73%	0.727	77%	0.766	S	S	*	*			trans	98.5	88.1	150.2	-49.8	-38.7	0	0	0	119.9
377	D	27.8	Very low	29.2	Very low	138 Å²	138	138.9 Å²	138.9	74%	0.738	77%	0.771	S	S	*	*				77.8	164.2	109.8	-150.8	15.2	0	0	0	122.8
378	L	27.8	Very low	29.1	Very low	140 Å²	140	139.6 Å²	139.6	73%	0.733	77%	0.765	S	S	*	*			trans	78.6	86.2	161.7	-58.7	178.7	0	0	0	121.8
379	S	27.8	Very low	29	Very low	97 Å²	97	140.2 Å²	140.2	68%	0.678	77%	0.768	S	S	*	*				27.9	121.9	103	-51	0	0	0	0	121.2
380	L	28.1	Very low	28.8	Very low	161 Å²	161	142.3 Å²	142.3	84%	0.843	77%	0.774	S	S	*	*				152.6	141.5	115.3	-89.1	163.9	0	0	0	117.5
381	S	28.6	Very low	28.7	Very low	107 Å²	107	143.5 Å²	143.5	75%	0.748	78%	0.776	S	S	*	*			trans	76.1	161.1	150.8	84.8	0	0	0	0	118.5
382	R	29	Very low	28.7	Very low	198 Å²	198	144.3 Å²	144.3	75%	0.747	77%	0.773	S	S	*	*			cis	-159.4	132.9	11.3	-159.4	172.2	158.1	171.1	-5.2	115.6
383	Q	30.5	Very low	28.7	Very low	166 Å²	166	150 Å²	150	78%	0.776	78%	0.78	S	S	*	*			trans	48.1	146.7	147.4	-64.7	169.9	-19.6	0	0	123.3
384	G	27.3	Very low	28.6	Very low	74 Å²	74	148 Å²	148	76%	0.763	78%	0.778	S	S	*	*			trans	-166.6	3.9	176.2	0	0	0	0	0	122.1
385	A	29	Very low	28.4	Very low	113 Å²	113	142 Å²	142	93%	0.934	77%	0.774	S	S	*	*			trans	63.7	153	177.6	0	0	0	0	0	118.4
386	G	26.1	Very low	28.2	Very low	59 Å²	59	144.6 Å²	144.6	61%	0.608	77%	0.773	S	S	*	*			cis	160.1	145.2	-16	0	0	0	0	0	115.4
387	F	26.5	Very low	28.4	Very low	205 Å²	205	144.7 Å²	144.7	90%	0.899	78%	0.778	S	S	*	*			trans	65.9	144.9	157.8	-70.5	-76.5	0	0	0	119.6
388	V	30.3	Very low	28.4	Very low	113 Å²	113	145.6 Å²	145.6	69%	0.685	78%	0.778	S	S	*	*			cis	-147.9	144.1	-11.8	-146.5	0	0	0	0	109.6
389	N	28.9	Very low	28.4	Very low	158 Å²	158	147.4 Å²	147.4	85%	0.845	78%	0.783	S	S	*	*				171.5	147.8	118.5	-97.8	-7.8	0	0	0	111.6
390	E	27.4	Very low	28.5	Very low	178 Å²	178	150.7 Å²	150.7	83%	0.832	79%	0.793	S	S	*	*			trans	-121.2	159.1	-170.1	-68.4	-172.7	138.6	0	0	114.3
391	D	30.2	Very low	28.5	Very low	132 Å²	132	150.1 Å²	150.1	71%	0.706	79%	0.787	S	S	*	*			trans	48.4	120.5	142.6	-72.7	18.5	0	0	0	123.2
392	F	27.8	Very low	29	Very low	168 Å²	168	150.1 Å²	150.1	74%	0.737	79%	0.785	S	S	*	*				-173.5	118.1	124.7	-110.4	-145	0	0	0	106.9
393	W	31.1	Very low	29.5	Very low	216 Å²	216	148.9 Å²	148.9	82%	0.818	79%	0.787	S	S	*	*			cis	-142.7	151.5	17.1	-72.8	81.6	0	0	0	112.7
394	K	28.6	Very low	29.6	Very low	194 Å²	194	145.6 Å²	145.6	84%	0.843	78%	0.775	S	S	*	*			trans	-87.4	146.3	145	-74.2	-177.8	177.8	176.5	0	108.8
395	G	24.8	Very low	30.3	Very low	76 Å²	76	146.5 Å²	146.5	78%	0.784	77%	0.767	S	S	*	*			trans	-158.6	-22.2	-173.3	0	0	0	0	0	121.5
396	R	26.9	Very low	31.1	Very low	207 Å²	207	147 Å²	147	78%	0.781	75%	0.751	S	S	*	*			trans	-158.9	124.5	164.5	-165.8	161.3	-67.4	-144.3	-1.4	111.6	E398	R396-E398 HydrophobicContact CG-CG 3.8Å
397	V	31.6	Very low	32.1	Very low	138 Å²	138	148.7 Å²	148.7	84%	0.836	74%	0.743	S	S	*	*			trans	-81.9	114.2	152.5	174.3	0	0	0	0	104.8
398	E	28.9	Very low	33	Very low	157 Å²	157	142.1 Å²	142.1	73%	0.734	71%	0.712	S	S	*	*			trans	-89.1	152.7	152	-64.2	-149.3	141.9	0	0	108.1	R396	R396-E398 HydrophobicContact CG-CG 3.8Å
399	Q	26.5	Very low	33.9	Very low	179 Å²	179	139.3 Å²	139.3	84%	0.836	70%	0.701	S	S	*	*			trans	-98.3	112	-161.2	177.8	176.6	-9.2	0	0	107.3	M401	Q399-M401 PolarHBondContact O-N 3.16Å
400	D	29.6	Very low	35.2	Very low	166 Å²	166	138.3 Å²	138.3	89%	0.888	69%	0.691	S	S	*	*			trans	-57.6	104.5	172.1	-74.3	-42.2	0	0	0	108.2
401	M	28.7	Very low	36.7	Very low	148 Å²	148	130.6 Å²	130.6	73%	0.729	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-72.8	135	175.1	-164.3	175.9	83.1	0	0	107.1	Q399 E403	Q399-M401 PolarHBondContact O-N 3.16Å; M401-E403 PolarHBondContact O-N 2.78Å
402	P	39	Very low	38	Very low	107 Å²	107	127.1 Å²	127.1	70%	0.695	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-54.2	134.9	168.1	-21.9	33.1	0	0	0	109.2	D404	P402-D404 PolarHBondContact O-N 3.2Å
403	E	38.9	Very low	39.8	Very low	172 Å²	172	124.7 Å²	124.7	80%	0.804	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-60.2	121.4	170.9	-68.5	-172.8	141.8	0	0	108.3	M401 P405	M401-E403 PolarHBondContact O-N 2.78Å; E403-P405 WeakPolarHBondContact O-CD 3.22Å
404	D	33.2	Very low	41.8	Very low	97 Å²	97	116.4 Å²	116.4	52%	0.519	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-75.3	122.8	-168.7	-152.4	-8.6	0	0	0	109.8	P402 E406 E407	P402-D404 PolarHBondContact O-N 3.2Å; D404-E406 PolarHBondContact O-N 2.87Å; D404-E406 VanDerWaalsContact O-N 3.07Å; D404-E407 PolarHBondContact O-N 2.75Å
405	P	42.2	Very low	43.9	Very low	93 Å²	93	107.3 Å²	107.3	60%	0.604	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	-21.9	179	-26.2	36.5	0	0	0	113.7	E403 E407	E403-P405 WeakPolarHBondContact O-CD 3.22Å; P405-E407 PolarHBondContact O-N 3.33Å
406	E	46.8	Very low	46.1	Very low	125 Å²	125	105.2 Å²	105.2	58%	0.584	53%	0.531	S	S	*	.	H	α-helix	trans	-62.9	-33.8	-176.4	-124.1	72.2	169.8	0	0	114.1	D404 W408 A409 E410	D404-E406 PolarHBondContact O-N 2.87Å; D404-E406 VanDerWaalsContact O-N 3.07Å; E406-W408 PolarHBondContact O-N 3.06Å; E406-A409 WeakPolarHBondContact O-CB 3.41Å; E406-A409 PolarHBondContact O-N 2.74Å; E406-E410 PolarHBondContact O-N 3.46Å
407	E	46.3	Very low	48.5	Very low	94 Å²	94	101.3 Å²	101.3	44%	0.439	52%	0.521	S	S	.	.	H	α-helix	trans	-61.4	-33.8	-176	-174.5	172.3	-154	0	0	111.7	D404 P405 H411	D404-E407 PolarHBondContact O-N 2.75Å; P405-E407 PolarHBondContact O-N 3.33Å; E407-H411 PolarHBondContact O-CE1 3.1Å; E407-H411 PolarHBondContact O-N 2.95Å; E407-H411 PolarHBondContact O-ND1 3.35Å
408	W	46.1	Very low	50.5	Low	67 Å²	67	95.3 Å²	95.3	25%	0.254	48%	0.484	S	S	.	.	H	α-helix	trans	-69.7	-35	176.4	-50.3	98.3	0	0	0	112.4	L109 R144 E406 H411 E412	L109-W408 WeakPolarHBondContact O-CZ3 3.41Å; R144-W408 HydrophobicContact CG-CH2 3.54Å; R144-W408 HydrophobicContact CG-CZ3 3.79Å; R144-W408 VanDerWaalsContact NE-CZ3 3.3Å; E406-W408 PolarHBondContact O-N 3.06Å; W408-H411 WeakPolarHBondContact O-CB 3.43Å; W408-H411 PolarHBondContact O-N 3.38Å; W408-E412 PolarHBondContact O-N 3.49Å
409	A	48.7	Very low	52.5	Low	54 Å²	54	88.1 Å²	88.1	45%	0.446	45%	0.451	S	S	.	.	H	α-helix	trans	-66.6	-42.7	177.5	0	0	0	0	0	111.3	E406 H411 E412 D413	E406-A409 WeakPolarHBondContact O-CB 3.41Å; E406-A409 PolarHBondContact O-N 2.74Å; A409-H411 PolarHBondContact O-N 2.94Å; A409-E412 PolarHBondContact O-N 2.83Å; A409-E412 VanDerWaalsContact O-N 3.1Å; A409-D413 PolarHBondContact O-N 2.83Å
410	E	55	Low	54.6	Low	137 Å²	137	82.6 Å²	82.6	64%	0.64	43%	0.427	S	S	*	.	H	α-helix	trans	-58.1	-33.7	172.8	-64.1	-166.1	166.2	0	0	112.4	E406 Y414	E406-E410 PolarHBondContact O-N 3.46Å; E410-Y414 VanDerWaalsContact O-CB 3.26Å; E410-Y414 WeakPolarHBondContact O-CB 3.44Å; E410-Y414 PolarHBondContact O-N 3.33Å
411	H	59.9	Low	56.8	Low	16 Å²	16	80.8 Å²	80.8	7%	0.074	41%	0.411	C	S	.	.	H	α-helix	trans	-72.6	-37	176.9	-67.6	26.5	0	0	0	112.3	R111 E407 W408 A409 M415	R111-H411 VanDerWaalsContact CB-CD2 3.41Å; R111-H411 WeakPolarHBondContact CB-CD2 3.18Å; R111-H411 WeakPolarHBondContact CB-NE2 3.44Å; R111-H411 PolarHBondContact N-CD2 3.43Å; E407-H411 PolarHBondContact O-CE1 3.1Å; E407-H411 PolarHBondContact O-N 2.95Å; E407-H411 PolarHBondContact O-ND1 3.35Å; W408-H411 WeakPolarHBondContact O-CB 3.43Å; W408-H411 PolarHBondContact O-N 3.38Å; A409-H411 PolarHBondContact O-N 2.94Å; H411-M415 VanDerWaalsContact O-CB 3.31Å; H411-M415 WeakPolarHBondContact O-CB 3.31Å; H411-M415 WeakPolarHBondContact O-CG 3.44Å; H411-M415 PolarHBondContact O-N 3.47Å
412	E	57.2	Low	58.7	Low	58 Å²	58	74.4 Å²	74.4	27%	0.271	38%	0.379	S	S	.	.	H	α-helix	trans	-65.6	-41.8	173.7	-65.5	-151.9	-168	0	0	112.2	K105 W408 A409 M415 T416	K105-E412 HydrophobicContact CB-CG 4.04Å; K105-E412 VanDerWaalsContact CB-OE1 3.25Å; K105-E412 WeakPolarHBondContact CB-OE1 3.47Å; K105-E412 HydrophobicContact CD-CB 4.34Å; K105-E412 VanDerWaalsContact CD-CD 3.46Å; K105-E412 HydrophobicContact CD-CG 3.84Å; K105-E412 WeakPolarHBondContact CD-OE2 3.27Å; K105-E412 HydrophobicContact CG-CG 4.39Å; K105-E412 IonicContact NZ-OE2 3.87Å; W408-E412 PolarHBondContact O-N 3.49Å; A409-E412 PolarHBondContact O-N 2.83Å; A409-E412 VanDerWaalsContact O-N 3.1Å; E412-M415 WeakPolarHBondContact O-CB 3.17Å; E412-T416 WeakPolarHBondContact O-CB 3.49Å; E412-T416 PolarHBondContact O-N 3.49Å; E412-T416 PolarHBondContact O-OG1 3.12Å
413	D	65.4	Low	59.6	Low	117 Å²	117	69.7 Å²	69.7	63%	0.626	35%	0.35	S	S	*	.	H	α-helix	trans	-67.9	-42.1	176.3	-88.2	-11.1	0	0	0	111.7	A409 M415 T416 Q417	A409-D413 PolarHBondContact O-N 2.83Å; D413-M415 PolarHBondContact O-N 3.28Å; D413-T416 PolarHBondContact O-N 3.35Å; D413-Q417 VanDerWaalsContact O-CB 3.27Å; D413-Q417 WeakPolarHBondContact O-CB 3.33Å; D413-Q417 PolarHBondContact O-N 2.87Å
414	Y	73.9	Confident	60.3	Low	42 Å²	42	66.1 Å²	66.1	17%	0.165	34%	0.336	C	S	.	.	H	α-helix	trans	-62.2	-43.6	175.2	179.5	-114.2	0	0	0	112.3	W35 R111 D167 I169 E410 Q417 L418	W35-Y414 PolarHBondContact NE1-OH 2.77Å; R111-Y414 PolarHBondContact NH2-OH 3.29Å; D167-Y414 HydrophobicContact CB-CE1 4.4Å; D167-Y414 PolarHBondContact OD2-OH 3.35Å; I169-Y414 HydrophobicContact CD1-CD1 4.34Å; I169-Y414 HydrophobicContact CD1-CE1 4.02Å; E410-Y414 VanDerWaalsContact O-CB 3.26Å; E410-Y414 WeakPolarHBondContact O-CB 3.44Å; E410-Y414 PolarHBondContact O-N 3.33Å; Y414-Q417 PolarHBondContact O-N 2.67Å; Y414-L418 HydrophobicContact CD1-CD1 3.94Å; Y414-L418 HydrophobicContact CE1-CD1 3.42Å; Y414-L418 VanDerWaalsContact CE1-CD1 3.42Å; Y414-L418 HydrophobicContact CE1-CG 4.28Å; Y414-L418 HydrophobicContact CE2-CD1 4.17Å; Y414-L418 HydrophobicContact CE2-CD2 4.49Å; Y414-L418 HydrophobicContact CE2-CG 4.14Å; Y414-L418 WeakPolarHBondContact O-CB 3.03Å; Y414-L418 WeakPolarHBondContact O-CG 3.21Å; Y414-L418 PolarHBondContact O-N 3.43Å
415	M	72.1	Confident	60.8	Low	3 Å²	3	67.2 Å²	67.2	2%	0.015	34%	0.336	C	S	.	.	H	α-helix	trans	-55.5	-51.8	171	-91.9	-69	-62.6	0	0	111.6	L76 L109 I169 H411 E412 D413 Q417 L418 L419	L76-M415 HydrophobicContact CB-CE 4.35Å; L76-M415 HydrophobicContact CD1-CE 4.34Å; L76-M415 HydrophobicContact CD1-SD 3.74Å; L76-M415 HydrophobicContact CD2-CE 4.02Å; L76-M415 HydrophobicContact CD2-SD 4.1Å; L76-M415 HydrophobicContact CG-CE 4.46Å; L76-M415 HydrophobicContact CG-SD 4.42Å; L109-M415 HydrophobicContact CD1-CG 4.3Å; L109-M415 HydrophobicContact CD2-CG 3.92Å; I169-M415 HydrophobicContact CD1-SD 3.83Å; I169-M415 HydrophobicContact CG2-SD 3.82Å; H411-M415 VanDerWaalsContact O-CB 3.31Å; H411-M415 WeakPolarHBondContact O-CB 3.31Å; H411-M415 WeakPolarHBondContact O-CG 3.44Å; H411-M415 PolarHBondContact O-N 3.47Å; E412-M415 WeakPolarHBondContact O-CB 3.17Å; D413-M415 PolarHBondContact O-N 3.28Å; M415-Q417 VanDerWaalsContact C-N 3.35Å; M415-Q417 PolarHBondContact O-N 2.94Å; M415-L418 WeakPolarHBondContact O-CB 3.26Å; M415-L418 PolarHBondContact O-N 2.84Å; M415-L419 HydrophobicContact CE-CD1 4.24Å; M415-L419 WeakPolarHBondContact O-CG 3.47Å; M415-L419 PolarHBondContact O-N 3.45Å
416	T	71.1	Confident	60.6	Low	33 Å²	33	67.9 Å²	67.9	20%	0.202	34%	0.343	C	S	.	.	H	α-helix	trans	-66.2	-38.1	-176.3	-53.3	0	0	0	0	111.1	K105 E412 D413 L419 L420	K105-T416 PolarHBondContact NZ-OG1 3.08Å; E412-T416 WeakPolarHBondContact O-CB 3.49Å; E412-T416 PolarHBondContact O-N 3.49Å; E412-T416 PolarHBondContact O-OG1 3.12Å; D413-T416 PolarHBondContact O-N 3.35Å; T416-L419 PolarHBondContact O-N 2.85Å; T416-L420 HydrophobicContact CG2-CD1 4.32Å; T416-L420 WeakPolarHBondContact O-CB 3.16Å; T416-L420 WeakPolarHBondContact O-CG 3.4Å; T416-L420 PolarHBondContact O-N 2.82Å
417	Q	77.2	Confident	60.5	Low	125 Å²	125	67.7 Å²	67.7	58%	0.584	35%	0.346	S	S	*	.	H	α-helix	trans	-66.5	-37.8	174	-170.9	-176	102.9	0	0	112.7	D413 Y414 M415 K421	D413-Q417 VanDerWaalsContact O-CB 3.27Å; D413-Q417 WeakPolarHBondContact O-CB 3.33Å; D413-Q417 PolarHBondContact O-N 2.87Å; Y414-Q417 PolarHBondContact O-N 2.67Å; M415-Q417 VanDerWaalsContact C-N 3.35Å; M415-Q417 PolarHBondContact O-N 2.94Å; Q417-K421 WeakPolarHBondContact O-CB 3.39Å; Q417-K421 PolarHBondContact O-N 2.99Å
418	L	74.3	Confident	60.2	Low	11 Å²	11	67.9 Å²	67.9	6%	0.058	35%	0.345	C	S	.	.	H	α-helix	trans	-63.1	-48.4	172.2	-79.6	170.6	0	0	0	111.1	L72 I169 Y414 M415 L420 K421 F422	L72-L418 HydrophobicContact CD1-CD1 4.16Å; L72-L418 HydrophobicContact CD1-CD2 4.47Å; L72-L418 HydrophobicContact CD2-CB 4.48Å; L72-L418 HydrophobicContact CD2-CD2 4.21Å; I169-L418 HydrophobicContact CD1-CD1 3.61Å; Y414-L418 HydrophobicContact CD1-CD1 3.94Å; Y414-L418 HydrophobicContact CE1-CD1 3.42Å; Y414-L418 VanDerWaalsContact CE1-CD1 3.42Å; Y414-L418 HydrophobicContact CE1-CG 4.28Å; Y414-L418 HydrophobicContact CE2-CD1 4.17Å; Y414-L418 HydrophobicContact CE2-CD2 4.49Å; Y414-L418 HydrophobicContact CE2-CG 4.14Å; Y414-L418 WeakPolarHBondContact O-CB 3.03Å; Y414-L418 WeakPolarHBondContact O-CG 3.21Å; Y414-L418 PolarHBondContact O-N 3.43Å; M415-L418 WeakPolarHBondContact O-CB 3.26Å; M415-L418 PolarHBondContact O-N 2.84Å; L418-L420 PolarHBondContact O-N 3.34Å; L418-K421 PolarHBondContact O-N 3.17Å; L418-F422 HydrophobicContact CD2-CD2 4.42Å; L418-F422 HydrophobicContact CD2-CE2 4.04Å; L418-F422 WeakPolarHBondContact O-CD2 3.49Å; L418-F422 PolarHBondContact O-N 3.34Å
419	L	69.5	Low	59.4	Low	7 Å²	7	72 Å²	72	4%	0.037	37%	0.367	C	S	.	.	H	α-helix	trans	-61.3	-42.9	178.9	-65.9	178.2	0	0	0	111.7	L76 P78 N81 M415 T416 G423	L76-L419 HydrophobicContact CB-CD2 4.43Å; L76-L419 VanDerWaalsContact O-CD2 3.25Å; L76-L419 WeakPolarHBondContact O-CD2 3.28Å; P78-L419 HydrophobicContact CB-CD2 4.36Å; P78-L419 HydrophobicContact CG-CD2 4.13Å; N81-L419 HydrophobicContact CB-CD1 3.76Å; M415-L419 HydrophobicContact CE-CD1 4.24Å; M415-L419 WeakPolarHBondContact O-CG 3.47Å; M415-L419 PolarHBondContact O-N 3.45Å; T416-L419 PolarHBondContact O-N 2.85Å; L419-G423 VanDerWaalsContact O-CA 3.24Å; L419-G423 WeakPolarHBondContact O-CA 3.35Å; L419-G423 PolarHBondContact O-N 3.36Å
420	L	72.4	Confident	58.5	Low	62 Å²	62	76.4 Å²	76.4	33%	0.325	38%	0.379	S	S	.	.	H	α-helix	trans	-56.7	-55.4	170.2	-82	161.8	0	0	0	112.4	R84 T416 L418 F422 G423 D424	R84-L420 VanDerWaalsContact NH1-CD2 3.27Å; T416-L420 HydrophobicContact CG2-CD1 4.32Å; T416-L420 WeakPolarHBondContact O-CB 3.16Å; T416-L420 WeakPolarHBondContact O-CG 3.4Å; T416-L420 PolarHBondContact O-N 2.82Å; L418-L420 PolarHBondContact O-N 3.34Å; L420-F422 PolarHBondContact O-N 2.98Å; L420-F422 VanDerWaalsContact O-N 3.11Å; L420-G423 PolarHBondContact O-N 3.41Å; L420-D424 WeakPolarHBondContact CD2-OD2 3.35Å; L420-D424 WeakPolarHBondContact O-CB 3.39Å; L420-D424 PolarHBondContact O-N 3.04Å; L420-D424 VanDerWaalsContact O-N 3.12Å
421	K	74.9	Confident	57.2	Low	129 Å²	129	76.4 Å²	76.4	56%	0.561	39%	0.391	S	S	*	.	H	α-helix	trans	-61.2	-24.5	-172.4	-177.4	173.3	-179	175.9	0	114.2	Q417 L418 K425	Q417-K421 WeakPolarHBondContact O-CB 3.39Å; Q417-K421 PolarHBondContact O-N 2.99Å; L418-K421 PolarHBondContact O-N 3.17Å; K421-K425 WeakPolarHBondContact O-CE 3.45Å
422	F	68.1	Low	56.1	Low	14 Å²	14	78.9 Å²	78.9	6%	0.061	41%	0.414	C	S	.	.	H	α-helix	trans	-117.5	-20.4	-178.4	-64.9	-76.8	0	0	0	114.4	I69 L72 L73 L418 L420	I69-F422 HydrophobicContact CD1-CE1 3.94Å; I69-F422 HydrophobicContact CG1-CD1 4.34Å; I69-F422 HydrophobicContact CG1-CE1 3.85Å; I69-F422 HydrophobicContact CG1-CZ 4.45Å; I69-F422 HydrophobicContact CG2-CD1 4.18Å; L72-F422 HydrophobicContact CD2-CB 4.26Å; L72-F422 HydrophobicContact CD2-CD2 3.29Å; L72-F422 HydrophobicContact CD2-CE2 3.74Å; L72-F422 HydrophobicContact CD2-CG 3.88Å; L73-F422 HydrophobicContact CD2-CB 4.17Å; L418-F422 HydrophobicContact CD2-CD2 4.42Å; L418-F422 HydrophobicContact CD2-CE2 4.04Å; L418-F422 WeakPolarHBondContact O-CD2 3.49Å; L418-F422 PolarHBondContact O-N 3.34Å; L420-F422 PolarHBondContact O-N 2.98Å; L420-F422 VanDerWaalsContact O-N 3.11Å
423	G	58.5	Low	54.9	Low	8 Å²	8	85 Å²	85	8%	0.082	44%	0.442	C	S	.	.	H	α-helix	trans	-83.1	-35	176	0	0	0	0	0	113.9	L419 L420 K425	L419-G423 VanDerWaalsContact O-CA 3.24Å; L419-G423 WeakPolarHBondContact O-CA 3.35Å; L419-G423 PolarHBondContact O-N 3.36Å; L420-G423 PolarHBondContact O-N 3.41Å; G423-K425 PolarHBondContact O-N 3.21Å
424	D	54.4	Low	53.1	Low	97 Å²	97	86.5 Å²	86.5	52%	0.519	46%	0.455	S	S	.	.	S	Bend	trans	-78.3	-3.7	178.2	-64.6	-11	0	0	0	112.7	R84 Y85 L420	R84-D424 IonicContact NH1-OD1 3.55Å; R84-D424 IonicContact NH1-OD2 3.39Å; Y85-D424 PolarHBondContact OH-OD1 3.3Å; L420-D424 WeakPolarHBondContact CD2-OD2 3.35Å; L420-D424 WeakPolarHBondContact O-CB 3.39Å; L420-D424 PolarHBondContact O-N 3.04Å; L420-D424 VanDerWaalsContact O-N 3.12Å
425	K	43.1	Very low	50.8	Low	119 Å²	119	90.5 Å²	90.5	52%	0.517	48%	0.48	S	S	.	.	S	Bend	trans	-85.4	136.3	169.9	-67.3	-174	179.4	-175.8	0	109.9	K421 G423 L427	K421-K425 WeakPolarHBondContact O-CE 3.45Å; G423-K425 PolarHBondContact O-N 3.21Å; K425-L427 PolarHBondContact O-N 3.06Å
426	S	38.8	Very low	48.8	Very low	107 Å²	107	98.8 Å²	98.8	75%	0.748	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-65.8	25.9	-172.9	-43	0	0	0	0	117	F428	S426-F428 PolarHBondContact O-N 3.47Å
427	L	44.5	Very low	46.6	Very low	121 Å²	121	107.9 Å²	107.9	63%	0.634	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-68.9	-17.3	166.9	-61.4	176.1	0	0	0	112.4	K425	K425-L427 PolarHBondContact O-N 3.06Å
428	F	38.8	Very low	44.1	Very low	98 Å²	98	107.6 Å²	107.6	43%	0.43	57%	0.565	S	S	.	*	G	3₁₀ helix	trans	-86.4	4.3	179.6	-82.8	-76.9	0	0	0	115.2	L73 P78 S426 Q430	L73-F428 HydrophobicContact CD1-CE2 4.22Å; L73-F428 HydrophobicContact CD1-CZ 4.33Å; L73-F428 HydrophobicContact CD2-CE2 3.83Å; L73-F428 HydrophobicContact CD2-CZ 3.97Å; P78-F428 HydrophobicContact CG-CE2 4.2Å; P78-F428 HydrophobicContact CG-CZ 3.95Å; S426-F428 PolarHBondContact O-N 3.47Å; F428-Q430 PolarHBondContact O-N 2.93Å
429	Q	29.8	Very low	41.7	Very low	154 Å²	154	113.2 Å²	113.2	72%	0.72	61%	0.605	S	S	*	*			trans	-81.9	100	169.2	-159.8	140.6	20.1	0	0	109.4
430	Q	29.5	Very low	39.6	Very low	146 Å²	146	120.6 Å²	120.6	68%	0.682	64%	0.639	S	S	*	*			trans	-54.6	151.3	156.5	-68.3	-164.1	29	0	0	108.8	F428 A432	F428-Q430 PolarHBondContact O-N 2.93Å; Q430-A432 PolarHBondContact O-N 3.4Å
431	P	28.5	Very low	37.4	Very low	138 Å²	138	125.6 Å²	125.6	90%	0.896	66%	0.66	S	S	*	*	S	Bend	trans	-74.3	59.1	175.2	33	-36.5	0	0	0	111.8
432	A	35.2	Very low	34.9	Very low	68 Å²	68	130.7 Å²	130.7	56%	0.562	68%	0.676	S	S	*	*			trans	-85.5	128.3	158.3	0	0	0	0	0	108	Q430	Q430-A432 PolarHBondContact O-N 3.4Å
433	E	32.9	Very low	32.9	Very low	186 Å²	186	137.2 Å²	137.2	87%	0.869	71%	0.711	S	S	*	*			trans	61.1	91.9	172.3	-54.1	-167.2	173.3	0	0	117.1
434	V	27.6	Very low	31.3	Very low	148 Å²	148	141.5 Å²	141.5	90%	0.897	74%	0.739	S	S	*	*			trans	-115.7	95.1	142.8	-179.2	0	0	0	0	108.7
435	D	25	Very low	30	Very low	127 Å²	127	144.5 Å²	144.5	68%	0.679	76%	0.755	S	S	*	*			trans	56.5	99.8	153.1	-151.3	-16.7	0	0	0	119.9	R437	D435-R437 PolarHBondContact OD1-N 3.23Å
436	I	31.1	Very low	29.1	Very low	176 Å²	176	144.4 Å²	144.4	90%	0.903	77%	0.77	S	S	*	*			trans	-120.8	76.1	148.6	-52.4	179.3	0	0	0	109.2
437	R	25.4	Very low	28.7	Very low	224 Å²	224	148.6 Å²	148.6	85%	0.845	78%	0.779	S	S	*	*			trans	-142.9	99.2	160	-73.6	-159.4	177.2	-157.9	-0.3	114.2	D435	D435-R437 PolarHBondContact OD1-N 3.23Å
438	S	23.8	Very low	28	Very low	120 Å²	120	148.8 Å²	148.8	84%	0.839	79%	0.785	S	S	*	*			trans	-156.4	56	153.9	39.6	0	0	0	0	114.9
439	S	24.1	Very low	27.6	Very low	128 Å²	128	153.5 Å²	153.5	90%	0.895	81%	0.806	S	S	*	*			trans	-164.9	148.9	136.6	-87.7	0	0	0	0	110.9
440	E	25.9	Very low	27.5	Very low	163 Å²	163	151.5 Å²	151.5	76%	0.762	81%	0.809	S	S	*	*			trans	-99	156.8	-171.2	-61.1	178.5	108.2	0	0	112.6
441	H	24.6	Very low	27.4	Very low	166 Å²	166	153.4 Å²	153.4	77%	0.769	82%	0.815	S	S	*	*			trans	68.2	165.6	167.6	-55.4	-27.7	0	0	0	113.3
442	W	24.1	Very low	27.4	Very low	236 Å²	236	153.4 Å²	153.4	89%	0.894	81%	0.806	S	S	*	*			cis	-120.2	141.2	15.1	-61.6	19.9	0	0	0	112.2
443	I	26.1	Very low	27	Very low	152 Å²	152	157 Å²	157	78%	0.779	82%	0.816	S	S	*	*			trans	-86.5	137.5	157.8	-65.9	174.8	0	0	0	107.6
444	S	24.6	Very low	26.9	Very low	97 Å²	97	155.1 Å²	155.1	68%	0.678	81%	0.811	S	S	*	*			trans	-152.3	74.1	167	-74.1	0	0	0	0	110.1	S446	S444-S446 PolarHBondContact O-N 3.23Å
445	D	25.8	Very low	26.7	Very low	161 Å²	161	157.2 Å²	157.2	86%	0.861	81%	0.808	S	S	*	*			trans	-56.3	127	158.2	-87.2	-50.8	0	0	0	109.2
446	S	24.9	Very low	26.9	Very low	117 Å²	117	160.1 Å²	160.1	82%	0.818	82%	0.815	S	S	*	*			trans	-138.9	124.9	162	59.1	0	0	0	0	109.7	S444	S444-S446 PolarHBondContact O-N 3.23Å
447	M	29.9	Very low	26.6	Very low	194 Å²	194	158.4 Å²	158.4	96%	0.956	81%	0.808	S	S	*	*			trans	-86.3	158	-165.2	-164	174.8	-178.8	0	0	112.6
448	V	31.4	Very low	26.6	Very low	125 Å²	125	155.1 Å²	155.1	76%	0.758	81%	0.807	S	S	*	*			trans	-60.6	151.3	-177.3	174.6	0	0	0	0	114.1
449	K	28.9	Very low	27.3	Very low	198 Å²	198	155.3 Å²	155.3	86%	0.861	81%	0.805	S	S	*	*			trans	99.1	161	155.1	-104.5	164.3	-174	172.4	0	119.5
450	S	27.5	Very low	27.3	Very low	111 Å²	111	153.7 Å²	153.7	78%	0.776	79%	0.794	S	S	*	*			trans	-130.2	141	-152.5	-45.2	0	0	0	0	113.5
451	K	28.1	Very low	27.6	Very low	186 Å²	186	153.6 Å²	153.6	81%	0.809	80%	0.798	S	S	*	*			trans	58.3	130.4	144.9	-110.4	-170.7	170.8	-177.8	0	120.9
452	L	29.4	Very low	27.7	Very low	138 Å²	138	149 Å²	149	72%	0.723	79%	0.789	S	S	*	*			trans	72.3	150	154.3	-59.5	159.2	0	0	0	115.6
453	D	26.8	Very low	28.1	Very low	144 Å²	144	143.4 Å²	143.4	77%	0.77	79%	0.786	S	S	*	*			cis	-146.3	-174.5	5.3	-139	-39.9	0	0	0	113.9
454	L	29	Very low	28.4	Very low	146 Å²	146	144.7 Å²	144.7	76%	0.764	79%	0.785	S	S	*	*			trans	-104.7	126.9	-158.4	-178.7	82.9	0	0	0	116.1
455	K	24.7	Very low	28.9	Very low	193 Å²	193	149.2 Å²	149.2	84%	0.839	79%	0.793	S	S	*	*			trans	176.6	124.6	134.3	-102.3	164.5	-175.7	173.3	0	118.6
456	K	28.6	Very low	28.9	Very low	187 Å²	187	150.9 Å²	150.9	81%	0.813	79%	0.789	S	S	*	*			trans	29	133.1	133.9	-75.1	-170.1	175.2	-175.9	0	124.6
457	N	24.1	Very low	28.9	Very low	141 Å²	141	151.7 Å²	151.7	75%	0.754	78%	0.78	S	S	*	*			trans	87.4	105.5	135.5	-69.2	18.8	0	0	0	122.6
458	N	26.2	Very low	28.8	Very low	155 Å²	155	146.9 Å²	146.9	83%	0.829	77%	0.765	S	S	*	*				9.8	151.9	116.8	-76.9	4.5	0	0	0	120
459	P	39.5	Very low	28.5	Very low	123 Å²	123	148.9 Å²	148.9	80%	0.799	77%	0.771	S	S	*	*			cis	-143	170	34.6	42.4	-24	0	0	0	120
460	S	24.3	Very low	28.6	Very low	95 Å²	95	146.7 Å²	146.7	66%	0.664	77%	0.766	S	S	*	*			trans	-32	142.6	158.1	-172.6	0	0	0	0	117.3
461	L	30.6	Very low	28.6	Very low	160 Å²	160	150.3 Å²	150.3	84%	0.838	76%	0.764	S	S	*	*				-172.1	132	104.6	-99.7	172.7	0	0	0	116.6
462	A	27.2	Very low	28.5	Very low	71 Å²	71	150.9 Å²	150.9	59%	0.587	76%	0.761	S	S	*	*			trans	31.1	115.1	144.5	0	0	0	0	0	121.8
463	S	32	Very low	28.6	Very low	118 Å²	118	147.6 Å²	147.6	83%	0.825	75%	0.754	S	S	*	*				-166.5	153.6	106.9	-83.6	0	0	0	0	111.8
464	K	32.9	Very low	28.7	Very low	178 Å²	178	148.2 Å²	148.2	77%	0.774	75%	0.752	S	S	*	*			cis	-177.4	144.4	-34.2	-131	174.5	-178.8	172.9	0	105.6
465	K	35.3	Very low	28.7	Very low	193 Å²	193	147.2 Å²	147.2	84%	0.839	76%	0.757	S	S	*	*			trans	67.7	114	174.9	-61.4	-172.5	174.9	-170.4	0	114.7
466	Y	25.7	Very low	29.1	Very low	196 Å²	196	146 Å²	146	77%	0.769	76%	0.755	S	S	*	*			cis	65.5	120.8	13.6	-132	-102.4	0	0	0	112.5
467	Q	24.8	Very low	29.5	Very low	134 Å²	134	145.4 Å²	145.4	63%	0.626	76%	0.76	S	S	*	*			cis	-157.9	177.2	-5.1	-148.2	178.4	6.7	0	0	109.3
468	S	27.6	Very low	29.8	Very low	92 Å²	92	141.7 Å²	141.7	64%	0.643	76%	0.756	S	S	*	*			trans	-6.1	131.7	155.4	53.4	0	0	0	0	118.5
469	D	24.8	Very low	30.2	Very low	167 Å²	167	143.4 Å²	143.4	89%	0.893	76%	0.764	S	S	*	*				-144.6	162.2	129	-125.3	-34.2	0	0	0	110.9
470	M	31.1	Very low	29.7	Very low	152 Å²	152	141.2 Å²	141.2	75%	0.749	76%	0.763	S	S	*	*			trans	-104.7	154	-175.5	-61.9	178.4	75.8	0	0	111.4
471	Y	27.7	Very low	29.9	Very low	187 Å²	187	144.1 Å²	144.1	73%	0.733	77%	0.772	S	S	*	*				164.5	136.9	121.8	-104.8	-116.7	0	0	0	113
472	W	26.9	Very low	30.2	Very low	198 Å²	198	141.2 Å²	141.2	75%	0.75	77%	0.765	S	S	*	*				42.9	158.6	127.3	-67.6	59.2	0	0	0	121.7
473	A	30.4	Very low	30.4	Very low	69 Å²	69	142.1 Å²	142.1	57%	0.57	77%	0.772	S	S	*	*			cis	-172.7	-179.6	-20.3	0	0	0	0	0	109.5
474	Q	30.1	Very low	30.5	Very low	158 Å²	158	148 Å²	148	74%	0.738	78%	0.778	S	S	*	*			trans	47.4	127.4	146.7	-78.6	173.1	-24.6	0	0	121.6
475	S	29.1	Very low	30.3	Very low	125 Å²	125	142.9 Å²	142.9	87%	0.874	78%	0.775	S	S	*	*			trans	-70.1	145.5	138.5	49.5	0	0	0	0	110.1
476	Q	32	Very low	30.3	Very low	168 Å²	168	138.6 Å²	138.6	79%	0.785	77%	0.77	S	S	*	*			trans	-136.3	132.8	-162.1	173	179.7	72	0	0	112.8
477	D	36.9	Very low	30.6	Very low	173 Å²	173	138.1 Å²	138.1	93%	0.925	77%	0.774	S	S	*	*			trans	-171.3	134.2	157	-89.1	-40.1	0	0	0	106.5
478	G	30.3	Very low	32.1	Very low	64 Å²	64	137.8 Å²	137.8	66%	0.66	78%	0.784	S	S	*	*			cis	177.7	150	-11.7	0	0	0	0	0	111
479	L	34.1	Very low	32.5	Very low	191 Å²	191	136.9 Å²	136.9	100%	1	79%	0.788	S	S	*	*			trans	70.4	154.6	175.6	-44.4	175.6	0	0	0	116.8
480	G	30.4	Very low	33.8	Very low	76 Å²	76	135 Å²	135	78%	0.784	79%	0.786	S	S	*	*			trans	179.4	-56.9	175.9	0	0	0	0	0	121
481	D	28.8	Very low	33.8	Very low	157 Å²	157	132 Å²	132	84%	0.84	79%	0.785	S	S	*	*			trans	73.2	147.3	174.8	-152.7	3.7	0	0	0	120.7
482	S	35.9	Very low	34	Very low	99 Å²	99	128.7 Å²	128.7	69%	0.692	79%	0.789	S	S	*	*			trans	60.5	117.6	148.6	-78.9	0	0	0	0	126.8
483	A	31.7	Very low	34.4	Very low	89 Å²	89	123.3 Å²	123.3	74%	0.736	78%	0.781	S	S	*	*				96.2	120.1	118.6	0	0	0	0	0	124.2
484	Y	33.9	Very low	34.6	Very low	242 Å²	242	130.8 Å²	130.8	95%	0.949	80%	0.795	S	S	*	*			trans	51.4	130.7	136.1	-108.7	-93.1	0	0	0	123.3
485	G	29.6	Very low	34.7	Very low	70 Å²	70	131 Å²	131	72%	0.722	79%	0.794	S	S	*	*			trans	157.3	133.1	157.8	0	0	0	0	0	114.7
486	S	35.4	Very low	34.8	Very low	104 Å²	104	130.5 Å²	130.5	73%	0.727	78%	0.78	S	S	*	*			trans	-139.8	129	-170.7	-54.5	0	0	0	0	115.4
487	H	32.1	Very low	34.7	Very low	186 Å²	186	129.5 Å²	129.5	86%	0.861	78%	0.775	S	S	*	*			trans	59.3	-172.7	150.7	-65.8	-43.8	0	0	0	116.9
488	P	55.9	Low	34.3	Very low	127 Å²	127	128.2 Å²	128.2	83%	0.825	76%	0.763	S	S	*	*			cis	-127.7	175.4	-14.9	26.8	-5.5	0	0	0	114.6
489	G	34.8	Very low	34.3	Very low	72 Å²	72	131.4 Å²	131.4	74%	0.742	77%	0.765	S	S	*	*			trans	167.2	120	155.1	0	0	0	0	0	116.1
490	P	51.8	Low	34.1	Very low	129 Å²	129	128 Å²	128	84%	0.838	75%	0.747	S	S	*	*			trans	-135.6	168.9	-148.8	40.6	-22.3	0	0	0	118
491	A	32.6	Very low	34	Very low	89 Å²	89	131.3 Å²	131.3	74%	0.736	74%	0.744	S	S	*	*				137.8	140.1	111.2	0	0	0	0	0	117.8
492	S	30.7	Very low	34.1	Very low	116 Å²	116	130.9 Å²	130.9	81%	0.811	74%	0.737	S	S	*	*			trans	76.2	144.1	140.7	-166	0	0	0	0	121
493	S	35.1	Very low	33.8	Very low	85 Å²	85	134 Å²	134	59%	0.594	74%	0.741	S	S	*	*			cis	178.5	143.6	-40.5	-122.3	0	0	0	0	111.4
494	R	35.8	Very low	33.6	Very low	226 Å²	226	133.4 Å²	133.4	85%	0.853	74%	0.743	S	S	*	*			trans	70	157.4	148.6	-62.8	166.8	-175.2	-169.7	-1.3	116.5
495	K	32.6	Very low	33.4	Very low	164 Å²	164	126.6 Å²	126.6	71%	0.713	74%	0.736	S	S	*	*			cis	-163.4	152.2	-4	-129.2	-173.2	162.6	-155.6	0	111.4
496	I	30.9	Very low	33.4	Very low	114 Å²	114	128.5 Å²	128.5	59%	0.585	75%	0.745	S	S	*	*			trans	64.9	126.9	145.1	-79.3	174.5	0	0	0	117.6
497	Q	29.3	Very low	33	Very low	147 Å²	147	127.4 Å²	127.4	69%	0.687	75%	0.75	S	S	*	*			cis	84.1	131.9	43.7	-169.1	-173.2	10.2	0	0	111.3
498	E	29.5	Very low	32.9	Very low	145 Å²	145	129.8 Å²	129.8	68%	0.678	75%	0.754	S	S	*	*			cis	-178.7	-176.3	-5.9	-177.4	169.4	-122.9	0	0	108.9
499	L	29.1	Very low	31.5	Very low	132 Å²	132	132.5 Å²	132.5	69%	0.691	75%	0.752	S	S	*	*			trans	86.1	117.8	161.4	-55.4	176.4	0	0	0	121.4
500	D	29.3	Very low	31.2	Very low	118 Å²	118	136.7 Å²	136.7	63%	0.631	75%	0.752	S	S	*	*				78.7	139.6	123.6	-63.6	4.3	0	0	0	125.1
501	M	28.9	Very low	30	Very low	146 Å²	146	135.6 Å²	135.6	72%	0.719	74%	0.74	S	S	*	*			trans	33.2	143.8	142.9	-90.1	80.8	77.3	0	0	121.5
502	E	30.9	Very low	29.8	Very low	148 Å²	148	138.8 Å²	138.8	69%	0.692	74%	0.739	S	S	*	*			cis	-171.7	174.5	-4.6	-146.7	-179.9	-169.6	0	0	108.5
503	H	29.6	Very low	29.7	Very low	166 Å²	166	138.5 Å²	138.5	77%	0.769	73%	0.733	S	S	*	*			trans	57.9	140.7	156.6	-73.8	106.6	0	0	0	121.8
504	G	27.3	Very low	30	Very low	75 Å²	75	139.7 Å²	139.7	77%	0.773	74%	0.739	S	S	*	*			trans	120.4	89.4	132.7	0	0	0	0	0	120.6
505	A	29.2	Very low	29.7	Very low	99 Å²	99	139.4 Å²	139.4	82%	0.818	74%	0.738	S	S	*	*			trans	18.2	124.2	143.7	0	0	0	0	0	123.1
506	A	29.7	Very low	29.5	Very low	110 Å²	110	141 Å²	141	91%	0.909	74%	0.741	S	S	*	*			trans	53.7	122.5	133.1	0	0	0	0	0	122.4
507	G	28.7	Very low	29.2	Very low	81 Å²	81	144.1 Å²	144.1	84%	0.835	75%	0.752	S	S	*	*			trans	170.9	102.9	161	0	0	0	0	0	117
508	Y	28.4	Very low	29.2	Very low	237 Å²	237	140 Å²	140	93%	0.929	75%	0.75	S	S	*	*			trans	-45.9	141	175	-67.2	-100.5	0	0	0	117.2
509	K	26.4	Very low	29.2	Very low	183 Å²	183	138.5 Å²	138.5	80%	0.796	76%	0.755	S	S	*	*				172.1	140.4	103.5	-96.3	-171	177.2	-170.7	0	115.5
510	H	29	Very low	29.2	Very low	160 Å²	160	138.9 Å²	138.9	74%	0.741	76%	0.757	S	S	*	*			trans	59.4	155.2	160.5	-83.3	-93	0	0	0	117.8
511	D	27.1	Very low	29.3	Very low	107 Å²	107	141.7 Å²	141.7	57%	0.572	77%	0.767	S	S	*	*			cis	-147.4	163.3	15.7	-142.4	-17.1	0	0	0	115.3
512	Q	28	Very low	29.2	Very low	155 Å²	155	139.7 Å²	139.7	72%	0.724	77%	0.766	S	S	*	*			trans	31.4	143.4	150.5	-83.1	165.6	85.1	0	0	123.1
513	T	29.7	Very low	29.1	Very low	111 Å²	111	139.6 Å²	139.6	68%	0.681	77%	0.769	S	S	*	*			cis	-169.5	160.3	-19.3	8.7	0	0	0	0	109.7
514	P	41.3	Very low	29	Very low	110 Å²	110	136.9 Å²	136.9	71%	0.714	77%	0.769	S	S	*	*			trans	-111.3	163	-173.2	40.9	-33	0	0	0	116.5
515	W	28.1	Very low	29.1	Very low	220 Å²	220	140.3 Å²	140.3	83%	0.833	77%	0.77	S	S	*	*			trans	-153.9	150.5	173.6	-71.9	88.1	0	0	0	109.7
516	Y	28.9	Very low	29	Very low	198 Å²	198	142 Å²	142	78%	0.776	76%	0.764	S	S	*	*			cis	-165	174.3	-22.3	-149.5	-100.3	0	0	0	109.4
517	E	24.8	Very low	28.9	Very low	178 Å²	178	145.8 Å²	145.8	83%	0.832	76%	0.76	S	S	*	*			trans	-135.8	142	179.6	-175.9	174.1	-172.4	0	0	113.1
518	G	29	Very low	29	Very low	62 Å²	62	150.5 Å²	150.5	64%	0.639	76%	0.761	S	S	*	*			trans	69.5	179.9	172.7	0	0	0	0	0	116.7
519	S	30	Very low	28.9	Very low	112 Å²	112	148.3 Å²	148.3	78%	0.783	76%	0.759	S	S	*	*			cis	-179.3	146.7	-29.5	-102.8	0	0	0	0	109.9
520	L	29.8	Very low	29	Very low	141 Å²	141	147.5 Å²	147.5	74%	0.738	76%	0.758	S	S	*	*			trans	71.1	123.5	161.6	-62.1	164.9	0	0	0	120.8
521	E	29.8	Very low	29	Very low	177 Å²	177	148 Å²	148	83%	0.827	76%	0.76	S	S	*	*				49.4	148.4	123.4	-65.8	175.7	-172.1	0	0	122.7
522	C	28.1	Very low	29.1	Very low	103 Å²	103	148 Å²	148	70%	0.696	77%	0.769	S	S	*	*			cis	-170.3	152.1	-18.4	-171.6	0	0	0	0	109.8
523	L	28.6	Very low	29.2	Very low	146 Å²	146	146.1 Å²	146.1	76%	0.764	77%	0.768	S	S	*	*				141.3	137.5	128.7	-78.1	173.1	0	0	0	115.6
524	S	27.8	Very low	29.3	Very low	110 Å²	110	150.7 Å²	150.7	77%	0.769	77%	0.772	S	S	*	*			trans	63.8	145.6	155.2	63.7	0	0	0	0	118.3
525	D	29	Very low	28.8	Very low	146 Å²	146	151 Å²	151	78%	0.781	77%	0.768	S	S	*	*			cis	-159.1	-178.5	5.1	-141.4	-36.4	0	0	0	112.9
526	L	27.4	Very low	29.1	Very low	134 Å²	134	145 Å²	145	70%	0.702	76%	0.76	S	S	*	*			trans	84.1	106.5	156.1	-70.9	153.1	0	0	0	122.4
527	K	28	Very low	29.1	Very low	190 Å²	190	143 Å²	143	83%	0.826	76%	0.759	S	S	*	*			trans	89.9	145.5	131.2	-83.2	179.1	178	179.2	0	123
528	Q	29.4	Very low	29.5	Very low	181 Å²	181	141 Å²	141	85%	0.846	75%	0.754	S	S	*	*			trans	-96	157.4	-178	-51.3	148	-77.2	0	0	111.8
529	Q	26.2	Very low	30	Very low	191 Å²	191	143.1 Å²	143.1	89%	0.893	76%	0.759	S	S	*	*			trans	-155.4	152.1	131.7	-162.3	158.9	-38.3	0	0	111.1
530	E	30	Very low	30.2	Very low	165 Å²	165	145.7 Å²	145.7	77%	0.771	76%	0.764	S	S	*	*			trans	-106.7	155	-175.1	-53.4	170.9	112.5	0	0	113.1
531	Q	28.9	Very low	30.4	Very low	170 Å²	170	143.1 Å²	143.1	79%	0.794	76%	0.763	S	S	*	*			trans	163.1	119.9	133.1	-87	155.6	16.7	0	0	109.9
532	S	27.6	Very low	30.6	Very low	107 Å²	107	142.5 Å²	142.5	75%	0.748	76%	0.764	S	S	*	*				78.1	140.7	81.2	103.3	0	0	0	0	113.5
533	V	30	Very low	30.8	Very low	117 Å²	117	143.2 Å²	143.2	71%	0.709	77%	0.771	S	S	*	*			cis	-166.5	149.5	-0.5	94.1	0	0	0	0	111.8
534	R	32.9	Very low	31.2	Very low	206 Å²	206	143.1 Å²	143.1	78%	0.777	77%	0.771	S	S	*	*			trans	62.4	160.3	159.7	-67.4	-179	177.2	-86.4	0.1	119.3
535	D	30.2	Very low	31.4	Very low	116 Å²	116	146.1 Å²	146.1	62%	0.62	78%	0.776	S	S	*	*			cis	-158.8	144.2	-18.6	-100.6	-21.4	0	0	0	112
536	S	34.2	Very low	32	Very low	95 Å²	95	145.6 Å²	145.6	66%	0.664	78%	0.779	S	S	*	*			trans	54.8	120.3	136.3	-158.9	0	0	0	0	125.4
537	M	30.6	Very low	32.1	Very low	155 Å²	155	142.6 Å²	142.6	76%	0.764	78%	0.78	S	S	*	*			trans	60.3	161.2	140.1	-68.1	168.5	64.9	0	0	119.2
538	D	31.6	Very low	32.5	Very low	136 Å²	136	138.8 Å²	138.8	73%	0.727	78%	0.784	S	S	*	*			cis	-150.6	-179.6	12.6	-143.1	-20.8	0	0	0	113.2
539	S	39.6	Very low	32.7	Very low	107 Å²	107	135.3 Å²	135.3	75%	0.748	78%	0.78	S	S	*	*			trans	-112.9	132.4	179.1	-60.8	0	0	0	0	114.9
540	L	34.8	Very low	33.4	Very low	167 Å²	167	133.5 Å²	133.5	87%	0.874	77%	0.773	S	S	*	*			trans	-141.2	129.4	165.7	-67.5	175.2	0	0	0	108.2
541	A	34.2	Very low	33.8	Very low	87 Å²	87	133.2 Å²	133.2	72%	0.719	78%	0.777	S	S	*	*				71.6	114.1	58	0	0	0	0	0	113
542	L	33	Very low	34	Very low	163 Å²	163	128 Å²	128	85%	0.853	77%	0.768	S	S	*	*			trans	-131.7	116.5	173.6	-74.8	178	0	0	0	110.7
543	S	32.7	Very low	34.2	Very low	119 Å²	119	132.7 Å²	132.7	83%	0.832	78%	0.778	S	S	*	*			trans	-114.1	134.3	162.3	-61.3	0	0	0	0	107.5
544	N	36.3	Very low	34.4	Very low	143 Å²	143	130.9 Å²	130.9	77%	0.765	78%	0.784	S	S	*	*			trans	-119.5	105.2	178.3	-81.9	-29.2	0	0	0	111
545	I	32.1	Very low	34.7	Very low	173 Å²	173	130.9 Å²	130.9	89%	0.887	79%	0.79	S	S	*	*			trans	-117.8	127.8	160	-68.7	174	0	0	0	105.7
546	T	42.1	Very low	35.4	Very low	136 Å²	136	131 Å²	131	83%	0.834	80%	0.797	S	S	*	*			trans	-140.6	113.7	-178.2	-33.4	0	0	0	0	113.9
547	G	30.2	Very low	35.4	Very low	71 Å²	71	137.6 Å²	137.6	73%	0.732	81%	0.807	S	S	*	*			trans	-149	165.1	150.3	0	0	0	0	0	107.1
548	A	36.4	Very low	35.9	Very low	109 Å²	109	136.2 Å²	136.2	90%	0.901	81%	0.81	S	S	*	*			cis	-162.4	175.9	-6.2	0	0	0	0	0	108.6
549	S	33.8	Very low	35.9	Very low	108 Å²	108	134.2 Å²	134.2	76%	0.755	81%	0.807	S	S	*	*			trans	-152.1	117.8	168.5	-173.1	0	0	0	0	107.2
550	M	41.1	Very low	35.4	Very low	154 Å²	154	136.8 Å²	136.8	76%	0.759	81%	0.811	S	S	*	*				56.2	126.8	84	-55.2	-137.4	66.2	0	0	112.4
551	D	38.8	Very low	35.1	Very low	158 Å²	158	139.7 Å²	139.7	85%	0.845	81%	0.812	S	S	*	*			cis	-116.2	-178.5	20.9	-56	-59.7	0	0	0	114
552	G	32.9	Very low	34.7	Very low	60 Å²	60	139.7 Å²	139.7	62%	0.619	81%	0.807	S	S	*	*			cis	176.4	166.8	-3.3	0	0	0	0	0	114
553	E	32	Very low	34.4	Very low	206 Å²	206	138.7 Å²	138.7	96%	0.963	80%	0.801	S	S	*	*			trans	64.1	158.1	168.2	-57.8	-152.8	103.6	0	0	122.3
554	G	33.1	Very low	34.2	Very low	80 Å²	80	141 Å²	141	83%	0.825	80%	0.799	S	S	*	*			trans	103.2	84.7	153.5	0	0	0	0	0	120.7
555	K	39.4	Very low	33.7	Very low	206 Å²	206	138.8 Å²	138.8	90%	0.896	79%	0.791	S	S	*	*			trans	-97.1	170	164.7	-67.3	179.6	-179.5	174.7	0	111.2
556	P	45.3	Very low	33.4	Very low	119 Å²	119	139.3 Å²	139.3	77%	0.773	79%	0.787	S	S	*	*			cis	-131.8	179.1	-9.6	36.1	-17.1	0	0	0	115.6
557	R	34.7	Very low	32.7	Very low	232 Å²	232	138.8 Å²	138.8	88%	0.875	78%	0.775	S	S	*	*			trans	-66.9	160.4	158	-90.3	179.8	167.2	169.4	-4.6	112.2
558	P	40.8	Very low	32.6	Very low	126 Å²	126	142.8 Å²	142.8	82%	0.818	78%	0.775	S	S	*	*				-127	-163.3	110.9	38.7	-33.4	0	0	0	113
559	S	31	Very low	32.4	Very low	95 Å²	95	144.2 Å²	144.2	66%	0.664	77%	0.767	S	S	*	*			trans	-150.6	157.3	-157.4	59.7	0	0	0	0	115.2
560	L	29.2	Very low	32.2	Very low	161 Å²	161	146.9 Å²	146.9	84%	0.843	77%	0.767	S	S	*	*			trans	74.4	150.8	160.9	-64.7	168.8	0	0	0	119
561	Y	27.3	Very low	31.8	Very low	228 Å²	228	145.8 Å²	145.8	89%	0.894	77%	0.769	S	S	*	*			trans	114.3	142.1	170.8	-84.1	-98	0	0	0	114.5
562	S	26.4	Very low	31.7	Very low	87 Å²	87	146.6 Å²	146.6	61%	0.608	77%	0.767	S	S	*	*			cis	170.2	145	-39.7	-177.5	0	0	0	0	107.2
563	L	28	Very low	31.6	Very low	141 Å²	141	150.7 Å²	150.7	74%	0.738	78%	0.775	S	S	*	*			trans	71	143.5	162.1	-75.9	163.5	0	0	0	121.1
564	Q	28.4	Very low	31.8	Very low	167 Å²	167	146.2 Å²	146.2	78%	0.78	77%	0.765	S	S	*	*			trans	75.1	146.2	146.9	-75.8	167.6	-3.7	0	0	119.9
565	T	24.7	Very low	32.3	Very low	98 Å²	98	149.6 Å²	149.6	60%	0.601	76%	0.759	S	S	*	*			cis	-177.6	154.4	-22.4	-109.1	0	0	0	0	110.7
566	F	27	Very low	32.5	Very low	183 Å²	183	147.4 Å²	147.4	80%	0.803	75%	0.75	S	S	*	*			trans	65.1	164.9	168.9	-67.7	-32.9	0	0	0	117.1
567	Q	27.1	Very low	32.2	Very low	126 Å²	126	149.6 Å²	149.6	59%	0.589	75%	0.752	S	S	*	*			cis	-174.1	167	-27	177.3	165	-41.9	0	0	108.4
568	E	27.9	Very low	32.4	Very low	154 Å²	154	143.7 Å²	143.7	72%	0.72	75%	0.746	S	S	*	*			trans	64	175.4	166.2	-89.9	132.2	-144.5	0	0	117.1
569	L	31.1	Very low	32.6	Very low	140 Å²	140	144.3 Å²	144.3	73%	0.733	74%	0.743	S	S	*	*				-169.4	165.7	-58	-116.4	171.4	0	0	0	107.6
570	E	30.2	Very low	33.1	Very low	164 Å²	164	147 Å²	147	77%	0.766	75%	0.747	S	S	*	*			trans	65.8	127.6	163.2	-77.2	168.8	-165.9	0	0	117.1
571	V	32.5	Very low	33.3	Very low	130 Å²	130	142.7 Å²	142.7	79%	0.788	74%	0.741	S	S	*	*				100	150.1	62.3	163	0	0	0	0	112.1
572	E	36.5	Very low	34.1	Very low	175 Å²	175	137.5 Å²	137.5	82%	0.818	73%	0.733	S	S	*	*			trans	-24.5	158.2	-175.9	-63.3	177	143.8	0	0	118.8
573	D	30.8	Very low	34.5	Very low	147 Å²	147	140.3 Å²	140.3	79%	0.786	74%	0.741	S	S	*	*			cis	-162.6	-178.5	43.1	-158.4	-7.1	0	0	0	113.2
574	C	37.3	Very low	34.9	Very low	111 Å²	111	140.7 Å²	140.7	75%	0.75	74%	0.744	S	S	*	*			trans	-94.8	164.1	-179	-71	0	0	0	0	114.5
575	E	43.4	Very low	35.4	Very low	151 Å²	151	137.5 Å²	137.5	71%	0.706	74%	0.739	S	S	*	*			trans	-173.5	144.1	136.9	-110.9	-166.8	151.1	0	0	117.4
576	K	43.7	Very low	36.2	Very low	160 Å²	160	137.7 Å²	137.7	70%	0.696	75%	0.745	S	S	*	*			trans	69.2	154.2	152.6	-67.3	160.7	179	147.5	0	118.3
577	M	37.9	Very low	36.6	Very low	165 Å²	165	136.4 Å²	136.4	81%	0.813	74%	0.743	S	S	*	*			cis	-142.5	137.7	20.3	-19.5	174.4	63.9	0	0	115.5
578	S	39.2	Very low	36.8	Very low	108 Å²	108	137.3 Å²	137.3	76%	0.755	75%	0.751	S	S	*	*			trans	23	154	136.5	57.2	0	0	0	0	123.9
579	N	44.1	Very low	37	Very low	140 Å²	140	138.1 Å²	138.1	75%	0.749	76%	0.755	S	S	*	*			cis	-174.9	-155.8	-19	-156.7	-0.1	0	0	0	106.1
580	M	43.5	Very low	37	Very low	151 Å²	151	142.7 Å²	142.7	74%	0.744	76%	0.762	S	S	*	*			cis	-164.6	150	0	169.1	62.6	93.5	0	0	109	T582	M580-T582 HydrophobicContact SD-CG2 4.44Å
581	G	33.1	Very low	37	Very low	70 Å²	70	139.6 Å²	139.6	72%	0.722	76%	0.759	S	S	*	*			trans	175.8	133.9	165.3	0	0	0	0	0	114.6
582	T	42.6	Very low	37.1	Very low	119 Å²	119	139.2 Å²	139.2	73%	0.73	76%	0.757	S	S	*	*			trans	-124.9	162.8	-169	56	0	0	0	0	113.8	M580	M580-T582 HydrophobicContact SD-CG2 4.44Å
583	L	36.7	Very low	37	Very low	147 Å²	147	139.4 Å²	139.4	77%	0.77	76%	0.758	S	S	*	*				-172.2	146	89.9	-84	172	0	0	0	112.9
584	N	35.5	Very low	37	Very low	149 Å²	149	136.1 Å²	136.1	80%	0.797	75%	0.746	S	S	*	*			trans	50.3	151.7	150.6	-77.6	-13.2	0	0	0	121.3
585	S	38.2	Very low	36.8	Very low	99 Å²	99	139 Å²	139	69%	0.692	75%	0.753	S	S	*	*			cis	179.6	157	-5.5	47.7	0	0	0	0	108.9
586	S	41.2	Very low	36.2	Very low	103 Å²	103	140.6 Å²	140.6	72%	0.72	76%	0.758	S	S	*	*			cis	-179.9	162.9	-15.4	57.8	0	0	0	0	111.4
587	M	35.7	Very low	35.7	Very low	156 Å²	156	137.7 Å²	137.7	77%	0.768	76%	0.758	S	S	*	*			trans	84.3	130.4	150.4	-76.1	-66.7	-92.1	0	0	124.3
588	L	32.6	Very low	35.3	Very low	144 Å²	144	137.6 Å²	137.6	75%	0.754	76%	0.76	S	S	*	*			trans	93.4	135.4	149.6	-68.8	170.7	0	0	0	123.3
589	H	31.2	Very low	34.7	Very low	172 Å²	172	137.4 Å²	137.4	80%	0.796	76%	0.759	S	S	*	*			trans	-93.8	164.4	-162.8	-42.4	-100.7	0	0	0	115.7
590	R	31	Very low	34	Very low	236 Å²	236	135.8 Å²	135.8	89%	0.891	76%	0.758	S	S	*	*				-167	144.9	110.4	-106.8	177	-177.5	-160.2	-0.5	114.7
591	S	29.8	Very low	33.3	Very low	99 Å²	99	137.5 Å²	137.5	69%	0.692	76%	0.764	S	S	*	*			trans	22.6	126.2	147	-53.8	0	0	0	0	119.3
592	T	35.9	Very low	33.1	Very low	121 Å²	121	140.8 Å²	140.8	74%	0.742	77%	0.765	S	S	*	*			cis	58.8	137.2	32.8	77.6	0	0	0	0	117.4
593	E	34.6	Very low	32.3	Very low	179 Å²	179	141.6 Å²	141.6	84%	0.836	77%	0.773	S	S	*	*			trans	69.9	153.7	155.9	-86.4	-179.3	-122.9	0	0	119.1
594	S	30.9	Very low	32	Very low	79 Å²	79	142.8 Å²	142.8	55%	0.552	78%	0.775	S	S	*	*			cis	-154.9	160.3	-2.5	-145.8	0	0	0	0	110.5
595	L	32.2	Very low	31.6	Very low	171 Å²	171	144.7 Å²	144.7	90%	0.895	78%	0.779	S	S	*	*				-180	139.7	104.3	-94.2	175.7	0	0	0	112.8
596	K	30.7	Very low	31	Very low	185 Å²	185	149.5 Å²	149.5	80%	0.804	79%	0.788	S	S	*	*			trans	-103.3	151.4	169.3	-57.9	168.3	-178.1	171.3	0	109.1
597	S	32.3	Very low	30.4	Very low	99 Å²	99	151.2 Å²	151.2	69%	0.692	79%	0.794	S	S	*	*				157.8	119.2	129.9	-75.2	0	0	0	0	110.1
598	L	30.4	Very low	29.9	Very low	163 Å²	163	151.8 Å²	151.8	85%	0.853	80%	0.799	S	S	*	*				67.7	135.1	92.4	-63.2	171.2	0	0	0	112.8
599	S	27.1	Very low	29.9	Very low	104 Å²	104	149.9 Å²	149.9	73%	0.727	80%	0.795	S	S	*	*			cis	-157.2	156.1	15.4	47.5	0	0	0	0	113.5
600	S	28.4	Very low	29.7	Very low	106 Å²	106	148.6 Å²	148.6	74%	0.741	79%	0.789	S	S	*	*			trans	50.8	108.2	146.3	-173.6	0	0	0	0	119.2
601	E	29.3	Very low	29.4	Very low	186 Å²	186	146.5 Å²	146.5	87%	0.869	79%	0.79	S	S	*	*				-160.9	166.8	104.3	-114.3	175.5	-141.3	0	0	112.6
602	L	28.5	Very low	29.3	Very low	140 Å²	140	148.2 Å²	148.2	73%	0.733	79%	0.785	S	S	*	*			trans	51	113.6	172	-163.7	65.5	0	0	0	118.5	Q604	L602-Q604 HydrophobicContact CD2-CB 4.37Å; L602-Q604 HydrophobicContact CG-CB 4.38Å; L602-Q604 PolarHBondContact O-N 3.37Å; L602-Q604 VanDerWaalsContact O-N 3.08Å
603	C	26.8	Very low	29	Very low	135 Å²	135	148.5 Å²	148.5	91%	0.912	79%	0.788	S	S	*	*			trans	-68.7	100.1	154.6	-74	0	0	0	0	109.8
604	Q	29.1	Very low	28.6	Very low	172 Å²	172	146.3 Å²	146.3	80%	0.804	79%	0.787	S	S	*	*			trans	-136.1	135.2	152.3	-133	170.8	12.8	0	0	112.8	L602 K606	L602-Q604 HydrophobicContact CD2-CB 4.37Å; L602-Q604 HydrophobicContact CG-CB 4.38Å; L602-Q604 PolarHBondContact O-N 3.37Å; L602-Q604 VanDerWaalsContact O-N 3.08Å; Q604-K606 PolarHBondContact O-N 2.97Å; Q604-K606 VanDerWaalsContact O-N 3.14Å
605	E	28.9	Very low	28.9	Very low	190 Å²	190	150 Å²	150	89%	0.888	80%	0.795	S	S	*	*			trans	-60.5	102.8	-165.6	-164	165.2	169.1	0	0	113.4
606	K	25.6	Very low	28.7	Very low	200 Å²	200	149.3 Å²	149.3	87%	0.87	79%	0.789	S	S	*	*			trans	14.9	102.5	158.7	-69.3	-179.9	178	176.3	0	117.1	Q604 L608	Q604-K606 PolarHBondContact O-N 2.97Å; Q604-K606 VanDerWaalsContact O-N 3.14Å; K606-L608 PolarHBondContact O-N 3.21Å; K606-L608 VanDerWaalsContact O-N 3.09Å
607	V	26.9	Very low	28.8	Very low	139 Å²	139	144.8 Å²	144.8	84%	0.842	78%	0.779	S	S	*	*			trans	-53.4	109.5	147	176	0	0	0	0	109.9
608	L	26.1	Very low	28.7	Very low	168 Å²	168	145.3 Å²	145.3	88%	0.88	78%	0.778	S	S	*	*			trans	-147.1	87.5	142.8	-159.9	90.6	0	0	0	108.2	K606	K606-L608 PolarHBondContact O-N 3.21Å; K606-L608 VanDerWaalsContact O-N 3.09Å
609	P	33.2	Very low	28.7	Very low	104 Å²	104	145.2 Å²	145.2	68%	0.675	78%	0.777	S	S	*	*			trans	-75.6	165.9	-175.6	32.2	-35.8	0	0	0	112.1	E611	P609-E611 PolarHBondContact O-N 3.31Å
610	E	25.6	Very low	28.9	Very low	144 Å²	144	151.6 Å²	151.6	67%	0.673	79%	0.785	S	S	*	*			trans	-52.8	132.9	169.7	-52.9	169.8	81.2	0	0	111.8	K612	E610-K612 WeakPolarHBondContact OE1-CE 3.42Å; E610-K612 IonicContact OE1-NZ 3.4Å; E610-K612 PolarHBondContact OE1-NZ 2.95Å; E610-K612 IonicContact OE2-NZ 2.75Å; E610-K612 PolarHBondContact OE2-NZ 3.47Å
611	E	24.7	Very low	29	Very low	192 Å²	192	158 Å²	158	90%	0.897	79%	0.793	S	S	*	*			trans	-109.7	131.3	141.4	-82.4	-98.3	111.2	0	0	107.3	P609	P609-E611 PolarHBondContact O-N 3.31Å
612	K	29	Very low	29	Very low	136 Å²	136	154.5 Å²	154.5	59%	0.591	79%	0.789	S	S	*	*			trans	-80.7	161.5	-172	-82.6	163.6	173.2	102.7	0	111.1	E610 V614	E610-K612 WeakPolarHBondContact OE1-CE 3.42Å; E610-K612 IonicContact OE1-NZ 3.4Å; E610-K612 PolarHBondContact OE1-NZ 2.95Å; E610-K612 IonicContact OE2-NZ 2.75Å; E610-K612 PolarHBondContact OE2-NZ 3.47Å; K612-V614 PolarHBondContact O-N 3.5Å
613	P	29.9	Very low	29	Very low	126 Å²	126	157.7 Å²	157.7	82%	0.818	80%	0.797	S	S	*	*			trans	-53.5	126.2	-177	19.6	-33.5	0	0	0	112.6	H615	P613-H615 PolarHBondContact O-N 2.68Å
614	V	25.9	Very low	29.1	Very low	133 Å²	133	156.5 Å²	156.5	81%	0.806	79%	0.79	S	S	*	*			trans	-70.7	98.3	179.1	177.9	0	0	0	0	109.7	K612	K612-V614 PolarHBondContact O-N 3.5Å
615	H	35.8	Very low	29.4	Very low	156 Å²	156	157.8 Å²	157.8	72%	0.722	80%	0.796	S	S	*	*			trans	-93.9	94.6	177.6	-174.5	-63.6	0	0	0	111.3	P613	P613-H615 PolarHBondContact O-N 2.68Å
616	M	27.7	Very low	29.5	Very low	157 Å²	157	154.3 Å²	154.3	77%	0.773	79%	0.793	S	S	*	*			trans	-143.8	145.5	177.3	-91.2	-75.2	-79.3	0	0	111.7
617	P	32.7	Very low	29.8	Very low	90 Å²	90	155.9 Å²	155.9	58%	0.584	79%	0.793	S	S	*	*			cis	-120.2	132.7	-9	35.7	-20.9	0	0	0	113.6	L619	P617-L619 PolarHBondContact O-N 2.94Å
618	V	30.6	Very low	30	Very low	111 Å²	111	154.9 Å²	154.9	67%	0.673	79%	0.79	S	S	*	*			trans	-78.5	106.7	163.9	179	0	0	0	0	109
619	L	31.1	Very low	30	Very low	160 Å²	160	155.3 Å²	155.3	84%	0.838	79%	0.787	S	S	*	*			trans	-81.4	130.8	170.9	-75.2	176.8	0	0	0	111.1	P617	P617-L619 PolarHBondContact O-N 2.94Å
620	R	30.5	Very low	29.8	Very low	238 Å²	238	159.3 Å²	159.3	90%	0.898	80%	0.797	S	S	*	*			trans	-79.5	139.4	-173.9	-65.3	173.7	166.5	92.5	-4.7	111.6
621	R	30.8	Very low	29.9	Very low	242 Å²	242	157.4 Å²	157.4	91%	0.913	80%	0.795	S	S	*	*			trans	-138.4	135	145.9	-133.8	168.8	-176	159.8	0.6	111.5
622	S	28.9	Very low	30	Very low	111 Å²	111	157.4 Å²	157.4	78%	0.776	79%	0.792	S	S	*	*			trans	-33.5	125.8	-176.4	47.4	0	0	0	0	117.5
623	K	29.2	Very low	29.9	Very low	208 Å²	208	160 Å²	160	90%	0.904	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-81.7	117	149.3	-79.3	-172.2	174.3	-177.3	0	109.1
624	S	29.8	Very low	29.9	Very low	110 Å²	110	159.4 Å²	159.4	77%	0.769	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-76.7	146	159.2	40.3	0	0	0	0	109.6
625	Q	34.1	Very low	30.1	Very low	199 Å²	199	161 Å²	161	93%	0.93	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-103.5	119.5	168.4	-70.7	-175.1	-3.7	0	0	109.1
626	S	31.1	Very low	29.8	Very low	116 Å²	116	161.2 Å²	161.2	81%	0.811	81%	0.813	S	S	*	*			trans	-128.6	124.9	158.5	48.4	0	0	0	0	107.7
627	R	31.3	Very low	30	Very low	234 Å²	234	160.1 Å²	160.1	88%	0.883	81%	0.814	S	S	*	*			trans	-118.3	114.5	-175.3	179.9	-175.6	-177.4	-173.4	2.4	107.9	Q629	R627-Q629 PolarHBondContact O-N 3.26Å
628	P	31.2	Very low	29.9	Very low	118 Å²	118	163.3 Å²	163.3	77%	0.766	83%	0.825	S	S	*	*			trans	-63.3	133.8	172.8	26.4	-32.5	0	0	0	109.5	Q630	P628-Q630 PolarHBondContact O-N 2.97Å
629	Q	27.8	Very low	29.8	Very low	176 Å²	176	165.3 Å²	165.3	82%	0.822	83%	0.832	S	S	*	*			trans	-89.3	84.8	-168.7	-174.3	170.9	-19.9	0	0	110.5	R627 V631	R627-Q629 PolarHBondContact O-N 3.26Å; Q629-V631 PolarHBondContact O-N 3.23Å
630	Q	27.1	Very low	29.7	Very low	188 Å²	188	165.1 Å²	165.1	88%	0.879	83%	0.832	S	S	*	*			trans	-60.8	109.5	168.5	-82.6	-174.8	-36.9	0	0	110	P628 K632	P628-Q630 PolarHBondContact O-N 2.97Å; Q630-K632 PolarHBondContact O-N 3.45Å
631	V	28.7	Very low	29.7	Very low	104 Å²	104	157.4 Å²	157.4	63%	0.63	83%	0.826	S	S	*	*			trans	-73.4	109.3	169.2	178.9	0	0	0	0	107.9	Q629 F633	Q629-V631 PolarHBondContact O-N 3.23Å; V631-F633 HydrophobicContact CG1-CD2 4.15Å; V631-F633 HydrophobicContact CG1-CE2 3.92Å; V631-F633 PolarHBondContact O-N 2.65Å
632	K	27.4	Very low	29.6	Very low	193 Å²	193	151.1 Å²	151.1	84%	0.839	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-73.4	120.5	161.8	-73.5	-170.3	172.4	-167.5	0	108.3	Q630	Q630-K632 PolarHBondContact O-N 3.45Å
633	F	26.4	Very low	29.8	Very low	190 Å²	190	157.4 Å²	157.4	83%	0.833	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-78.9	150.2	154.4	-78.6	-90.9	0	0	0	109	V631	V631-F633 HydrophobicContact CG1-CD2 4.15Å; V631-F633 HydrophobicContact CG1-CE2 3.92Å; V631-F633 PolarHBondContact O-N 2.65Å
634	S	30.1	Very low	29.8	Very low	114 Å²	114	155.5 Å²	155.5	80%	0.797	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-94.4	125.7	176.2	-53.6	0	0	0	0	109.5
635	D	29.4	Very low	29.8	Very low	167 Å²	167	156.7 Å²	156.7	89%	0.893	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-84.3	116.2	160.6	-83.3	-42.1	0	0	0	108.6
636	D	29.1	Very low	29.6	Very low	159 Å²	159	153.5 Å²	153.5	85%	0.85	81%	0.814	S	S	*	*			trans	-166.2	66.7	170.4	-115.8	-23.5	0	0	0	112.1
637	V	32.1	Very low	29.7	Very low	134 Å²	134	157.2 Å²	157.2	81%	0.812	82%	0.818	S	S	*	*			trans	-144.9	121.8	153.5	177.6	0	0	0	0	109.3
638	I	31.5	Very low	29.6	Very low	158 Å²	158	153.6 Å²	153.6	81%	0.81	82%	0.815	S	S	*	*			trans	-86.2	128.8	159	-63.9	-70.2	0	0	0	107.8
639	D	27.7	Very low	29.5	Very low	153 Å²	153	159.2 Å²	159.2	82%	0.818	82%	0.821	S	S	*	*			trans	-134.7	149.7	153.3	-164.6	11.9	0	0	0	109.6
640	N	29.5	Very low	29.5	Very low	156 Å²	156	159.4 Å²	159.4	83%	0.834	82%	0.822	S	S	*	*			trans	-139.4	80.4	-159.7	-153.9	20.3	0	0	0	109.7
641	G	30	Very low	29.8	Very low	75 Å²	75	156 Å²	156	77%	0.773	82%	0.816	S	S	*	*			trans	-129.8	113.9	-173.1	0	0	0	0	0	113.2
642	S	30	Very low	30.2	Very low	111 Å²	111	157 Å²	157	78%	0.776	82%	0.824	S	S	*	*			trans	-92	133	176.5	57.7	0	0	0	0	112.4
643	Y	32.9	Very low	30.2	Very low	243 Å²	243	156.9 Å²	156.9	95%	0.953	83%	0.829	S	S	*	*			trans	-150	146.6	149.3	-108.5	-77.5	0	0	0	110.4
644	E	28	Very low	30.4	Very low	168 Å²	168	153.4 Å²	153.4	79%	0.785	83%	0.828	S	S	*	*			trans	-100.1	158.2	-170.5	-92.2	-170.7	104	0	0	114.7
645	N	29.7	Very low	30.5	Very low	135 Å²	135	156.8 Å²	156.8	72%	0.722	83%	0.831	S	S	*	*			trans	54.8	93.5	151.4	-68.5	-48.8	0	0	0	120
646	V	30.8	Very low	30.6	Very low	132 Å²	132	160.5 Å²	160.5	80%	0.8	83%	0.833	S	S	*	*			trans	-137.1	129.5	135.4	-178.6	0	0	0	0	108.5
647	E	32	Very low	30.8	Very low	194 Å²	194	159.7 Å²	159.7	91%	0.907	83%	0.834	S	S	*	*			trans	-74.7	127.4	176.5	-63	-176.6	117.6	0	0	111.7
648	I	30.9	Very low	30.8	Very low	158 Å²	158	164.9 Å²	164.9	81%	0.81	84%	0.839	S	S	*	*			trans	-130.5	126.2	168.1	-60	-176.4	0	0	0	110.3
649	R	27.6	Very low	30.8	Very low	235 Å²	235	169 Å²	169	89%	0.887	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-75.5	127.1	-172.1	179.9	178.3	-177.6	156.2	-0.9	112.3
650	Q	29.5	Very low	30.9	Very low	181 Å²	181	172.4 Å²	172.4	85%	0.846	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-68.9	134	170.3	-68.1	-174.2	-2.7	0	0	111.4
651	P	32.6	Very low	30.8	Very low	117 Å²	117	171.3 Å²	171.3	76%	0.76	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-83.9	150.2	164.9	33.9	-32.4	0	0	0	111.3
652	P	36.5	Very low	30.6	Very low	123 Å²	123	178.1 Å²	178.1	80%	0.799	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-81.2	161.3	-177.7	33.8	-36.4	0	0	0	113.4
653	M	27.6	Very low	30.3	Very low	192 Å²	192	180.3 Å²	180.3	95%	0.946	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-67.9	142.2	166.4	-55.3	-167.1	-56.6	0	0	110.7
654	S	31.9	Very low	29.9	Very low	116 Å²	116	177.9 Å²	177.9	81%	0.811	84%	0.84	S	S	*	*			trans	-110.2	123.1	-178.7	59.2	0	0	0	0	112.7
655	E	30.4	Very low	30.1	Very low	185 Å²	185	177 Å²	177	86%	0.864	84%	0.837	S	S	*	*			trans	-71.5	166.7	170.9	-70.5	-171.8	94	0	0	113.5
656	R	32.7	Very low	30.2	Very low	245 Å²	245	177.1 Å²	177.1	93%	0.925	83%	0.833	S	S	*	*			trans	-57.6	138.1	176.4	-77.3	173.1	153.2	137.8	-8.8	112.8
657	T	33.1	Very low	30	Very low	142 Å²	142	181.5 Å²	181.5	87%	0.871	84%	0.835	S	S	*	*			trans	-116.2	145.8	166.8	-21.4	0	0	0	0	111.9
658	R	31.1	Very low	29.8	Very low	243 Å²	243	175.6 Å²	175.6	92%	0.917	83%	0.826	S	S	*	*			trans	-83.5	147.2	-177.7	-66.7	175.9	173.7	167	-2	112.3
659	R	32.9	Very low	29.6	Very low	245 Å²	245	174.2 Å²	174.2	93%	0.925	83%	0.83	S	S	*	*			trans	-63.2	149	176.4	-69.2	-178.5	175.6	171	-0.8	112.4
660	R	29.2	Very low	29.7	Very low	224 Å²	224	173.5 Å²	173.5	85%	0.845	83%	0.827	S	S	*	*			trans	-120.8	141.8	171.5	-171.4	-171.2	-66.2	-174.9	0.3	108.2
661	V	28.1	Very low	30.3	Very low	133 Å²	133	169.9 Å²	169.9	81%	0.806	82%	0.819	S	S	*	*			trans	-120.3	144.6	-177.6	178.2	0	0	0	0	110
662	Y	26.1	Very low	30.3	Very low	218 Å²	218	171.7 Å²	171.7	86%	0.855	82%	0.818	S	S	*	*			trans	-110.7	161.7	174.2	-107.6	-95.2	0	0	0	111.2
663	H	23	Very low	30.1	Very low	158 Å²	158	174 Å²	174	73%	0.731	82%	0.817	S	S	*	*			trans	-120.6	160	-170.3	-149.3	-76.8	0	0	0	112
664	F	25.3	Very low	30.2	Very low	191 Å²	191	171.6 Å²	171.6	84%	0.838	80%	0.803	S	S	*	*			trans	-144	162.1	168.8	-154.9	-98.3	0	0	0	109.8
665	E	30.9	Very low	30.1	Very low	151 Å²	151	177.7 Å²	177.7	71%	0.706	81%	0.808	S	S	*	*			trans	-143.3	171.2	-177.8	-60.2	-165.3	97.4	0	0	109
666	E	31.8	Very low	30.1	Very low	137 Å²	137	179.5 Å²	179.5	64%	0.64	81%	0.807	S	S	*	*			cis	-153	-178.5	19.7	-162.8	-100.2	115.4	0	0	109.7
667	R	27.2	Very low	30.1	Very low	224 Å²	224	179.4 Å²	179.4	85%	0.845	81%	0.807	S	S	*	*			trans	75.9	126.4	169.5	-52.3	-175.2	-178.4	-168.5	3.7	118.4
668	G	27.1	Very low	29.9	Very low	69 Å²	69	178 Å²	178	71%	0.711	80%	0.803	S	S	*	*			cis	160.4	106.5	-13	0	0	0	0	0	115.1
669	S	27.7	Very low	30	Very low	129 Å²	129	178.3 Å²	178.3	90%	0.902	80%	0.804	S	S	*	*			trans	-168.3	153.2	155.8	-85.2	0	0	0	0	111
670	R	30	Very low	29.9	Very low	221 Å²	221	176.5 Å²	176.5	83%	0.834	80%	0.803	S	S	*	*			trans	-149.8	152.1	-174.8	-88.2	-172.9	176.5	-173.9	1.3	108.6
671	P	41.8	Very low	29.7	Very low	104 Å²	104	170.2 Å²	170.2	68%	0.675	79%	0.793	S	S	*	*				-144.6	145.4	82.1	21.5	2.3	0	0	0	118.4
672	H	32.1	Very low	29.9	Very low	156 Å²	156	175.3 Å²	175.3	72%	0.722	80%	0.798	S	S	*	*			trans	65.8	146	139.5	-58.4	-32.6	0	0	0	121.5
673	H	32.5	Very low	30.3	Very low	170 Å²	170	170.2 Å²	170.2	79%	0.787	80%	0.795	S	S	*	*			cis	-132.5	172.2	0.9	-99.7	-57	0	0	0	112.8
674	H	28.8	Very low	30.7	Very low	142 Å²	142	170 Å²	170	66%	0.657	80%	0.798	S	S	*	*			trans	-130.3	151.8	-177.1	-71.4	-55.7	0	0	0	113.5
675	R	31.2	Very low	30.9	Very low	244 Å²	244	168.8 Å²	168.8	92%	0.921	80%	0.801	S	S	*	*			trans	-172.1	121.6	132.1	-98.2	159.8	-169.3	-145.9	3	106.5
676	R	29.8	Very low	30.9	Very low	223 Å²	223	165.8 Å²	165.8	84%	0.842	80%	0.802	S	S	*	*				55.1	121.6	53.7	-65.9	-166.6	174.4	-140.6	1.1	111.1
677	R	32.9	Very low	30.9	Very low	244 Å²	244	167.3 Å²	167.3	92%	0.921	81%	0.814	S	S	*	*				-155.5	-178.6	51.2	-83.4	176.7	171.1	169.9	-5.1	109.7
678	S	28.2	Very low	31.2	Very low	113 Å²	113	163.9 Å²	163.9	79%	0.79	81%	0.812	S	S	*	*			cis	-173	149.9	-30.1	-178.8	0	0	0	0	107.7
679	R	33.1	Very low	31.3	Very low	248 Å²	248	169.3 Å²	169.3	94%	0.936	82%	0.824	S	S	*	*			trans	-116.2	127	179	-94.9	-178.7	168.7	162.8	-4.3	112.7
680	K	30.9	Very low	31.2	Very low	208 Å²	208	167.9 Å²	167.9	90%	0.904	82%	0.82	S	S	*	*			trans	-178.2	145	158.6	-100.2	174.8	176.4	-178	0	107.1
681	S	25.4	Very low	31.2	Very low	91 Å²	91	162.2 Å²	162.2	64%	0.636	82%	0.82	S	S	*	*			cis	-169.2	156.3	-15	55.2	0	0	0	0	111
682	R	32.9	Very low	30.5	Very low	241 Å²	241	165.3 Å²	165.3	91%	0.909	83%	0.826	S	S	*	*			trans	68.5	163.4	167.6	-65.9	175.7	171.8	171.9	-4.2	114
683	S	34	Very low	30.3	Very low	111 Å²	111	169.7 Å²	169.7	78%	0.776	84%	0.836	S	S	*	*			cis	-131.6	156.9	7.4	52	0	0	0	0	113.7
684	D	31.6	Very low	29.9	Very low	152 Å²	152	172.3 Å²	172.3	81%	0.813	84%	0.839	S	S	*	*			trans	-69.3	144.6	174.8	-48.7	-92.3	0	0	0	112.3
685	N	29.7	Very low	29.6	Very low	167 Å²	167	172 Å²	172	89%	0.893	85%	0.851	S	S	*	*			trans	-157.6	90.2	156.7	-138.4	-11	0	0	0	109.5
686	A	30.1	Very low	29.3	Very low	88 Å²	88	165.9 Å²	165.9	73%	0.727	85%	0.846	S	S	*	*			trans	-134.1	107.2	-176.1	0	0	0	0	0	110.4
687	L	31.4	Very low	29.4	Very low	169 Å²	169	161.1 Å²	161.1	89%	0.885	84%	0.844	S	S	*	*			trans	-100.4	98.5	170	-72.5	175.4	0	0	0	109.2
688	N	33.7	Very low	29.1	Very low	151 Å²	151	158.7 Å²	158.7	81%	0.807	84%	0.84	S	S	*	*			trans	-84	137.2	164.9	-80.1	-19.8	0	0	0	109.6
689	L	29.2	Very low	29	Very low	184 Å²	184	161.4 Å²	161.4	96%	0.963	84%	0.84	S	S	*	*			trans	-113.9	103.3	162	-73.4	175.9	0	0	0	108.9
690	A	26.5	Very low	28.6	Very low	98 Å²	98	161.4 Å²	161.4	81%	0.81	84%	0.84	S	S	*	*			trans	-122.2	145.6	162.4	0	0	0	0	0	107.7
691	A	29.8	Very low	28.3	Very low	103 Å²	103	160.1 Å²	160.1	85%	0.851	84%	0.835	S	S	*	*			trans	-83.9	137.6	-169	0	0	0	0	0	112.9
692	E	26.4	Very low	28.4	Very low	169 Å²	169	165.8 Å²	165.8	79%	0.79	84%	0.842	S	S	*	*			trans	-122.9	130.7	153	-81	-140.4	127.8	0	0	110.8
693	R	27.4	Very low	28.1	Very low	247 Å²	247	163.7 Å²	163.7	93%	0.932	84%	0.84	S	S	*	*			trans	-98.3	122.8	157.9	-75.2	179.5	170.4	-172.1	-1	108.2
694	R	25.5	Very low	28	Very low	225 Å²	225	167.5 Å²	167.5	85%	0.849	84%	0.839	S	S	*	*			trans	-137.9	142.5	148.4	-72.3	-163.6	-177.6	-103.8	-2.1	110.6
695	C	22.7	Very low	27.7	Very low	135 Å²	135	163.3 Å²	163.3	91%	0.912	82%	0.821	S	S	*	*			trans	-88.3	155.6	179.5	-58.8	0	0	0	0	110.8
696	S	24	Very low	28	Very low	116 Å²	116	160.4 Å²	160.4	81%	0.811	81%	0.812	S	S	*	*			trans	-119.4	157.5	153.4	74.1	0	0	0	0	109.5
697	P	31.6	Very low	28.4	Very low	124 Å²	124	163.7 Å²	163.7	81%	0.805	81%	0.812	S	S	*	*			trans	-100.2	128.7	-160.4	35	-31.6	0	0	0	114
698	K	27.6	Very low	28.7	Very low	193 Å²	193	160.8 Å²	160.8	84%	0.839	80%	0.797	S	S	*	*			trans	-138.6	137	153.5	-71.1	-164.1	175.4	-173.7	0	111.7
699	E	24.8	Very low	28.8	Very low	169 Å²	169	160.2 Å²	160.2	79%	0.79	79%	0.79	S	S	*	*			trans	40.7	105.7	155.9	-68.8	160.6	141.1	0	0	119.4	F701	E699-F701 PolarHBondContact O-N 2.94Å
700	R	26.1	Very low	29.2	Very low	249 Å²	249	159 Å²	159	94%	0.94	78%	0.779	S	S	*	*			trans	-75.7	103.2	166.7	-78.7	176.5	165.5	157.3	-4.4	111.3
701	F	24.6	Very low	29.8	Very low	181 Å²	181	161.8 Å²	161.8	79%	0.794	77%	0.773	S	S	*	*			trans	-101.8	127.9	149.1	-87.2	-89.9	0	0	0	109.7	E699	E699-F701 PolarHBondContact O-N 2.94Å
702	R	27.2	Very low	30.3	Very low	209 Å²	209	165.3 Å²	165.3	79%	0.789	77%	0.769	S	S	*	*			trans	-89.3	122.1	173.8	-72.5	-178	177.1	174.8	-0.8	109.1
703	F	27.3	Very low	31.3	Very low	197 Å²	197	162.6 Å²	162.6	86%	0.864	76%	0.759	S	S	*	*			trans	-110.2	141.5	156.6	-82.4	-86.8	0	0	0	109.3
704	Y	30.2	Very low	32.1	Very low	191 Å²	191	158.4 Å²	158.4	75%	0.749	75%	0.75	S	S	*	*			trans	-86.5	154.6	179.7	-83	-104.9	0	0	0	110.9
705	S	27.2	Very low	32.9	Very low	64 Å²	64	155.2 Å²	155.2	45%	0.448	75%	0.75	S	S	.	*			trans	-71.9	138.9	170	-178.4	0	0	0	0	110.4	Q707	S705-Q707 PolarHBondContact O-N 2.91Å; S705-Q707 VanDerWaalsContact O-N 3.12Å
706	P	35.7	Very low	34.2	Very low	106 Å²	106	154.6 Å²	154.6	69%	0.688	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-61.9	-15.9	177	-25.3	35.5	0	0	0	115.4	D708 H709	P706-D708 VanDerWaalsContact C-N 3.33Å; P706-D708 PolarHBondContact O-N 2.62Å; P706-H709 PolarHBondContact O-N 2.72Å
707	Q	38.7	Very low	35.6	Very low	157 Å²	157	152.7 Å²	152.7	73%	0.734	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-80.7	-3.3	-167.1	-71	169.8	-23.6	0	0	115.6	S705	S705-Q707 PolarHBondContact O-N 2.91Å; S705-Q707 VanDerWaalsContact O-N 3.12Å
708	D	37.3	Very low	36.2	Very low	108 Å²	108	151.6 Å²	151.6	58%	0.578	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-92.8	-10.2	170.4	-72.4	-48.2	0	0	0	113.3	P706	P706-D708 VanDerWaalsContact C-N 3.33Å; P706-D708 PolarHBondContact O-N 2.62Å
709	H	36	Very low	37.1	Very low	140 Å²	140	152.9 Å²	152.9	65%	0.648	71%	0.713	S	S	*	*	S	Bend	trans	-70.2	-35.8	-173.1	-115.1	-77.8	0	0	0	113.9	P706 F712	P706-H709 PolarHBondContact O-N 2.72Å; H709-F712 PolarHBondContact O-N 2.69Å
710	E	36.8	Very low	38.1	Very low	157 Å²	157	149.5 Å²	149.5	73%	0.734	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-70.8	-33.7	-178	-62.8	-171.1	124	0	0	112.7	F712 I713	E710-F712 PolarHBondContact O-N 2.87Å; E710-I713 PolarHBondContact O-N 3.11Å
711	K	39.3	Very low	39.1	Very low	158 Å²	158	141.6 Å²	141.6	69%	0.687	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-72.7	-13.4	180	-69.7	173.9	-176.4	162.9	0	113.3
712	F	39.9	Very low	40	Very low	177 Å²	177	139.9 Å²	139.9	78%	0.776	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-91.5	-16	-179.7	-137.2	-89.9	0	0	0	114	H709 E710	H709-F712 PolarHBondContact O-N 2.69Å; E710-F712 PolarHBondContact O-N 2.87Å
713	I	47.2	Very low	40.9	Very low	112 Å²	112	132.6 Å²	132.6	57%	0.574	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	-22.4	-173.3	-66.3	177.2	0	0	0	112.6	E710 N715	E710-I713 PolarHBondContact O-N 3.11Å; I713-N715 PolarHBondContact O-N 2.83Å; I713-N715 VanDerWaalsContact O-N 3.08Å
714	Q	44	Very low	41.5	Very low	159 Å²	159	132.7 Å²	132.7	74%	0.743	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-9.8	-170.8	-67.3	-177.8	-13.4	0	0	116.2
715	N	42.5	Very low	42.3	Very low	157 Å²	157	128.5 Å²	128.5	84%	0.84	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125	28.8	-170.1	-81.9	-36	0	0	0	115.1	I713	I713-N715 PolarHBondContact O-N 2.83Å; I713-N715 VanDerWaalsContact O-N 3.08Å
716	K	50.1	Low	42.9	Very low	123 Å²	123	132.2 Å²	132.2	54%	0.535	65%	0.648	S	S	.	*	S	Bend	trans	-126.4	145.1	174.3	-83.5	-179.9	161.5	-82.6	0	112.8	E720	K716-E720 WeakPolarHBondContact CD-OE2 3.27Å; K716-E720 VanDerWaalsContact CG-OE2 3.28Å; K716-E720 WeakPolarHBondContact CG-OE2 3.13Å; K716-E720 IonicContact NZ-OE1 2.86Å; K716-E720 PolarHBondContact NZ-OE1 3.32Å; K716-E720 IonicContact NZ-OE2 2.67Å; K716-E720 PolarHBondContact NZ-OE2 3.23Å
717	S	53.2	Low	43.1	Very low	75 Å²	75	133.2 Å²	133.2	52%	0.524	65%	0.647	S	S	.	*			trans	-74.9	147.6	-179.2	79.7	0	0	0	0	111.7	R719 E720	S717-R719 PolarHBondContact O-N 3.09Å; S717-E720 PolarHBondContact O-N 3.21Å; S717-E720 VanDerWaalsContact O-N 3.08Å
718	S	43.8	Very low	43.1	Very low	101 Å²	101	129.6 Å²	129.6	71%	0.706	64%	0.644	S	S	*	*	H	α-helix	trans	-55.9	-19.3	-174.5	-40.4	0	0	0	0	114.8
719	R	47.6	Very low	42.9	Very low	221 Å²	221	132.1 Å²	132.1	83%	0.834	65%	0.652	S	S	*	*	H	α-helix	trans	-77.5	-20.1	-178.3	-141.5	175.6	-169.7	178.3	2.8	114	S717	S717-R719 PolarHBondContact O-N 3.09Å
720	E	45.4	Very low	42.9	Very low	98 Å²	98	132.1 Å²	132.1	46%	0.458	66%	0.656	S	S	.	*	H	α-helix	trans	-83.7	-34.2	174.8	-65.9	-175	124.6	0	0	112.2	K716 S717 Q722 A723	K716-E720 WeakPolarHBondContact CD-OE2 3.27Å; K716-E720 VanDerWaalsContact CG-OE2 3.28Å; K716-E720 WeakPolarHBondContact CG-OE2 3.13Å; K716-E720 IonicContact NZ-OE1 2.86Å; K716-E720 PolarHBondContact NZ-OE1 3.32Å; K716-E720 IonicContact NZ-OE2 2.67Å; K716-E720 PolarHBondContact NZ-OE2 3.23Å; S717-E720 PolarHBondContact O-N 3.21Å; S717-E720 VanDerWaalsContact O-N 3.08Å; E720-Q722 VanDerWaalsContact C-N 3.32Å; E720-Q722 PolarHBondContact O-N 3.21Å; E720-A723 PolarHBondContact O-N 3.1Å
721	I	48	Very low	42.6	Very low	82 Å²	82	136.2 Å²	136.2	42%	0.421	67%	0.667	S	S	.	*	H	α-helix	trans	-62.3	-41.1	-178.5	-61.2	174.7	0	0	0	110.8	A723 Y724 I725	I721-A723 VanDerWaalsContact C-N 3.3Å; I721-A723 PolarHBondContact O-N 3.05Å; I721-Y724 PolarHBondContact O-N 3Å; I721-Y724 VanDerWaalsContact O-N 3.16Å; I721-I725 HydrophobicContact CG2-CD1 4.22Å; I721-I725 PolarHBondContact O-N 3.2Å
722	Q	42.7	Very low	42.4	Very low	145 Å²	145	131.8 Å²	131.8	68%	0.678	67%	0.666	S	S	*	*	H	α-helix	trans	-68.2	-27.2	-176.4	-160.3	164.9	16.4	0	0	113.4	E720 Y724	E720-Q722 VanDerWaalsContact C-N 3.32Å; E720-Q722 PolarHBondContact O-N 3.21Å; Q722-Y724 VanDerWaalsContact C-N 3.33Å
723	A	45.1	Very low	41.9	Very low	57 Å²	57	132 Å²	132	47%	0.471	67%	0.67	S	S	.	*	H	α-helix	trans	-74.1	-23	175.2	0	0	0	0	0	113.2	E720 I721 N727	E720-A723 PolarHBondContact O-N 3.1Å; I721-A723 VanDerWaalsContact C-N 3.3Å; I721-A723 PolarHBondContact O-N 3.05Å; A723-N727 PolarHBondContact O-ND2 3.14Å
724	Y	41.3	Very low	40.9	Very low	199 Å²	199	137.9 Å²	137.9	78%	0.78	69%	0.686	S	S	*	*	H	α-helix	trans	-79.3	-43.7	178.6	-159.8	-95	0	0	0	111.6	I721 Q722 Q726 N727	I721-Y724 PolarHBondContact O-N 3Å; I721-Y724 VanDerWaalsContact O-N 3.16Å; Q722-Y724 VanDerWaalsContact C-N 3.33Å; Y724-Q726 VanDerWaalsContact C-N 3.33Å; Y724-Q726 PolarHBondContact O-N 3.02Å; Y724-N727 PolarHBondContact O-N 2.95Å
725	I	46.1	Very low	40.1	Very low	102 Å²	102	134.6 Å²	134.6	52%	0.523	69%	0.686	S	S	.	*	H	α-helix	trans	-60.2	-43.2	179.5	-63.3	170.2	0	0	0	111	I721 N727 A728	I721-I725 HydrophobicContact CG2-CD1 4.22Å; I721-I725 PolarHBondContact O-N 3.2Å; I725-N727 PolarHBondContact O-N 2.8Å; I725-A728 PolarHBondContact O-N 3.09Å
726	Q	40.5	Very low	39.5	Very low	143 Å²	143	135.7 Å²	135.7	67%	0.668	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-10.1	-176.2	-160.5	167.7	32.6	0	0	114.7	Y724	Y724-Q726 VanDerWaalsContact C-N 3.33Å; Y724-Q726 PolarHBondContact O-N 3.02Å
727	N	39.3	Very low	38.6	Very low	127 Å²	127	135.9 Å²	135.9	68%	0.679	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	-7.5	176	-75.9	-80.3	0	0	0	113.7	A723 Y724 I725	A723-N727 PolarHBondContact O-ND2 3.14Å; Y724-N727 PolarHBondContact O-N 2.95Å; I725-N727 PolarHBondContact O-N 2.8Å
728	A	39	Very low	37.3	Very low	81 Å²	81	139.6 Å²	139.6	67%	0.669	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-24.3	-179.8	0	0	0	0	0	113.5	I725 L730	I725-A728 PolarHBondContact O-N 3.09Å; A728-L730 VanDerWaalsContact C-N 3.3Å; A728-L730 PolarHBondContact O-N 2.86Å
729	E	33.5	Very low	36.6	Very low	161 Å²	161	139.5 Å²	139.5	75%	0.752	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	3.7	-171.3	-59.2	-176.1	133.9	0	0	114.2
730	L	35.6	Very low	35.8	Very low	140 Å²	140	135.1 Å²	135.1	73%	0.733	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	8.3	-167.7	-113.5	163.4	0	0	0	115.7	A728	A728-L730 VanDerWaalsContact C-N 3.3Å; A728-L730 PolarHBondContact O-N 2.86Å
731	Y	30.7	Very low	35	Very low	242 Å²	242	140.7 Å²	140.7	95%	0.949	73%	0.728	S	S	*	*	S	Bend	trans	-126.7	59.1	175.5	-103.8	-90	0	0	0	111.6
732	G	34.9	Very low	34.1	Very low	65 Å²	65	140.5 Å²	140.5	67%	0.67	74%	0.738	S	S	*	*			trans	-153.4	25.8	-171	0	0	0	0	0	117
733	Q	30.1	Very low	33.5	Very low	183 Å²	183	141.8 Å²	141.8	86%	0.855	75%	0.749	S	S	*	*			trans	-154.9	161.4	175.6	-106.9	151.8	50.5	0	0	112
734	Y	26.2	Very low	32.8	Very low	235 Å²	235	149.8 Å²	149.8	92%	0.922	77%	0.767	S	S	*	*			trans	78.2	126.4	-162.4	-60.2	-73.6	0	0	0	114.6
735	A	27.6	Very low	32.2	Very low	89 Å²	89	147.5 Å²	147.5	74%	0.736	77%	0.768	S	S	*	*			cis	-149.5	162.8	-3.3	0	0	0	0	0	112.2
736	H	29.1	Very low	31.3	Very low	181 Å²	181	150.5 Å²	150.5	84%	0.838	78%	0.78	S	S	*	*			trans	-128.6	152.1	176.1	-100.2	-68.3	0	0	0	111.2
737	T	30.7	Very low	30.6	Very low	127 Å²	127	149.8 Å²	149.8	78%	0.779	79%	0.785	S	S	*	*			trans	59	119.6	159.8	56.4	0	0	0	0	120.6
738	T	27	Very low	30.1	Very low	153 Å²	153	149.9 Å²	149.9	94%	0.939	79%	0.79	S	S	*	*			trans	-155.4	168.5	130.7	28.9	0	0	0	0	109.3
739	S	28.1	Very low	29.6	Very low	98 Å²	98	152.7 Å²	152.7	69%	0.685	79%	0.794	S	S	*	*			trans	-126.3	176.2	-159.7	54.3	0	0	0	0	115.5
740	D	31.2	Very low	29.3	Very low	129 Å²	129	154.8 Å²	154.8	69%	0.69	80%	0.8	S	S	*	*			trans	89	118.7	151.6	-62.3	-58.4	0	0	0	123
741	Y	27.6	Very low	28.9	Very low	216 Å²	216	156 Å²	156	85%	0.847	80%	0.8	S	S	*	*			trans	74.3	135.3	136.2	-93.8	-99.1	0	0	0	125
742	A	29.5	Very low	28.8	Very low	77 Å²	77	152.7 Å²	152.7	64%	0.636	79%	0.791	S	S	*	*			trans	82.7	101.7	142.5	0	0	0	0	0	122.3
743	L	31.3	Very low	28.4	Very low	172 Å²	172	152.7 Å²	152.7	90%	0.901	79%	0.79	S	S	*	*				49.7	111.3	123.3	-70.4	165	0	0	0	120.7
744	R	28.7	Very low	28.4	Very low	225 Å²	225	150 Å²	150	85%	0.849	78%	0.781	S	S	*	*				-156.1	125.5	126	-161.5	164.7	180	165.9	-1.4	113.4
745	N	28.8	Very low	28.6	Very low	151 Å²	151	148.3 Å²	148.3	81%	0.807	78%	0.775	S	S	*	*			trans	-89.6	143.6	163.6	-86.2	-16.8	0	0	0	110.3
746	Q	28	Very low	28.5	Very low	166 Å²	166	147.4 Å²	147.4	78%	0.776	77%	0.774	S	S	*	*			trans	152.4	153.9	150.9	-88.5	165.4	-4.2	0	0	111.3
747	V	26.8	Very low	28.6	Very low	128 Å²	128	145.4 Å²	145.4	78%	0.776	77%	0.769	S	S	*	*			cis	-175.5	174	-33.5	110.3	0	0	0	0	109.3
748	V	27	Very low	28.6	Very low	128 Å²	128	147.5 Å²	147.5	78%	0.776	77%	0.771	S	S	*	*			trans	81.4	134.2	171.8	-144	0	0	0	0	119.8
749	D	29	Very low	28.8	Very low	141 Å²	141	147.2 Å²	147.2	75%	0.754	76%	0.763	S	S	*	*			trans	-72.6	158	164.3	-50	-100.7	0	0	0	115.9
750	K	27.8	Very low	29	Very low	204 Å²	204	149.2 Å²	149.2	89%	0.887	77%	0.766	S	S	*	*			trans	-177	133.2	133.1	-101.2	162	-177.4	-179.2	0	109.2
751	F	26.8	Very low	29.2	Very low	166 Å²	166	147.1 Å²	147.1	73%	0.728	76%	0.762	S	S	*	*			cis	97.9	127.1	22	-149.9	-58.5	0	0	0	114
752	F	28.2	Very low	29.1	Very low	173 Å²	173	148.8 Å²	148.8	76%	0.759	77%	0.767	S	S	*	*			trans	70	141.6	-173.6	-71.5	-64.8	0	0	0	116.6	L754	F752-L754 HydrophobicContact CD1-CD2 4.32Å; F752-L754 HydrophobicContact CD1-CG 4.34Å; F752-L754 HydrophobicContact CE1-CD2 4.44Å
753	G	26.2	Very low	29	Very low	64 Å²	64	149.8 Å²	149.8	66%	0.66	77%	0.768	S	S	*	*			cis	125.8	176.6	-6.5	0	0	0	0	0	114.5
754	L	30	Very low	29	Very low	127 Å²	127	146.5 Å²	146.5	67%	0.665	76%	0.759	S	S	*	*			trans	73	150.8	176.1	-46.3	-177.7	0	0	0	115	F752	F752-L754 HydrophobicContact CD1-CD2 4.32Å; F752-L754 HydrophobicContact CD1-CG 4.34Å; F752-L754 HydrophobicContact CE1-CD2 4.44Å
755	Y	30.3	Very low	28.9	Very low	200 Å²	200	141.9 Å²	141.9	78%	0.784	76%	0.756	S	S	*	*			cis	-147.3	165.3	-16.9	-104.5	-58.1	0	0	0	104.7
756	G	26.7	Very low	28.9	Very low	70 Å²	70	139.9 Å²	139.9	72%	0.722	75%	0.754	S	S	*	*			cis	160.6	-164.8	12.1	0	0	0	0	0	105.7
757	D	30.3	Very low	29.1	Very low	138 Å²	138	137.2 Å²	137.2	74%	0.738	75%	0.754	S	S	*	*			cis	-160.3	-173.8	-45.1	-149.4	-21	0	0	0	106.6
758	E	31.6	Very low	29.5	Very low	172 Å²	172	136.3 Å²	136.3	80%	0.804	75%	0.753	S	S	*	*			trans	69.9	152.3	170.9	-53.7	174.8	178.2	0	0	116
759	D	31.8	Very low	30.2	Very low	146 Å²	146	135.1 Å²	135.1	78%	0.781	75%	0.751	S	S	*	*			cis	-179.1	161.3	-28.1	-99.7	-5.9	0	0	0	106.4
760	D	32.5	Very low	30.4	Very low	140 Å²	140	134.1 Å²	134.1	75%	0.749	75%	0.754	S	S	*	*			cis	-162.2	165.9	-19	-174.2	22.1	0	0	0	109.5
761	S	34.6	Very low	30.6	Very low	86 Å²	86	131.3 Å²	131.3	60%	0.601	75%	0.749	S	S	*	*			trans	33.6	127.4	149.7	-166.8	0	0	0	0	123.8
762	W	26	Very low	30.9	Very low	251 Å²	251	129.2 Å²	129.2	95%	0.951	76%	0.755	S	S	*	*				-158.5	136.6	113.9	-147.5	-54.8	0	0	0	112.7
763	C	27.4	Very low	31.2	Very low	98 Å²	98	128.9 Å²	128.9	66%	0.662	76%	0.756	S	S	*	*			trans	-105.8	143.1	175.3	-65.7	0	0	0	0	115.4
764	S	30.2	Very low	31.8	Very low	102 Å²	102	135.1 Å²	135.1	71%	0.713	77%	0.768	S	S	*	*			trans	71.1	130	135.4	-65.4	0	0	0	0	124.6
765	T	28	Very low	32.8	Very low	128 Å²	128	135.3 Å²	135.3	79%	0.785	77%	0.766	S	S	*	*			trans	89.9	140.8	130.3	49.3	0	0	0	0	125
766	S	28.7	Very low	33.7	Very low	110 Å²	110	128.9 Å²	128.9	77%	0.769	76%	0.76	S	S	*	*			trans	81.5	145.7	154.9	77.9	0	0	0	0	119.5
767	S	32.1	Very low	35.4	Very low	109 Å²	109	132 Å²	132	76%	0.762	75%	0.751	S	S	*	*			cis	-168.7	169.3	-18.1	-101.8	0	0	0	0	112.9
768	S	34.3	Very low	36.1	Very low	109 Å²	109	132.6 Å²	132.6	76%	0.762	75%	0.747	S	S	*	*			trans	77	152.9	154.7	-67.7	0	0	0	0	121.1
769	S	41.1	Very low	36.9	Very low	104 Å²	104	132.2 Å²	132.2	73%	0.727	75%	0.75	S	S	*	*			cis	-172.5	146.7	-25.4	-92.5	0	0	0	0	110
770	S	33	Very low	38.1	Very low	119 Å²	119	128.2 Å²	128.2	83%	0.832	74%	0.743	S	S	*	*				168.2	129	129	-93.2	0	0	0	0	114
771	D	33.4	Very low	39.2	Very low	145 Å²	145	128.8 Å²	128.8	78%	0.775	74%	0.741	S	S	*	*			trans	-0.1	130.5	157	-87.8	-71.9	0	0	0	121.8
772	S	32.8	Very low	40.1	Very low	123 Å²	123	128.9 Å²	128.9	86%	0.86	74%	0.74	S	S	*	*				-172.7	141.6	92.9	-124.3	0	0	0	0	111
773	E	34.9	Very low	41.4	Very low	165 Å²	165	122.4 Å²	122.4	77%	0.771	72%	0.723	S	S	*	*			trans	-105.5	150	175.9	64.3	-156.9	144.7	0	0	112.7
774	E	38.5	Very low	42.5	Very low	196 Å²	196	123.5 Å²	123.5	92%	0.916	73%	0.728	S	S	*	*			trans	-131.9	120.6	157.7	77.7	176.3	-140.6	0	0	110
775	E	51.4	Low	43.2	Very low	131 Å²	131	126.8 Å²	126.8	61%	0.612	73%	0.732	S	S	*	*			trans	-88.7	123.3	176.8	-69.3	-169.2	130.4	0	0	110.5	Y777	E775-Y777 HydrophobicContact CB-CD2 4.23Å; E775-Y777 HydrophobicContact CB-CE2 3.69Å; E775-Y777 WeakPolarHBondContact O-CD2 3.43Å; E775-Y777 PolarHBondContact O-N 3.18Å; E775-Y777 PolarHBondContact OE2-OH 3.34Å
776	G	48.4	Very low	43.5	Very low	64 Å²	64	126.6 Å²	126.6	66%	0.66	73%	0.733	S	S	*	*			trans	-79.9	93.5	176.7	0	0	0	0	0	112.9
777	Y	63	Low	43.7	Very low	137 Å²	137	132.5 Å²	132.5	54%	0.537	74%	0.739	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.6	136.5	169.4	-69.7	-100.7	0	0	0	110.8	E775	E775-Y777 HydrophobicContact CB-CD2 4.23Å; E775-Y777 HydrophobicContact CB-CE2 3.69Å; E775-Y777 WeakPolarHBondContact O-CD2 3.43Å; E775-Y777 PolarHBondContact O-N 3.18Å; E775-Y777 PolarHBondContact OE2-OH 3.34Å
778	F	44.4	Very low	43.7	Very low	149 Å²	149	133 Å²	133	65%	0.654	74%	0.743	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-113.2	116.6	166.2	-163.5	-98.9	0	0	0	109.1	G780 Q781 I783	F778-G780 PolarHBondContact O-N 3.43Å; F778-G780 VanDerWaalsContact O-N 3.13Å; F778-Q781 PolarHBondContact N-O 3.07Å; F778-Q781 PolarHBondContact O-N 3.45Å; F778-I783 HydrophobicContact CB-CD1 4.31Å; F778-I783 HydrophobicContact CB-CG1 4.33Å
779	L	48.1	Very low	43.4	Very low	165 Å²	165	136 Å²	136	86%	0.864	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	50.7	35.1	-179.1	-55.9	176.9	0	0	0	115
780	G	58	Low	42.8	Very low	62 Å²	62	142.3 Å²	142.3	64%	0.639	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	89.7	7.1	169.6	0	0	0	0	0	116.5	F778	F778-G780 PolarHBondContact O-N 3.43Å; F778-G780 VanDerWaalsContact O-N 3.13Å
781	Q	55.4	Low	42.7	Very low	151 Å²	151	147.4 Å²	147.4	71%	0.706	76%	0.759	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-129.8	153.1	166.8	-70.2	-162.1	-3.2	0	0	112	F778	F778-Q781 PolarHBondContact N-O 3.07Å; F778-Q781 PolarHBondContact O-N 3.45Å
782	P	52.5	Low	42.8	Very low	88 Å²	88	146.3 Å²	146.3	57%	0.571	76%	0.761	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73.4	144.4	177.1	30.2	-35.1	0	0	0	111.5	P784	P782-P784 WeakPolarHBondContact O-CD 3.44Å
783	I	53.5	Low	42.4	Very low	116 Å²	116	149.3 Å²	149.3	60%	0.595	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-75.7	120.3	-177.1	-55.4	178.1	0	0	0	110.2	F778 Q785	F778-I783 HydrophobicContact CB-CD1 4.31Å; F778-I783 HydrophobicContact CB-CG1 4.33Å; I783-Q785 PolarHBondContact O-N 3.08Å
784	P	50	Low	42.1	Very low	120 Å²	120	151.4 Å²	151.4	78%	0.779	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-68.6	123.6	179.9	-20.3	33.6	0	0	0	112.6	P782	P782-P784 WeakPolarHBondContact O-CD 3.44Å
785	Q	44.9	Very low	41.7	Very low	171 Å²	171	145.3 Å²	145.3	80%	0.799	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-89.1	130.6	172.1	-64.7	-171.2	16.8	0	0	111.3	I783	I783-Q785 PolarHBondContact O-N 3.08Å
786	P	34.2	Very low	40.6	Very low	125 Å²	125	145.3 Å²	145.3	81%	0.812	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-81.9	124.5	174.6	31.5	-32.4	0	0	0	111.2
787	R	33.3	Very low	39.8	Very low	233 Å²	233	148.8 Å²	148.8	88%	0.879	74%	0.74	S	S	*	*			trans	-138.3	148.1	164.4	-82.4	-161.3	172.8	-158.1	-2.3	113.9
788	S	33	Very low	38.4	Very low	121 Å²	121	148.6 Å²	148.6	85%	0.846	75%	0.748	S	S	*	*			trans	-42.7	146.7	-176.7	-45.2	0	0	0	0	116.6
789	L	28.8	Very low	37.7	Very low	172 Å²	172	147.2 Å²	147.2	90%	0.901	76%	0.757	S	S	*	*			trans	-120.7	128.9	159.4	-78.8	168.9	0	0	0	110.9
790	R	27.1	Very low	36.8	Very low	236 Å²	236	142.7 Å²	142.7	89%	0.891	75%	0.75	S	S	*	*			trans	-124.3	145.1	156	-137.2	-176.8	-167.6	-168.7	4.5	106.6
791	Y	31.3	Very low	35.4	Very low	225 Å²	225	145.5 Å²	145.5	88%	0.882	76%	0.755	S	S	*	*			trans	-41.3	147.1	-172.9	-74.6	-96.1	0	0	0	116.8
792	P	34.4	Very low	34.2	Very low	123 Å²	123	144.2 Å²	144.2	80%	0.799	76%	0.758	S	S	*	*				-116.5	-178.7	126.7	36.8	-32.8	0	0	0	112.8
793	Y	26	Very low	33.2	Very low	186 Å²	186	146 Å²	146	73%	0.729	77%	0.767	S	S	*	*			trans	-139.8	137.1	-166.5	161.1	-76.3	0	0	0	108.5	T795	Y793-T795 HydrophobicContact CE1-CG2 4.25Å
794	Y	28.8	Very low	32.1	Very low	208 Å²	208	145 Å²	145	82%	0.816	78%	0.776	S	S	*	*			trans	-168.8	-175.5	145.3	-122.7	-87.9	0	0	0	111.1
795	T	28.4	Very low	31.3	Very low	69 Å²	69	147.5 Å²	147.5	42%	0.423	78%	0.782	S	S	.	*			trans	-125.8	174.8	-141.7	53.9	0	0	0	0	117.5	Y793	Y793-T795 HydrophobicContact CE1-CG2 4.25Å
796	D	29.5	Very low	30.5	Very low	130 Å²	130	143.8 Å²	143.8	70%	0.695	78%	0.775	S	S	*	*			trans	94.9	130	148.6	-54.7	-42	0	0	0	122.5
797	D	31	Very low	30.3	Very low	137 Å²	137	143.4 Å²	143.4	73%	0.733	78%	0.775	S	S	*	*			trans	63.5	146.1	142.7	-70.9	-1.3	0	0	0	122.1
798	L	33.7	Very low	30.1	Very low	134 Å²	134	137.6 Å²	137.6	70%	0.702	77%	0.77	S	S	*	*			cis	-164.2	147	-7.4	-121.7	168.2	0	0	0	110.9
799	S	29.8	Very low	30.1	Very low	119 Å²	119	139.5 Å²	139.5	83%	0.832	77%	0.766	S	S	*	*			trans	57	145.6	162.9	65.5	0	0	0	0	118.8
800	G	28.4	Very low	30.3	Very low	70 Å²	70	140.6 Å²	140.6	72%	0.722	76%	0.764	S	S	*	*			cis	173.2	-162.8	4.6	0	0	0	0	0	107.2
801	T	30.1	Very low	30.4	Very low	122 Å²	122	132.8 Å²	132.8	75%	0.748	76%	0.757	S	S	*	*			cis	-166.5	165	-12.1	-27.2	0	0	0	0	108.6
802	T	29.2	Very low	30.4	Very low	123 Å²	123	130.3 Å²	130.3	76%	0.755	75%	0.753	S	S	*	*			trans	64.2	145	160	57.3	0	0	0	0	119.8
803	T	31.5	Very low	30.2	Very low	127 Å²	127	134.8 Å²	134.8	78%	0.779	75%	0.754	S	S	*	*			cis	-166.4	148.9	-11.3	16.3	0	0	0	0	112.5
804	A	31.7	Very low	30.4	Very low	95 Å²	95	131 Å²	131	79%	0.785	75%	0.751	S	S	*	*			trans	61.8	160.2	154.5	0	0	0	0	0	118.4
805	L	31.9	Very low	30.5	Very low	172 Å²	172	126.2 Å²	126.2	90%	0.901	74%	0.743	S	S	*	*			cis	-135.4	-164.4	22.9	-100	167.4	0	0	0	113.2
806	S	28.2	Very low	30.6	Very low	93 Å²	93	132 Å²	132	65%	0.65	76%	0.763	S	S	*	*			trans	-132.5	158	-154.2	59.8	0	0	0	0	118.5
807	S	30.3	Very low	30.7	Very low	116 Å²	116	130.4 Å²	130.4	81%	0.811	76%	0.761	S	S	*	*			trans	72	151.4	159.6	-54.8	0	0	0	0	117.1
808	S	28.9	Very low	30.8	Very low	111 Å²	111	132.1 Å²	132.1	78%	0.776	76%	0.762	S	S	*	*			cis	-154	162.4	-4.2	34.1	0	0	0	0	108.3
809	Q	34	Very low	30.8	Very low	162 Å²	162	134.2 Å²	134.2	76%	0.757	77%	0.766	S	S	*	*			cis	112.7	138.1	14.7	-159.7	-173.6	52.9	0	0	113.3
810	F	31.6	Very low	31.1	Very low	194 Å²	194	135.7 Å²	135.7	85%	0.851	76%	0.757	S	S	*	*			trans	74.5	149.1	-173.3	-64.2	-85.7	0	0	0	116.6
811	G	28.9	Very low	31.2	Very low	72 Å²	72	142.8 Å²	142.8	74%	0.742	76%	0.762	S	S	*	*			cis	-164	173.1	2.2	0	0	0	0	0	114.9
812	Q	32.3	Very low	31.2	Very low	173 Å²	173	140.3 Å²	140.3	81%	0.808	76%	0.76	S	S	*	*			trans	-82.7	159.1	-174.9	-60.9	173.4	-13.3	0	0	114
813	R	30.6	Very low	31.5	Very low	217 Å²	217	144 Å²	144	82%	0.819	77%	0.769	S	S	*	*				141.9	128.8	120.7	-82.3	-168.2	176.8	-173.1	-2	118.2
814	T	29.9	Very low	31.8	Very low	108 Å²	108	147.7 Å²	147.7	66%	0.663	77%	0.774	S	S	*	*				89.9	130.9	124.8	173.2	0	0	0	0	123.5
815	T	30.7	Very low	31.9	Very low	106 Å²	106	146.4 Å²	146.4	65%	0.65	77%	0.77	S	S	*	*			trans	76.3	119.1	144.8	46.5	0	0	0	0	124.6
816	K	30.2	Very low	32.4	Very low	192 Å²	192	148.1 Å²	148.1	84%	0.835	77%	0.77	S	S	*	*				37.6	129	118	-48.7	175.6	-175.6	173	0	116.7
817	S	32	Very low	32.9	Very low	96 Å²	96	151.1 Å²	151.1	67%	0.671	78%	0.779	S	S	*	*			cis	176.2	162.9	47.3	72	0	0	0	0	115.6
818	K	33.4	Very low	33.1	Very low	172 Å²	172	151.1 Å²	151.1	75%	0.748	78%	0.778	S	S	*	*			trans	51.6	122.9	140.3	-71	172.1	-174.7	173.3	0	122.4
819	K	34	Very low	33.3	Very low	179 Å²	179	152.4 Å²	152.4	78%	0.778	77%	0.774	S	S	*	*			trans	67.6	158.4	132.6	-65.2	-178.4	177.5	179.8	0	117.2
820	K	34.4	Very low	33.1	Very low	150 Å²	150	151.8 Å²	151.8	65%	0.652	78%	0.775	S	S	*	*			cis	-159.3	167.8	-17.4	-120.2	-173.7	175.6	-173.2	0	107.3
821	R	31	Very low	33.4	Very low	219 Å²	219	151.7 Å²	151.7	83%	0.826	80%	0.798	S	S	*	*			trans	18.4	117.3	151.4	-59.6	177	176.2	179.1	-6.7	116.4
822	G	30.1	Very low	33.6	Very low	69 Å²	69	155.7 Å²	155.7	71%	0.711	80%	0.801	S	S	*	*			cis	86.5	125.6	30.9	0	0	0	0	0	111.2
823	H	36.3	Very low	33.7	Very low	202 Å²	202	154.7 Å²	154.7	94%	0.935	80%	0.8	S	S	*	*			trans	-149.9	156.4	176.1	-124.1	-88.1	0	0	0	112.5
824	K	38.4	Very low	33.8	Very low	203 Å²	203	151.3 Å²	151.3	88%	0.883	80%	0.799	S	S	*	*			trans	-89.1	135.1	-174.8	-66.4	-176.6	175.4	-173.7	0	113.6
825	G	33.8	Very low	34.1	Very low	68 Å²	68	153.8 Å²	153.8	70%	0.701	81%	0.807	S	S	*	*				83	146.1	127.1	0	0	0	0	0	119.9
826	K	41.6	Very low	34.3	Very low	209 Å²	209	156.8 Å²	156.8	91%	0.909	82%	0.817	S	S	*	*				-167.8	152.9	121.6	-99.7	160.2	-174.2	-178.2	0	110.5
827	N	39.3	Very low	34.6	Very low	155 Å²	155	154.5 Å²	154.5	83%	0.829	82%	0.816	S	S	*	*			trans	-89.2	146.4	174.4	-53	-4.5	0	0	0	109.7
828	C	33.7	Very low	34.7	Very low	116 Å²	116	158.6 Å²	158.6	78%	0.784	83%	0.826	S	S	*	*			trans	-161.1	125.2	143.5	-93.7	0	0	0	0	105.9
829	I	32.9	Very low	34.8	Very low	138 Å²	138	157.6 Å²	157.6	71%	0.708	83%	0.833	S	S	*	*				90.8	109.5	54.3	-73.6	173.5	0	0	0	111.9
830	I	30.5	Very low	34.9	Very low	149 Å²	149	155.8 Å²	155.8	76%	0.764	84%	0.837	S	S	*	*			trans	60.2	110.1	155.5	-59.4	166.7	0	0	0	117
831	S	37	Very low	35	Very low	192 Å²	192	156.4 Å²	156.4	100%	1.343	85%	0.854	S	S	*	*				-146.9	0	100	-67.8	0	0	0	0	109.2

Retrieved 831 of 831 residues in 888 ms (Link to these results)

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