A0A087XNY5_POEFO Loading...

Discoidin domain-containing receptor 2

AlphaFold DB , UniProt , Accession A0A087XNY5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 864 aa.

						>A0A087XNY5_POEFO|A0A087XNY5
MMRHLSDSLFLPLIVIQLLGTVTSQVNPGVCRYALGMSSGQISDEDISASSQWSESTAARYGRLDGEEGDGAWCPEITGEPDHLKEFLQIDLRSLHFITLVGTQGRHAGGMGNEFAQMYKIKYSRDGSRWISWRNRQGKQVIEGNRNTYDIALRDMQPPIIARLVRFMPVIDHSMNVCMRVELYGCEWLDGLVSYNAPAGQQMNLPAYPVYLNDSVYDGAIIYSMTEGLGQLTDGVCGEDDFTLSHVHNGWPGYDYVGWNNDSFPGGSVEIMFEFDRIRNFTSMKVHCNNMFSRHVKAFQQVVCHFRSDSDWETTPLAFSPVEDEKNPSARFITVKLANHMASAIKCQFYFADAWMLFSEITFQSDTAMYNTTPPSTPKPGTSPPPSPEDDPTHKVDDSNTRILIGCLVAIIFILVAIIVIILWRQVWQKMLEKASRRILDDELTASLSIQSETFSYNHTSNRPGTAGEQESNSTYERIFPLGPDYQEPSRLICKLPEFPQNSEEPASAAAAASKSTTQTVVQDGAPHYAEADIVNLQGVTGGNTYAIPAVTMDLLSGKDVVVEEFPRKLLTFKEKLGEGQFGEVHLCEAEGMQEFINEDYLLDVPEGQPVLVAVKMLRSDANKNARNDFLKEIKIMSRLKDPNIIRLLAVCIYSDPLCMITEYMENGDLNQFLSRHEPEGQLALLSNASTVSFGDLCYMATQIASGMKYLSSLNFVHRDLATRNCLVGKNYTIKIADFGMSRNLYSGDYYRIQGRAVLPIRWMSWESILLGKFTTASDVWAYAVTLWEILNFCKEQPYSQLTDEQVIENTGEFFRDQKRQIYLPQPVLCPDSLYKIMLNCWRRNAKERPSFQELHRALLDLQP
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.9	Very low	30.4	Very low	218 Å²	218	162.6 Å²	162.6	100%	1.074	82%	0.82	S	S	*	*				0	112.7	0	177.6	178.8	-172	0	0	106.1
2	M	29.2	Very low	30.5	Very low	168 Å²	168	158 Å²	158	83%	0.828	81%	0.809	S	S	*	*			trans	60.7	171.2	-171	-52	-177.8	-159.4	0	0	114
3	R	31.8	Very low	30.3	Very low	220 Å²	220	157.9 Å²	157.9	83%	0.83	81%	0.81	S	S	*	*				-175	138.3	-61.7	-121	-173.5	177.4	-174.1	-0.3	106.3
4	H	33	Very low	30.1	Very low	161 Å²	161	156.4 Å²	156.4	75%	0.745	80%	0.802	S	S	*	*			trans	48.3	121.6	167.4	-65.9	-83.4	0	0	0	120.3
5	L	30.7	Very low	29.9	Very low	176 Å²	176	152.9 Å²	152.9	92%	0.921	79%	0.791	S	S	*	*				-160.2	124.1	119	-106.6	160.6	0	0	0	108.8
6	S	29.4	Very low	29.9	Very low	87 Å²	87	151.7 Å²	151.7	61%	0.608	78%	0.784	S	S	*	*			trans	-144.7	179.9	170.7	66	0	0	0	0	108.6
7	D	29.4	Very low	29.7	Very low	140 Å²	140	151.9 Å²	151.9	75%	0.749	78%	0.781	S	S	*	*			trans	84.5	93.3	171.9	-47.7	-0.8	0	0	0	112
8	S	31	Very low	29.8	Very low	103 Å²	103	152.6 Å²	152.6	72%	0.72	79%	0.785	S	S	*	*				85.9	104.4	60.9	-67.5	0	0	0	0	112.5	F10	S8-F10 PolarHBondContact O-N 3.05Å
9	L	31	Very low	29.7	Very low	168 Å²	168	152 Å²	152	88%	0.88	78%	0.783	S	S	*	*			trans	-71.3	124.5	167.9	-77.8	79.2	0	0	0	109.9
10	F	29.6	Very low	29.6	Very low	191 Å²	191	147.5 Å²	147.5	84%	0.838	78%	0.775	S	S	*	*			trans	-135	122.1	159.2	-96.4	-88.9	0	0	0	109	S8 P12	S8-F10 PolarHBondContact O-N 3.05Å; F10-P12 WeakPolarHBondContact O-CD 3.41Å
11	L	27.8	Very low	29.6	Very low	157 Å²	157	145.6 Å²	145.6	82%	0.822	77%	0.77	S	S	*	*			trans	-79.4	124.8	166.2	-92.6	71.7	0	0	0	108.8	L13	L11-L13 PolarHBondContact O-N 3.22Å
12	P	30.8	Very low	29.7	Very low	107 Å²	107	139.3 Å²	139.3	70%	0.695	74%	0.744	S	S	*	*			trans	-77.6	109.2	162.1	30.7	-30	0	0	0	109.1	F10 I14	F10-P12 WeakPolarHBondContact O-CD 3.41Å; P12-I14 VanDerWaalsContact C-N 3.33Å; P12-I14 HydrophobicContact CB-CG1 4.35Å; P12-I14 PolarHBondContact O-N 3.06Å
13	L	28.1	Very low	30.3	Very low	157 Å²	157	136.2 Å²	136.2	82%	0.822	73%	0.734	S	S	*	*			trans	-74.2	86.4	170.7	-170.9	80.3	0	0	0	109.1	L11 V15	L11-L13 PolarHBondContact O-N 3.22Å; L13-V15 VanDerWaalsContact C-N 3.31Å; L13-V15 HydrophobicContact CD2-CG2 4Å; L13-V15 HydrophobicContact CG-CG2 4.19Å; L13-V15 PolarHBondContact O-N 3.13Å
14	I	27.8	Very low	31.2	Very low	137 Å²	137	126.4 Å²	126.4	70%	0.703	70%	0.7	S	S	*	*			trans	-73.8	86.9	178.8	-54.8	-178.1	0	0	0	109.5	P12 I16	P12-I14 VanDerWaalsContact C-N 3.33Å; P12-I14 HydrophobicContact CB-CG1 4.35Å; P12-I14 PolarHBondContact O-N 3.06Å; I14-I16 HydrophobicContact CG2-CG1 3.98Å; I14-I16 PolarHBondContact O-N 2.81Å; I14-I16 VanDerWaalsContact O-N 3.08Å
15	V	27.7	Very low	32.6	Very low	104 Å²	104	122.6 Å²	122.6	63%	0.63	68%	0.682	S	S	*	*			trans	-71.8	95.8	166.1	179.6	0	0	0	0	108	L13 Q17	L13-V15 VanDerWaalsContact C-N 3.31Å; L13-V15 HydrophobicContact CD2-CG2 4Å; L13-V15 HydrophobicContact CG-CG2 4.19Å; L13-V15 PolarHBondContact O-N 3.13Å; V15-Q17 HydrophobicContact CG1-CG 4.5Å; V15-Q17 PolarHBondContact O-N 2.86Å
16	I	29.3	Very low	34.2	Very low	133 Å²	133	115.3 Å²	115.3	68%	0.682	65%	0.645	S	S	*	*			trans	-69.5	99.4	168.8	-57.9	179.9	0	0	0	107.5	I14 L18	I14-I16 HydrophobicContact CG2-CG1 3.98Å; I14-I16 PolarHBondContact O-N 2.81Å; I14-I16 VanDerWaalsContact O-N 3.08Å; I16-L18 HydrophobicContact CG2-CG 4.46Å; I16-L18 PolarHBondContact O-N 2.81Å
17	Q	26.6	Very low	36.3	Very low	155 Å²	155	115.5 Å²	115.5	72%	0.724	64%	0.639	S	S	*	*			trans	-67.3	103.4	165.6	-77.7	-167	-18.5	0	0	108.8	V15 L19	V15-Q17 HydrophobicContact CG1-CG 4.5Å; V15-Q17 PolarHBondContact O-N 2.86Å; Q17-L19 PolarHBondContact O-N 3.26Å
18	L	30.5	Very low	38.2	Very low	165 Å²	165	110.2 Å²	110.2	86%	0.864	61%	0.612	S	S	*	*			trans	-71.6	65.3	167.6	-84.6	163.5	0	0	0	110.5	I16 G20	I16-L18 HydrophobicContact CG2-CG 4.46Å; I16-L18 PolarHBondContact O-N 2.81Å; L18-G20 PolarHBondContact O-N 2.81Å
19	L	28.6	Very low	39.7	Very low	141 Å²	141	107.2 Å²	107.2	74%	0.738	60%	0.597	S	S	*	*			trans	-69.1	90	157.9	-80.9	168.6	0	0	0	107.5	Q17 T21	Q17-L19 PolarHBondContact O-N 3.26Å; L19-T21 PolarHBondContact O-N 3.29Å
20	G	28.1	Very low	41.7	Very low	61 Å²	61	103.1 Å²	103.1	63%	0.629	58%	0.58	S	S	*	*			trans	-61	106.8	166.4	0	0	0	0	0	108.5	L18 V22	L18-G20 PolarHBondContact O-N 2.81Å; G20-V22 VanDerWaalsContact C-N 3.34Å; G20-V22 PolarHBondContact O-N 3.05Å
21	T	29	Very low	44.1	Very low	109 Å²	109	94.2 Å²	94.2	67%	0.669	54%	0.541	S	S	*	.			trans	-68.9	92.4	177.3	45.1	0	0	0	0	109.5	L19 T23	L19-T21 PolarHBondContact O-N 3.29Å; T21-T23 PolarHBondContact O-N 2.68Å
22	V	34.5	Very low	46.8	Very low	86 Å²	86	89 Å²	89	52%	0.521	51%	0.51	S	S	.	.			trans	-56.7	108.2	169.4	179.2	0	0	0	0	108	G20 S24 Q364	G20-V22 VanDerWaalsContact C-N 3.34Å; G20-V22 PolarHBondContact O-N 3.05Å; V22-S24 PolarHBondContact O-N 2.98Å; V22-Q364 VanDerWaalsContact O-CD 3.28Å; V22-Q364 PolarHBondContact O-OE1 2.69Å
23	T	41.5	Very low	49.5	Very low	102 Å²	102	90.3 Å²	90.3	63%	0.626	50%	0.502	S	S	*	.			trans	-76.1	92.6	177	48.4	0	0	0	0	109.1	T21 Q25	T21-T23 PolarHBondContact O-N 2.68Å; T23-Q25 PolarHBondContact O-N 2.82Å
24	S	51.5	Low	52.4	Low	15 Å²	15	85 Å²	85	11%	0.105	48%	0.481	C	S	.	.			trans	-59.6	0.1	171.8	-101.1	0	0	0	0	115	V22 V26 F363	V22-S24 PolarHBondContact O-N 2.98Å; S24-V26 PolarHBondContact O-N 3.08Å; S24-F363 WeakPolarHBondContact CB-O 3.26Å; S24-F363 PolarHBondContact OG-O 3.43Å
25	Q	61.1	Low	55.4	Low	80 Å²	80	79.6 Å²	79.6	37%	0.374	45%	0.453	S	S	.	.			trans	-80	110	176.8	-173.1	-178.4	3	0	0	109.8	T23 C237	T23-Q25 PolarHBondContact O-N 2.82Å; Q25-C237 PolarHBondContact NE2-SG 3.24Å
26	V	65.6	Low	58.4	Low	23 Å²	23	74.6 Å²	74.6	14%	0.139	42%	0.423	C	S	.	.			trans	-76.1	131.2	173.3	-177.3	0	0	0	0	109.5	S24 C31 F97 W188	S24-V26 PolarHBondContact O-N 3.08Å; V26-C31 HydrophobicContact CG1-CB 3.64Å; V26-C31 VanDerWaalsContact CG1-SG 3.56Å; V26-F97 HydrophobicContact CG1-CB 4.3Å; V26-F97 HydrophobicContact CG1-CD1 3.58Å; V26-F97 HydrophobicContact CG1-CD2 4.24Å; V26-F97 HydrophobicContact CG1-CE1 3.82Å; V26-F97 HydrophobicContact CG1-CE2 4.46Å; V26-F97 HydrophobicContact CG1-CG 3.8Å; V26-F97 HydrophobicContact CG1-CZ 4.26Å; V26-W188 HydrophobicContact CB-CZ3 4.37Å; V26-W188 HydrophobicContact CG2-CE3 3.93Å; V26-W188 HydrophobicContact CG2-CZ3 3.75Å
27	N	72.4	Confident	61.4	Low	91 Å²	91	68.3 Å²	68.3	49%	0.487	39%	0.391	S	S	.	.			trans	-105.3	114.7	173.6	-176.6	-56.4	0	0	0	109.5	G29 V30 C31	N27-G29 PolarHBondContact O-N 3.28Å; N27-G29 VanDerWaalsContact O-N 3.11Å; N27-G29 WeakPolarHBondContact OD1-CA 3.46Å; N27-G29 PolarHBondContact OD1-N 3.14Å; N27-V30 HydrophobicContact CB-CB 4.29Å; N27-V30 HydrophobicContact CB-CG2 4.17Å; N27-V30 PolarHBondContact O-N 3.09Å; N27-C31 WeakPolarHBondContact O-CB 3.38Å; N27-C31 PolarHBondContact O-N 3.29Å
28	P	69.1	Low	64.4	Low	29 Å²	29	63.2 Å²	63.2	19%	0.188	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-20.2	-176.8	-25.6	34.5	0	0	0	115.4	R32 F97 T99 P159 G235	P28-R32 WeakPolarHBondContact O-CD 3.39Å; P28-R32 WeakPolarHBondContact O-CG 3.44Å; P28-F97 HydrophobicContact CB-CE1 4.25Å; P28-F97 HydrophobicContact CG-CE1 4.01Å; P28-F97 HydrophobicContact CG-CZ 4.05Å; P28-T99 HydrophobicContact CB-CG2 4.23Å; P28-P159 HydrophobicContact CB-CG 4.39Å; P28-P159 HydrophobicContact CG-CG 4.45Å; P28-G235 WeakPolarHBondContact CD-O 3.24Å
29	G	62.7	Low	66.9	Low	40 Å²	40	57.8 Å²	57.8	41%	0.412	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-18.4	175	0	0	0	0	0	114.4	N27 R32 Q538	N27-G29 PolarHBondContact O-N 3.28Å; N27-G29 VanDerWaalsContact O-N 3.11Å; N27-G29 WeakPolarHBondContact OD1-CA 3.46Å; N27-G29 PolarHBondContact OD1-N 3.14Å; G29-R32 VanDerWaalsContact O-CD 3.31Å; G29-R32 WeakPolarHBondContact O-CD 3.43Å; G29-Q538 PolarHBondContact O-NE2 3.33Å; G29-Q538 VanDerWaalsContact O-NE2 3.13Å
30	V	72.7	Confident	69.8	Low	83 Å²	83	53.2 Å²	53.2	50%	0.503	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-35	-177.7	-176.6	0	0	0	0	112	N27 R32	N27-V30 HydrophobicContact CB-CB 4.29Å; N27-V30 HydrophobicContact CB-CG2 4.17Å; N27-V30 PolarHBondContact O-N 3.09Å; V30-R32 VanDerWaalsContact C-N 3.25Å; V30-R32 PolarHBondContact O-N 2.81Å
31	C	79.9	Confident	72.7	Confident	4 Å²	4	57.7 Å²	57.7	3%	0.027	34%	0.34	C	S	.	.			trans	-75	70.9	178.4	-179.5	0	0	0	0	110.9	V26 N27 F97 T99 G185 C186	V26-C31 HydrophobicContact CG1-CB 3.64Å; V26-C31 VanDerWaalsContact CG1-SG 3.56Å; N27-C31 WeakPolarHBondContact O-CB 3.38Å; N27-C31 PolarHBondContact O-N 3.29Å; C31-F97 HydrophobicContact CB-CD1 4.42Å; C31-F97 PolarHBondContact SG-O 3.15Å; C31-F97 VanDerWaalsContact SG-O 3.38Å; C31-T99 HydrophobicContact CB-CG2 4.44Å; C31-T99 WeakPolarHBondContact O-CG2 3.06Å; C31-T99 PolarHBondContact O-OG1 3.23Å; C31-G185 CarbonylContact C-O 3.52Å; C31-G185 WeakPolarHBondContact O-CA 3.47Å; C31-G185 VanDerWaalsContact SG-C 3.55Å; C31-C186 HydrophobicContact CB-CB 4.05Å; C31-C186 WeakPolarHBondContact CB-SG 3.45Å; C31-C186 WeakPolarHBondContact SG-CB 3.19Å; C31-C186 PolarHBondContact SG-N 2.55Å; C31-C186 CovalentContact SG-SG 2.04Å; C31-C186 PolarHBondContact SG-SG 3.3Å
32	R	86.3	Confident	75.7	Confident	48 Å²	48	52.9 Å²	52.9	18%	0.181	31%	0.31	C	S	.	.			trans	-141.4	25.6	-168.5	-57.1	-176.7	68.1	94.1	-11.7	113.4	P28 G29 V30 T99 D155 G185	P28-R32 WeakPolarHBondContact O-CD 3.39Å; P28-R32 WeakPolarHBondContact O-CG 3.44Å; G29-R32 VanDerWaalsContact O-CD 3.31Å; G29-R32 WeakPolarHBondContact O-CD 3.43Å; V30-R32 VanDerWaalsContact C-N 3.25Å; V30-R32 PolarHBondContact O-N 2.81Å; R32-T99 WeakPolarHBondContact CG-OG1 3.41Å; R32-D155 IonicContact CZ-OD1 3.66Å; R32-D155 IonicContact NH1-OD1 3.99Å; R32-D155 PolarHBondContact NH1-OD1 3.36Å; R32-D155 IonicContact NH2-OD1 3.33Å; R32-D155 PolarHBondContact NH2-OD1 2.84Å; R32-D155 IonicContact NH2-OD2 3.64Å; R32-G185 PolarHBondContact N-O 2.79Å
33	Y	86.1	Confident	78.6	Confident	133 Å²	133	51 Å²	51	52%	0.522	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	141.8	178.7	-49.2	-72.4	0	0	0	110.4	L35 Y184 G185 C186	Y33-L35 PolarHBondContact O-N 3.46Å; Y33-Y184 CarbonylContact O-C 3.53Å; Y33-Y184 VanDerWaalsContact O-CA 3.23Å; Y33-Y184 WeakPolarHBondContact O-CA 3.48Å; Y33-G185 WeakPolarHBondContact CD2-O 3.49Å; Y33-G185 PolarHBondContact N-O 2.92Å; Y33-G185 PolarHBondContact O-N 2.74Å; Y33-C186 HydrophobicContact CD2-CB 4.15Å; Y33-C186 HydrophobicContact CE2-CB 4.46Å
34	A	90	Very high	81.2	Confident	46 Å²	46	50 Å²	50	38%	0.38	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	133	173.3	0	0	0	0	0	110.1	E182 L183 Y184	A34-E182 HydrophobicContact CB-CG 4.11Å; A34-L183 WeakPolarHBondContact CA-O 3.31Å; A34-Y184 HydrophobicContact CB-CD1 3.95Å; A34-Y184 HydrophobicContact CB-CE1 3.79Å
35	L	90.1	Very high	83.3	Confident	23 Å²	23	57.5 Å²	57.5	12%	0.12	33%	0.325	C	S	.	.			trans	-90.6	-12	-171.4	-61.2	-173.6	0	0	0	113.8	Y33 I42 L92 H96 I98 L183	Y33-L35 PolarHBondContact O-N 3.46Å; L35-I42 WeakPolarHBondContact O-CG1 3.2Å; L35-L92 HydrophobicContact CB-CD2 4.2Å; L35-L92 HydrophobicContact CD1-CD1 3.87Å; L35-L92 HydrophobicContact CD1-CD2 4.33Å; L35-H96 HydrophobicContact CD1-CB 4.11Å; L35-I98 HydrophobicContact CD1-CG1 4.12Å; L35-L183 HydrophobicContact CB-CB 4.29Å; L35-L183 HydrophobicContact CD1-CB 3.94Å; L35-L183 HydrophobicContact CG-CB 4.29Å; L35-L183 WeakPolarHBondContact CG-O 3.34Å; L35-L183 PolarHBondContact N-O 3.27Å
36	G	90.3	Very high	85	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.311	C	S	.	.	S	Bend	trans	131.9	21	159	0	0	0	0	0	117.1	G40 Q41 I42 E182	G36-G40 PolarHBondContact O-N 2.71Å; G36-Q41 PolarHBondContact O-N 2.94Å; G36-I42 PolarHBondContact O-N 3.06Å; G36-E182 PolarHBondContact N-OE1 3.14Å
37	M	93.3	Very high	86.6	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.306	C	S	.	.	S	Bend	trans	-69.2	-53.5	174.8	-66.5	-64.6	-68.1	0	0	111.1	I42 I47 R63 I90 V181 E182 L183	M37-I42 HydrophobicContact CG-CD1 4.04Å; M37-I42 HydrophobicContact SD-CB 4.37Å; M37-I42 HydrophobicContact SD-CD1 3.92Å; M37-I42 HydrophobicContact SD-CG2 4.09Å; M37-I47 HydrophobicContact CE-CD1 3.62Å; M37-I47 HydrophobicContact CE-CG1 4.08Å; M37-I47 HydrophobicContact CE-CG2 4.23Å; M37-I47 HydrophobicContact SD-CD1 3.78Å; M37-I47 HydrophobicContact SD-CG1 4.03Å; M37-R63 HydrophobicContact CE-CG 4.12Å; M37-R63 WeakPolarHBondContact O-CB 3.5Å; M37-R63 VanDerWaalsContact O-CD 3.31Å; M37-R63 WeakPolarHBondContact O-CD 3.35Å; M37-R63 WeakPolarHBondContact O-CG 3.42Å; M37-R63 PolarHBondContact O-NH1 2.95Å; M37-I90 HydrophobicContact CE-CD1 3.57Å; M37-I90 HydrophobicContact CE-CG1 3.96Å; M37-I90 HydrophobicContact CG-CD1 4.09Å; M37-I90 HydrophobicContact SD-CD1 3.45Å; M37-I90 WeakPolarHBondContact SD-CD1 3.44Å; M37-I90 HydrophobicContact SD-CG1 3.68Å; M37-I90 HydrophobicContact SD-CG2 4.08Å; M37-V181 WeakPolarHBondContact CB-O 3.44Å; M37-V181 HydrophobicContact CE-CG2 4.02Å; M37-V181 WeakPolarHBondContact CG-O 3.17Å; M37-E182 WeakPolarHBondContact CA-OE2 3.46Å; M37-E182 HydrophobicContact CB-CB 4.39Å; M37-E182 WeakPolarHBondContact CB-OE1 3.31Å; M37-E182 WeakPolarHBondContact CB-OE2 3.2Å; M37-E182 WeakPolarHBondContact CG-OE1 3.46Å; M37-E182 PolarHBondContact N-OE1 3.07Å; M37-E182 VanDerWaalsContact N-OE1 3.12Å; M37-E182 PolarHBondContact N-OE2 3.07Å; M37-L183 HydrophobicContact CG-CD1 4.28Å
38	S	88.1	Confident	87.7	Confident	49 Å²	49	51.5 Å²	51.5	34%	0.343	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-42.1	-179	70.2	0	0	0	0	112.1	G40 L64 E182	S38-G40 VanDerWaalsContact C-N 3.26Å; S38-G40 PolarHBondContact O-N 2.76Å; S38-L64 WeakPolarHBondContact CB-O 3.41Å; S38-E182 PolarHBondContact N-OE2 3.19Å
39	S	84.9	Confident	89	Confident	50 Å²	50	51.6 Å²	51.6	35%	0.35	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	3.2	-175.4	65.1	0	0	0	0	115	Q41	S39-Q41 PolarHBondContact O-N 3.08Å
40	G	88	Confident	90.5	Very high	45 Å²	45	51.8 Å²	51.8	46%	0.464	30%	0.296	S	S	.	.	S	Bend	trans	70.2	8	176.9	0	0	0	0	0	115.9	G36 S38	G36-G40 PolarHBondContact O-N 2.71Å; S38-G40 VanDerWaalsContact C-N 3.26Å; S38-G40 PolarHBondContact O-N 2.76Å
41	Q	88.8	Confident	91.4	Very high	155 Å²	155	49 Å²	49	72%	0.724	28%	0.28	S	S	*	.			trans	-70.3	-33.1	178.7	-63.3	-179	22.3	0	0	112.3	G36 S39	G36-Q41 PolarHBondContact O-N 2.94Å; S39-Q41 PolarHBondContact O-N 3.08Å
42	I	93.1	Very high	91.9	Very high	9 Å²	9	52 Å²	52	5%	0.046	29%	0.294	C	S	.	.	S	Bend	trans	-78.9	121.8	165.3	-63.8	171.3	0	0	0	106.5	L35 G36 M37 D46 I47 R63 I90 L92	L35-I42 WeakPolarHBondContact O-CG1 3.2Å; G36-I42 PolarHBondContact O-N 3.06Å; M37-I42 HydrophobicContact CG-CD1 4.04Å; M37-I42 HydrophobicContact SD-CB 4.37Å; M37-I42 HydrophobicContact SD-CD1 3.92Å; M37-I42 HydrophobicContact SD-CG2 4.09Å; I42-D46 HydrophobicContact CG2-CB 3.62Å; I42-I47 HydrophobicContact CG2-CD1 4.14Å; I42-I47 HydrophobicContact CG2-CG1 3.78Å; I42-R63 VanDerWaalsContact O-CZ 3.29Å; I42-R63 PolarHBondContact O-NH1 2.83Å; I42-R63 PolarHBondContact O-NH2 2.77Å; I42-I90 HydrophobicContact CD1-CG2 3.88Å; I42-I90 HydrophobicContact CG2-CG2 4.13Å; I42-L92 HydrophobicContact CD1-CD2 3.62Å; I42-L92 HydrophobicContact CG1-CD2 4.36Å
43	S	96	Very high	92.1	Very high	45 Å²	45	56.9 Å²	56.9	32%	0.315	31%	0.312	S	S	.	.			trans	-79.9	163.7	-174.8	76	0	0	0	0	112.3	E45 D46	S43-E45 PolarHBondContact O-N 2.97Å; S43-E45 PolarHBondContact OG-N 2.8Å; S43-D46 WeakPolarHBondContact CA-OD2 3.46Å; S43-D46 VanDerWaalsContact CB-OD2 3.31Å; S43-D46 WeakPolarHBondContact CB-OD2 3.26Å; S43-D46 PolarHBondContact N-OD2 2.84Å; S43-D46 VanDerWaalsContact O-CB 3.31Å; S43-D46 WeakPolarHBondContact O-CB 3.47Å; S43-D46 PolarHBondContact O-N 3.2Å; S43-D46 PolarHBondContact OG-OD2 2.87Å
44	D	94.9	Very high	92.3	Very high	83 Å²	83	52 Å²	52	44%	0.444	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-62.9	-23.8	175.5	-79.4	14.8	0	0	0	112.9	D46 I47 R60 R63	D44-D46 PolarHBondContact O-N 3.41Å; D44-I47 PolarHBondContact O-N 2.9Å; D44-R60 HydrophobicContact CB-CB 4.25Å; D44-R60 VanDerWaalsContact CG-CB 3.49Å; D44-R60 WeakPolarHBondContact OD2-CB 3.4Å; D44-R60 WeakPolarHBondContact OD2-CD 3.17Å; D44-R63 IonicContact OD1-CZ 2.67Å; D44-R63 IonicContact OD1-NE 2.79Å; D44-R63 IonicContact OD1-NH2 3.76Å; D44-R63 PolarHBondContact OD1-NH2 3.42Å
45	E	96.3	Very high	92.4	Very high	171 Å²	171	55.2 Å²	55.2	80%	0.799	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-70.3	-20	173.2	-60.3	-176	-172.7	0	0	112.7	S43	S43-E45 PolarHBondContact O-N 2.97Å; S43-E45 PolarHBondContact OG-N 2.8Å
46	D	97.3	Very high	92.4	Very high	15 Å²	15	55.9 Å²	55.9	8%	0.08	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-90	-14.5	-179.1	-56.7	-44.1	0	0	0	112.8	I42 S43 D44 I90 D91 R93	I42-D46 HydrophobicContact CG2-CB 3.62Å; S43-D46 WeakPolarHBondContact CA-OD2 3.46Å; S43-D46 VanDerWaalsContact CB-OD2 3.31Å; S43-D46 WeakPolarHBondContact CB-OD2 3.26Å; S43-D46 PolarHBondContact N-OD2 2.84Å; S43-D46 VanDerWaalsContact O-CB 3.31Å; S43-D46 WeakPolarHBondContact O-CB 3.47Å; S43-D46 PolarHBondContact O-N 3.2Å; S43-D46 PolarHBondContact OG-OD2 2.87Å; D44-D46 PolarHBondContact O-N 3.41Å; D46-I90 WeakPolarHBondContact O-CA 3.36Å; D46-D91 WeakPolarHBondContact CB-O 3.48Å; D46-D91 PolarHBondContact O-N 2.7Å; D46-R93 IonicContact OD1-CZ 2.76Å; D46-R93 IonicContact OD1-NE 2.6Å; D46-R93 PolarHBondContact OD1-NE 3.25Å; D46-R93 IonicContact OD1-NH2 3.45Å; D46-R93 PolarHBondContact OD1-NH2 2.93Å
47	I	97.8	Very high	92.5	Very high	9 Å²	9	56.1 Å²	56.1	5%	0.046	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	110.3	-175.1	-51.9	168.5	0	0	0	108.9	M37 I42 D44 A59 R63 L88 Q89 I90	M37-I47 HydrophobicContact CE-CD1 3.62Å; M37-I47 HydrophobicContact CE-CG1 4.08Å; M37-I47 HydrophobicContact CE-CG2 4.23Å; M37-I47 HydrophobicContact SD-CD1 3.78Å; M37-I47 HydrophobicContact SD-CG1 4.03Å; I42-I47 HydrophobicContact CG2-CD1 4.14Å; I42-I47 HydrophobicContact CG2-CG1 3.78Å; D44-I47 PolarHBondContact O-N 2.9Å; I47-A59 HydrophobicContact CG2-CB 4.14Å; I47-A59 VanDerWaalsContact CG2-O 3.24Å; I47-A59 WeakPolarHBondContact CG2-O 3.35Å; I47-R63 HydrophobicContact CD1-CG 4.16Å; I47-R63 VanDerWaalsContact CD1-CZ 3.4Å; I47-L88 HydrophobicContact CG2-CD1 3.79Å; I47-Q89 WeakPolarHBondContact CA-O 3.18Å; I47-I90 HydrophobicContact CG2-CG1 4.48Å
48	S	96.9	Very high	92.6	Very high	44 Å²	44	56.1 Å²	56.1	31%	0.308	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	160.6	-175.7	46.2	0	0	0	0	110.5	Q89	S48-Q89 PolarHBondContact N-O 3.02Å; S48-Q89 WeakPolarHBondContact O-CA 2.96Å; S48-Q89 PolarHBondContact O-N 3.08Å; S48-Q89 VanDerWaalsContact O-O 3.09Å; S48-Q89 PolarHBondContact OG-NE2 3.35Å
49	A	95.9	Very high	92.9	Very high	32 Å²	32	54.2 Å²	54.2	26%	0.264	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	164.7	177.6	0	0	0	0	0	111.7	S51 A59 W73 F87 L88	A49-S51 VanDerWaalsContact C-N 3.32Å; A49-S51 WeakPolarHBondContact CB-O 3.45Å; A49-A59 HydrophobicContact CB-CB 3.8Å; A49-W73 HydrophobicContact CB-CZ2 4.08Å; A49-W73 VanDerWaalsContact CB-NE1 3.29Å; A49-F87 VanDerWaalsContact CA-O 3.26Å; A49-F87 WeakPolarHBondContact CA-O 3.49Å; A49-F87 WeakPolarHBondContact CB-O 3.46Å; A49-L88 HydrophobicContact CB-CD1 4.49Å
50	S	93.5	Very high	93.3	Very high	43 Å²	43	55 Å²	55	30%	0.301	30%	0.296	S	S	.	.	S	Bend	trans	-62.1	-39.9	167.5	48	0	0	0	0	112.5	E86 F87	S50-E86 WeakPolarHBondContact CB-OE2 3.35Å; S50-E86 VanDerWaalsContact OG-CA 3.29Å; S50-E86 WeakPolarHBondContact OG-CA 3.46Å; S50-E86 PolarHBondContact OG-OE2 3.09Å; S50-F87 PolarHBondContact N-O 2.99Å; S50-F87 PolarHBondContact OG-N 2.96Å; S50-F87 PolarHBondContact OG-O 3.5Å
51	S	91.4	Very high	93.7	Very high	24 Å²	24	54.8 Å²	54.8	17%	0.168	28%	0.281	C	S	.	.			trans	-159.4	173	-177	69.4	0	0	0	0	110.5	A49 W73 P75 E76 E86	A49-S51 VanDerWaalsContact C-N 3.32Å; A49-S51 WeakPolarHBondContact CB-O 3.45Å; S51-W73 PolarHBondContact O-NE1 3.39Å; S51-P75 WeakPolarHBondContact OG-CA 3.44Å; S51-E76 PolarHBondContact OG-N 3.42Å; S51-E86 WeakPolarHBondContact CB-OE2 3.35Å; S51-E86 PolarHBondContact OG-OE2 3.37Å
52	Q	91.8	Very high	94	Very high	68 Å²	68	47.4 Å²	47.4	32%	0.318	25%	0.247	S	C	.	.			trans	-145.9	135.3	170.7	63.3	-173.1	39.3	0	0	109.7	S54 E55 A58 C74	Q52-S54 VanDerWaalsContact C-N 3.35Å; Q52-S54 PolarHBondContact O-N 2.86Å; Q52-E55 PolarHBondContact NE2-OE2 2.93Å; Q52-A58 VanDerWaalsContact OE1-CA 3.28Å; Q52-C74 CarbonylContact C-O 3.46Å; Q52-C74 WeakPolarHBondContact CA-O 3.42Å
53	W	88.8	Confident	94.1	Very high	150 Å²	150	48.7 Å²	48.7	57%	0.568	25%	0.251	S	S	*	.	S	Bend	trans	-64.1	-38.5	179.8	178.4	-85.9	0	0	0	112.6	T57 C74 I77	W53-T57 PolarHBondContact N-OG1 3.06Å; W53-C74 HydrophobicContact CB-CB 4.22Å; W53-C74 PolarHBondContact N-O 3.14Å; W53-I77 HydrophobicContact CZ3-CB 4.46Å
54	S	90.9	Very high	93.8	Very high	32 Å²	32	46.7 Å²	46.7	22%	0.224	24%	0.237	C	C	.	.	S	Bend	trans	-146.9	169.8	172.8	64.6	0	0	0	0	110.9	Q52 S56 T57 A58	Q52-S54 VanDerWaalsContact C-N 3.35Å; Q52-S54 PolarHBondContact O-N 2.86Å; S54-S56 PolarHBondContact O-N 3.47Å; S54-S56 PolarHBondContact OG-N 2.9Å; S54-S56 PolarHBondContact OG-OG 2.93Å; S54-T57 PolarHBondContact N-OG1 3.02Å; S54-T57 VanDerWaalsContact N-OG1 3.08Å; S54-T57 CarbonylContact O-C 3.59Å; S54-T57 PolarHBondContact O-N 3.22Å; S54-T57 VanDerWaalsContact O-N 3.08Å; S54-T57 PolarHBondContact O-OG1 3.06Å; S54-T57 PolarHBondContact OG-N 2.92Å; S54-T57 VanDerWaalsContact OG-N 3.15Å; S54-T57 PolarHBondContact OG-OG1 2.71Å; S54-A58 PolarHBondContact O-N 3.48Å
55	E	91.4	Very high	93.4	Very high	112 Å²	112	46.6 Å²	46.6	52%	0.523	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-65.2	-20.3	171	-171.6	53.6	-142.8	0	0	112.6	Q52 R60 Y61	Q52-E55 PolarHBondContact NE2-OE2 2.93Å; E55-R60 PolarHBondContact O-NH2 2.8Å; E55-R60 VanDerWaalsContact O-NH2 3.12Å; E55-R60 IonicContact OE1-CZ 2.66Å; E55-R60 IonicContact OE1-NH1 3.49Å; E55-R60 PolarHBondContact OE1-NH1 2.69Å; E55-R60 IonicContact OE1-NH2 3.59Å; E55-R60 PolarHBondContact OE1-NH2 2.92Å; E55-Y61 WeakPolarHBondContact O-CE2 3.24Å
56	S	91.2	Very high	92.7	Very high	37 Å²	37	39.7 Å²	39.7	26%	0.259	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-84.9	-10.7	172.7	48.3	0	0	0	0	113.9	S54 Y61 D70	S54-S56 PolarHBondContact O-N 3.47Å; S54-S56 PolarHBondContact OG-N 2.9Å; S54-S56 PolarHBondContact OG-OG 2.93Å; S56-Y61 WeakPolarHBondContact O-CD2 3.28Å; S56-D70 WeakPolarHBondContact CB-OD2 3.22Å; S56-D70 PolarHBondContact O-N 2.9Å; S56-D70 PolarHBondContact OG-OD2 2.53Å
57	T	92.1	Very high	92.1	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.031	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-116.1	27.5	170.6	72.3	0	0	0	0	112.3	W53 S54 D70 A72 W73 C74	W53-T57 PolarHBondContact N-OG1 3.06Å; S54-T57 PolarHBondContact N-OG1 3.02Å; S54-T57 VanDerWaalsContact N-OG1 3.08Å; S54-T57 CarbonylContact O-C 3.59Å; S54-T57 PolarHBondContact O-N 3.22Å; S54-T57 VanDerWaalsContact O-N 3.08Å; S54-T57 PolarHBondContact O-OG1 3.06Å; S54-T57 PolarHBondContact OG-N 2.92Å; S54-T57 VanDerWaalsContact OG-N 3.15Å; S54-T57 PolarHBondContact OG-OG1 2.71Å; T57-D70 HydrophobicContact CG2-CB 3.99Å; T57-A72 WeakPolarHBondContact CA-O 3.25Å; T57-W73 WeakPolarHBondContact O-CA 3.37Å; T57-C74 HydrophobicContact CG2-CB 4.07Å; T57-C74 PolarHBondContact O-N 2.89Å; T57-C74 PolarHBondContact OG1-O 3.08Å
58	A	94.8	Very high	91.4	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.008	26%	0.255	C	S	.	.			trans	-59.8	160.1	176.2	0	0	0	0	0	113.1	Q52 S54 R60 Y61	Q52-A58 VanDerWaalsContact OE1-CA 3.28Å; S54-A58 PolarHBondContact O-N 3.48Å; A58-R60 HydrophobicContact CB-CG 4.26Å; A58-R60 PolarHBondContact O-N 2.88Å; A58-R60 VanDerWaalsContact O-N 3.11Å; A58-Y61 HydrophobicContact CB-CD2 4.1Å; A58-Y61 HydrophobicContact CB-CE2 4.12Å; A58-Y61 PolarHBondContact O-N 2.87Å
59	A	95.5	Very high	90.9	Very high	8 Å²	8	49.4 Å²	49.4	7%	0.066	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-52.4	-38.2	-173.8	0	0	0	0	0	114.1	I47 A49 Y61 G62 L88	I47-A59 HydrophobicContact CG2-CB 4.14Å; I47-A59 VanDerWaalsContact CG2-O 3.24Å; I47-A59 WeakPolarHBondContact CG2-O 3.35Å; A49-A59 HydrophobicContact CB-CB 3.8Å; A59-Y61 PolarHBondContact O-N 2.8Å; A59-G62 PolarHBondContact O-N 2.87Å; A59-L88 HydrophobicContact CB-CD1 3.89Å
60	R	93.9	Very high	90.5	Very high	68 Å²	68	51.4 Å²	51.4	26%	0.257	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-56.5	-26	176.4	61.3	-177.5	-178.7	-94.2	-6.9	115	D44 E55 A58 G62 R63	D44-R60 HydrophobicContact CB-CB 4.25Å; D44-R60 VanDerWaalsContact CG-CB 3.49Å; D44-R60 WeakPolarHBondContact OD2-CB 3.4Å; D44-R60 WeakPolarHBondContact OD2-CD 3.17Å; E55-R60 PolarHBondContact O-NH2 2.8Å; E55-R60 VanDerWaalsContact O-NH2 3.12Å; E55-R60 IonicContact OE1-CZ 2.66Å; E55-R60 IonicContact OE1-NH1 3.49Å; E55-R60 PolarHBondContact OE1-NH1 2.69Å; E55-R60 IonicContact OE1-NH2 3.59Å; E55-R60 PolarHBondContact OE1-NH2 2.92Å; A58-R60 HydrophobicContact CB-CG 4.26Å; A58-R60 PolarHBondContact O-N 2.88Å; A58-R60 VanDerWaalsContact O-N 3.11Å; R60-G62 VanDerWaalsContact C-N 3.25Å; R60-G62 PolarHBondContact O-N 3.46Å; R60-R63 WeakPolarHBondContact O-CD 3.34Å; R60-R63 WeakPolarHBondContact O-CG 3.43Å; R60-R63 PolarHBondContact O-NE 2.95Å
61	Y	95.4	Very high	90.2	Very high	39 Å²	39	49.3 Å²	49.3	15%	0.153	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-84.1	1.7	175.4	-53.2	-56.5	0	0	0	112.9	E55 S56 A58 A59 R63 E68 A72 W73	E55-Y61 WeakPolarHBondContact O-CE2 3.24Å; S56-Y61 WeakPolarHBondContact O-CD2 3.28Å; A58-Y61 HydrophobicContact CB-CD2 4.1Å; A58-Y61 HydrophobicContact CB-CE2 4.12Å; A58-Y61 PolarHBondContact O-N 2.87Å; A59-Y61 PolarHBondContact O-N 2.8Å; Y61-R63 PolarHBondContact O-N 2.87Å; Y61-E68 HydrophobicContact CD1-CB 3.63Å; Y61-E68 WeakPolarHBondContact CD1-O 3.3Å; Y61-E68 HydrophobicContact CE1-CB 3.66Å; Y61-A72 CarbonylContact O-C 3.47Å; Y61-A72 VanDerWaalsContact O-CA 3.27Å; Y61-A72 WeakPolarHBondContact O-CA 3.38Å; Y61-W73 PolarHBondContact O-N 3Å
62	G	94.6	Very high	90.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.247	C	C	.	.			trans	-76.6	16.7	172.4	0	0	0	0	0	115	A59 R60 R180 V181	A59-G62 PolarHBondContact O-N 2.87Å; R60-G62 VanDerWaalsContact C-N 3.25Å; R60-G62 PolarHBondContact O-N 3.46Å; G62-R180 CarbonylContact O-C 3.55Å; G62-R180 WeakPolarHBondContact O-CA 3.33Å; G62-V181 PolarHBondContact O-N 2.92Å
63	R	95.7	Very high	90.5	Very high	36 Å²	36	45 Å²	45	14%	0.136	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-81.6	134.5	178.6	-64.9	172	-179.3	-77.7	2.4	111.1	M37 I42 D44 I47 R60 Y61 G66 R180	M37-R63 HydrophobicContact CE-CG 4.12Å; M37-R63 WeakPolarHBondContact O-CB 3.5Å; M37-R63 VanDerWaalsContact O-CD 3.31Å; M37-R63 WeakPolarHBondContact O-CD 3.35Å; M37-R63 WeakPolarHBondContact O-CG 3.42Å; M37-R63 PolarHBondContact O-NH1 2.95Å; I42-R63 VanDerWaalsContact O-CZ 3.29Å; I42-R63 PolarHBondContact O-NH1 2.83Å; I42-R63 PolarHBondContact O-NH2 2.77Å; D44-R63 IonicContact OD1-CZ 2.67Å; D44-R63 IonicContact OD1-NE 2.79Å; D44-R63 IonicContact OD1-NH2 3.76Å; D44-R63 PolarHBondContact OD1-NH2 3.42Å; I47-R63 HydrophobicContact CD1-CG 4.16Å; I47-R63 VanDerWaalsContact CD1-CZ 3.4Å; R60-R63 WeakPolarHBondContact O-CD 3.34Å; R60-R63 WeakPolarHBondContact O-CG 3.43Å; R60-R63 PolarHBondContact O-NE 2.95Å; Y61-R63 PolarHBondContact O-N 2.87Å; R63-G66 PolarHBondContact O-N 3.31Å; R63-R180 WeakPolarHBondContact O-CB 3.41Å; R63-R180 VanDerWaalsContact O-CD 3.25Å; R63-R180 WeakPolarHBondContact O-CD 3.44Å; R63-R180 VanDerWaalsContact O-CG 3.32Å; R63-R180 WeakPolarHBondContact O-CG 3.26Å
64	L	90.7	Very high	90.7	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.021	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	140.5	174.2	-155.5	80	0	0	0	111.7	S38 G66 Q104 I151 V181 E182	S38-L64 WeakPolarHBondContact CB-O 3.41Å; L64-G66 PolarHBondContact O-N 2.96Å; L64-Q104 HydrophobicContact CD1-CB 3.63Å; L64-I151 HydrophobicContact CD1-CG1 4.45Å; L64-I151 HydrophobicContact CD1-CG2 4.22Å; L64-I151 HydrophobicContact CD2-CD1 3.99Å; L64-I151 HydrophobicContact CD2-CG1 4.24Å; L64-I151 HydrophobicContact CD2-CG2 3.95Å; L64-I151 HydrophobicContact CG-CG1 4.42Å; L64-V181 PolarHBondContact N-O 3.19Å; L64-V181 VanDerWaalsContact N-O 3.08Å; L64-E182 HydrophobicContact CB-CB 3.85Å; L64-E182 HydrophobicContact CD2-CB 3.83Å; L64-E182 HydrophobicContact CG-CB 4.35Å
65	D	86.3	Confident	90.8	Very high	80 Å²	80	36.8 Å²	36.8	43%	0.428	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	58	1.3	-177.4	-61.3	-42.3	0	0	0	116.1	Q104 I151	D65-Q104 PolarHBondContact OD1-NE2 3.5Å; D65-Q104 PolarHBondContact OD1-OE1 2.76Å; D65-I151 WeakPolarHBondContact OD2-CD1 3.37Å
66	G	81.5	Confident	90.5	Very high	26 Å²	26	36.5 Å²	36.5	27%	0.268	20%	0.196	S	C	.	.			trans	-77.4	126.1	174.4	0	0	0	0	0	112.7	R63 L64 R180	R63-G66 PolarHBondContact O-N 3.31Å; L64-G66 PolarHBondContact O-N 2.96Å; G66-R180 WeakPolarHBondContact O-CD 3.35Å; G66-R180 PolarHBondContact O-NH1 2.88Å
67	E	84.1	Confident	89.6	Confident	82 Å²	82	37.2 Å²	37.2	38%	0.383	20%	0.196	S	C	.	.			trans	-103.1	12.7	175.3	-65.6	-72.4	132.3	0	0	112.9	H107 A108 G109 R180	E67-H107 WeakPolarHBondContact OE1-CB 3.29Å; E67-H107 IonicContact OE1-CD2 3Å; E67-H107 IonicContact OE1-CG 3.27Å; E67-H107 IonicContact OE2-CD2 3.2Å; E67-A108 WeakPolarHBondContact OE2-CA 3.44Å; E67-A108 PolarHBondContact OE2-N 3.12Å; E67-G109 PolarHBondContact OE2-N 2.9Å; E67-R180 IonicContact OE1-CZ 3.73Å; E67-R180 IonicContact OE1-NH1 3.84Å; E67-R180 PolarHBondContact OE1-NH1 3.45Å; E67-R180 IonicContact OE1-NH2 2.68Å; E67-R180 PolarHBondContact OE1-NH2 2.9Å
68	E	82.8	Confident	87.9	Confident	146 Å²	146	40.9 Å²	40.9	68%	0.682	22%	0.219	S	C	*	.			trans	-69	157	177.2	-67.8	-167.5	-173.9	0	0	113.3	Y61 G71	Y61-E68 HydrophobicContact CD1-CB 3.63Å; Y61-E68 WeakPolarHBondContact CD1-O 3.3Å; Y61-E68 HydrophobicContact CE1-CB 3.66Å; E68-G71 WeakPolarHBondContact O-CA 3.37Å; E68-G71 PolarHBondContact O-N 3.36Å
69	G	87.2	Confident	85.8	Confident	45 Å²	45	45 Å²	45	46%	0.464	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	-134	-174.8	0	0	0	0	0	111.1	G71	G69-G71 VanDerWaalsContact C-N 3.27Å
70	D	86.7	Confident	83.8	Confident	73 Å²	73	51.4 Å²	51.4	39%	0.39	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	15.1	168	-72	-31.1	0	0	0	112.3	S56 T57 R106 A108	S56-D70 WeakPolarHBondContact CB-OD2 3.22Å; S56-D70 PolarHBondContact O-N 2.9Å; S56-D70 PolarHBondContact OG-OD2 2.53Å; T57-D70 HydrophobicContact CG2-CB 3.99Å; D70-R106 WeakPolarHBondContact O-CD 3.36Å; D70-R106 VanDerWaalsContact O-CG 3.23Å; D70-R106 WeakPolarHBondContact O-CG 3.43Å; D70-R106 PolarHBondContact O-NH1 2.83Å; D70-A108 WeakPolarHBondContact O-CB 3.26Å
71	G	86.9	Confident	81.7	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.313	C	S	.	.	S	Bend	trans	89.5	12.3	167.4	0	0	0	0	0	117.3	E68 G69 R180	E68-G71 WeakPolarHBondContact O-CA 3.37Å; E68-G71 PolarHBondContact O-N 3.36Å; G69-G71 VanDerWaalsContact C-N 3.27Å; G71-R180 VanDerWaalsContact O-CD 3.31Å; G71-R180 WeakPolarHBondContact O-CD 3.41Å; G71-R180 PolarHBondContact O-NE 2.91Å
72	A	94.6	Very high	79.7	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	33%	0.328	C	S	.	.	S	Bend	trans	-171.5	167.5	169.7	0	0	0	0	0	111.9	T57 Y61 R106 C178 R180	T57-A72 WeakPolarHBondContact CA-O 3.25Å; Y61-A72 CarbonylContact O-C 3.47Å; Y61-A72 VanDerWaalsContact O-CA 3.27Å; Y61-A72 WeakPolarHBondContact O-CA 3.38Å; A72-R106 HydrophobicContact CB-CB 3.55Å; A72-R106 HydrophobicContact CB-CG 3.67Å; A72-C178 HydrophobicContact CB-CB 3.82Å; A72-R180 HydrophobicContact CB-CG 3.94Å
73	W	95.8	Very high	77.7	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	34%	0.339	C	S	.	.	B	Isolated β-bridge	trans	-75.8	138	154.6	167	71.6	0	0	0	110.6	A49 S51 T57 Y61 P75 F87 L88 P169 C178 M179	A49-W73 HydrophobicContact CB-CZ2 4.08Å; A49-W73 VanDerWaalsContact CB-NE1 3.29Å; S51-W73 PolarHBondContact O-NE1 3.39Å; T57-W73 WeakPolarHBondContact O-CA 3.37Å; Y61-W73 PolarHBondContact O-N 3Å; W73-P75 HydrophobicContact CH2-CB 4.16Å; W73-P75 HydrophobicContact CH2-CG 4.19Å; W73-P75 HydrophobicContact CZ2-CB 3.74Å; W73-P75 HydrophobicContact CZ2-CG 4.21Å; W73-F87 VanDerWaalsContact CH2-C 3.43Å; W73-F87 WeakPolarHBondContact CZ2-O 3.28Å; W73-L88 HydrophobicContact CB-CD1 4.34Å; W73-L88 HydrophobicContact CD2-CB 4.07Å; W73-L88 HydrophobicContact CD2-CD1 4.15Å; W73-L88 HydrophobicContact CE3-CB 3.7Å; W73-L88 HydrophobicContact CE3-CD2 4.27Å; W73-L88 HydrophobicContact CE3-CG 4.38Å; W73-L88 HydrophobicContact CG-CD1 4.07Å; W73-L88 HydrophobicContact CH2-CB 4.16Å; W73-L88 HydrophobicContact CZ3-CB 3.75Å; W73-P169 HydrophobicContact CH2-CG 4.07Å; W73-P169 HydrophobicContact CZ3-CG 4.18Å; W73-C178 CarbonylContact O-C 3.39Å; W73-C178 VanDerWaalsContact O-CA 3.26Å; W73-C178 WeakPolarHBondContact O-CA 3.42Å; W73-C178 WeakPolarHBondContact O-CB 3.34Å; W73-M179 HydrophobicContact CE3-CB 4.08Å; W73-M179 HydrophobicContact CZ3-CB 4.33Å; W73-M179 HydrophobicContact CZ3-CG 4.4Å; W73-M179 HydrophobicContact CZ3-SD 4.37Å; W73-M179 PolarHBondContact N-O 3.36Å; W73-M179 PolarHBondContact O-N 3.18Å
74	C	93.6	Very high	75.9	Confident	9 Å²	9	61.8 Å²	61.8	6%	0.061	36%	0.36	C	S	.	.			trans	-137	127.6	173.9	-50.7	0	0	0	0	109.1	Q52 W53 T57 C178	Q52-C74 CarbonylContact C-O 3.46Å; Q52-C74 WeakPolarHBondContact CA-O 3.42Å; W53-C74 HydrophobicContact CB-CB 4.22Å; W53-C74 PolarHBondContact N-O 3.14Å; T57-C74 HydrophobicContact CG2-CB 4.07Å; T57-C74 PolarHBondContact O-N 2.89Å; T57-C74 PolarHBondContact OG1-O 3.08Å; C74-C178 HydrophobicContact CB-CB 4.09Å; C74-C178 WeakPolarHBondContact CB-SG 3.5Å; C74-C178 WeakPolarHBondContact SG-CB 3.21Å; C74-C178 CovalentContact SG-SG 2.04Å; C74-C178 PolarHBondContact SG-SG 2.86Å
75	P	91.8	Very high	75.1	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.013	38%	0.383	C	S	.	.			trans	-71.3	157.3	176.7	29.8	-34.2	0	0	0	112.6	S51 W73 I77 E86 I171 V177	S51-P75 WeakPolarHBondContact OG-CA 3.44Å; W73-P75 HydrophobicContact CH2-CB 4.16Å; W73-P75 HydrophobicContact CH2-CG 4.19Å; W73-P75 HydrophobicContact CZ2-CB 3.74Å; W73-P75 HydrophobicContact CZ2-CG 4.21Å; P75-I77 PolarHBondContact O-N 2.8Å; P75-E86 HydrophobicContact CB-CB 4.07Å; P75-E86 HydrophobicContact CB-CG 3.92Å; P75-E86 HydrophobicContact CG-CB 4.48Å; P75-I171 HydrophobicContact CG-CD1 4.07Å; P75-V177 VanDerWaalsContact CD-O 3.32Å; P75-V177 WeakPolarHBondContact CD-O 3.25Å
76	E	86.6	Confident	75.2	Confident	105 Å²	105	65 Å²	65	49%	0.491	37%	0.37	S	S	.	.			trans	-75.4	98.2	171.7	-166.5	-174.9	177.2	0	0	109.8	S51 T78	S51-E76 PolarHBondContact OG-N 3.42Å; E76-T78 VanDerWaalsContact C-N 3.25Å; E76-T78 HydrophobicContact CG-CG2 4.16Å; E76-T78 PolarHBondContact O-N 3.34Å
77	I	72.1	Confident	75.8	Confident	52 Å²	52	65.5 Å²	65.5	27%	0.267	37%	0.365	S	S	.	.			trans	-75.7	78.9	-177.9	-51.8	-177.7	0	0	0	110.1	W53 P75 I171 N176	W53-I77 HydrophobicContact CZ3-CB 4.46Å; P75-I77 PolarHBondContact O-N 2.8Å; I77-I171 HydrophobicContact CD1-CG2 4.3Å; I77-I171 HydrophobicContact CG1-CD1 4.48Å; I77-N176 HydrophobicContact CD1-CB 4.23Å
78	T	56.2	Low	76.4	Confident	83 Å²	83	61.6 Å²	61.6	51%	0.509	35%	0.347	S	S	.	.			trans	-73.3	142.2	170.6	52.4	0	0	0	0	110.9	E76 E80	E76-T78 VanDerWaalsContact C-N 3.25Å; E76-T78 HydrophobicContact CG-CG2 4.16Å; E76-T78 PolarHBondContact O-N 3.34Å; T78-E80 PolarHBondContact O-N 3.16Å
79	G	50.9	Low	77.1	Confident	87 Å²	87	56 Å²	56	90%	0.897	32%	0.321	S	S	*	.	S	Bend	trans	-76.3	21.1	-169.2	0	0	0	0	0	116.7
80	E	52.4	Low	77.7	Confident	142 Å²	142	53.8 Å²	53.8	66%	0.664	30%	0.298	S	S	*	.	S	Bend	trans	-91.4	152.2	175.5	-69.6	-158.6	159.8	0	0	112	T78 D82 H83	T78-E80 PolarHBondContact O-N 3.16Å; E80-D82 PolarHBondContact O-N 3.39Å; E80-H83 PolarHBondContact O-CE1 3.38Å
81	P	50.1	Low	78.2	Confident	116 Å²	116	51.6 Å²	51.6	75%	0.753	29%	0.287	S	S	*	.	S	Bend	trans	-71.2	2.8	-167	-19.9	34.2	0	0	0	116.3	H83	P81-H83 PolarHBondContact O-CD2 3.06Å; P81-H83 VanDerWaalsContact O-CD2 3.3Å; P81-H83 PolarHBondContact O-N 3.14Å; P81-H83 VanDerWaalsContact O-N 3.08Å
82	D	52.4	Low	78.7	Confident	86 Å²	86	52.3 Å²	52.3	46%	0.46	29%	0.29	S	S	.	.			trans	-92.3	45.7	-164.1	-135.8	-9.1	0	0	0	112	E80 L84 K85	E80-D82 PolarHBondContact O-N 3.39Å; D82-L84 PolarHBondContact O-N 3.1Å; D82-K85 HydrophobicContact CB-CD 4.1Å; D82-K85 PolarHBondContact O-N 3.32Å; D82-K85 WeakPolarHBondContact OD2-CE 3.39Å; D82-K85 IonicContact OD2-NZ 3.71Å; D82-K85 PolarHBondContact OD2-NZ 3.33Å
83	H	53.6	Low	78.6	Confident	50 Å²	50	59.6 Å²	59.6	23%	0.231	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	17	-174	-48.8	-58.5	0	0	0	115.6	E80 P81 H173	E80-H83 PolarHBondContact O-CE1 3.38Å; P81-H83 PolarHBondContact O-CD2 3.06Å; P81-H83 VanDerWaalsContact O-CD2 3.3Å; P81-H83 PolarHBondContact O-N 3.14Å; P81-H83 VanDerWaalsContact O-N 3.08Å; H83-H173 AromaticContact CE1-CE1 3.85Å; H83-H173 AromaticContact NE2-CE1 3.2Å; H83-H173 PolarHBondContact NE2-CE1 3.02Å; H83-H173 AromaticContact NE2-ND1 3.99Å; H83-H173 AromaticContact NE2-NE2 3.96Å
84	L	56.9	Low	78.4	Confident	110 Å²	110	61 Å²	61	58%	0.576	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.9	5.9	179.3	-66.1	172.6	0	0	0	112.6	D82 K120 M168	D82-L84 PolarHBondContact O-N 3.1Å; L84-K120 VanDerWaalsContact CD2-NZ 3.32Å; L84-M168 WeakPolarHBondContact O-CE 2.85Å
85	K	73.8	Confident	78.5	Confident	117 Å²	117	61 Å²	61	51%	0.509	33%	0.327	S	S	.	.			trans	-88.3	-30.1	177.1	-76.7	172.7	172.4	159	0	113.9	D82 F87	D82-K85 HydrophobicContact CB-CD 4.1Å; D82-K85 PolarHBondContact O-N 3.32Å; D82-K85 WeakPolarHBondContact OD2-CE 3.39Å; D82-K85 IonicContact OD2-NZ 3.71Å; D82-K85 PolarHBondContact OD2-NZ 3.33Å; K85-F87 VanDerWaalsContact O-CD1 3.24Å; K85-F87 WeakPolarHBondContact O-CD1 3.14Å
86	E	89.6	Confident	78.6	Confident	33 Å²	33	62.1 Å²	62.1	15%	0.154	33%	0.332	C	S	.	.			trans	-70.9	136.9	-170.9	-59.4	-45.6	106.2	0	0	113.5	S50 S51 P75 M168 P169 I171	S50-E86 WeakPolarHBondContact CB-OE2 3.35Å; S50-E86 VanDerWaalsContact OG-CA 3.29Å; S50-E86 WeakPolarHBondContact OG-CA 3.46Å; S50-E86 PolarHBondContact OG-OE2 3.09Å; S51-E86 WeakPolarHBondContact CB-OE2 3.35Å; S51-E86 PolarHBondContact OG-OE2 3.37Å; P75-E86 HydrophobicContact CB-CB 4.07Å; P75-E86 HydrophobicContact CB-CG 3.92Å; P75-E86 HydrophobicContact CG-CB 4.48Å; E86-M168 WeakPolarHBondContact O-CA 3.31Å; E86-M168 WeakPolarHBondContact O-CE 3.48Å; E86-P169 HydrophobicContact CB-CG 4.48Å; E86-I171 HydrophobicContact CB-CD1 4.38Å; E86-I171 HydrophobicContact CG-CD1 4.22Å
87	F	94	Very high	79.1	Confident	37 Å²	37	57.2 Å²	57.2	16%	0.162	31%	0.309	C	S	.	.			trans	-153.8	149	177.5	62.3	-101.9	0	0	0	113.5	A49 S50 W73 K85 Q89 R166 F167 M168	A49-F87 VanDerWaalsContact CA-O 3.26Å; A49-F87 WeakPolarHBondContact CA-O 3.49Å; A49-F87 WeakPolarHBondContact CB-O 3.46Å; S50-F87 PolarHBondContact N-O 2.99Å; S50-F87 PolarHBondContact OG-N 2.96Å; S50-F87 PolarHBondContact OG-O 3.5Å; W73-F87 VanDerWaalsContact CH2-C 3.43Å; W73-F87 WeakPolarHBondContact CZ2-O 3.28Å; K85-F87 VanDerWaalsContact O-CD1 3.24Å; K85-F87 WeakPolarHBondContact O-CD1 3.14Å; F87-Q89 HydrophobicContact CD2-CB 3.76Å; F87-Q89 HydrophobicContact CE2-CB 3.82Å; F87-R166 HydrophobicContact CB-CB 4.08Å; F87-R166 HydrophobicContact CB-CG 4.1Å; F87-R166 HydrophobicContact CD2-CG 3.76Å; F87-R166 HydrophobicContact CE2-CG 4.37Å; F87-R166 HydrophobicContact CG-CB 4.43Å; F87-R166 HydrophobicContact CG-CG 3.92Å; F87-F167 CarbonylContact C-O 3.47Å; F87-F167 VanDerWaalsContact CA-O 3.22Å; F87-F167 WeakPolarHBondContact CA-O 3.38Å; F87-M168 HydrophobicContact CB-CE 4.33Å; F87-M168 HydrophobicContact CB-CG 4.05Å; F87-M168 HydrophobicContact CD1-CE 4.44Å
88	L	97.1	Very high	80.2	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	123.3	155.4	-177.4	64.6	0	0	0	107.9	I47 A49 A59 W73 R166 F167 V181	I47-L88 HydrophobicContact CG2-CD1 3.79Å; A49-L88 HydrophobicContact CB-CD1 4.49Å; A59-L88 HydrophobicContact CB-CD1 3.89Å; W73-L88 HydrophobicContact CB-CD1 4.34Å; W73-L88 HydrophobicContact CD2-CB 4.07Å; W73-L88 HydrophobicContact CD2-CD1 4.15Å; W73-L88 HydrophobicContact CE3-CB 3.7Å; W73-L88 HydrophobicContact CE3-CD2 4.27Å; W73-L88 HydrophobicContact CE3-CG 4.38Å; W73-L88 HydrophobicContact CG-CD1 4.07Å; W73-L88 HydrophobicContact CH2-CB 4.16Å; W73-L88 HydrophobicContact CZ3-CB 3.75Å; L88-R166 CarbonylContact O-C 3.58Å; L88-R166 VanDerWaalsContact O-CA 3.28Å; L88-R166 WeakPolarHBondContact O-CA 3.42Å; L88-F167 PolarHBondContact N-O 2.94Å; L88-F167 PolarHBondContact O-N 3.18Å; L88-V181 HydrophobicContact CD2-CG1 4.19Å; L88-V181 HydrophobicContact CD2-CG2 3.75Å
89	Q	97.9	Very high	82	Confident	28 Å²	28	51 Å²	51	13%	0.131	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	136.9	-179.2	179.2	-178.3	-68.4	0	0	111	I47 S48 F87 W130 V165 R166	I47-Q89 WeakPolarHBondContact CA-O 3.18Å; S48-Q89 PolarHBondContact N-O 3.02Å; S48-Q89 WeakPolarHBondContact O-CA 2.96Å; S48-Q89 PolarHBondContact O-N 3.08Å; S48-Q89 VanDerWaalsContact O-O 3.09Å; S48-Q89 PolarHBondContact OG-NE2 3.35Å; F87-Q89 HydrophobicContact CD2-CB 3.76Å; F87-Q89 HydrophobicContact CE2-CB 3.82Å; Q89-W130 HydrophobicContact CG-CH2 4.27Å; Q89-V165 CarbonylContact C-O 3.55Å; Q89-V165 VanDerWaalsContact CA-O 3.29Å; Q89-V165 WeakPolarHBondContact CA-O 3.36Å; Q89-R166 HydrophobicContact CB-CG 3.82Å; Q89-R166 HydrophobicContact CG-CG 4.01Å
90	I	98.5	Very high	84.1	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	130.2	177.8	-67.4	154.7	0	0	0	108.5	M37 I42 D46 I47 L92 L164 V165 F167 V181 L183	M37-I90 HydrophobicContact CE-CD1 3.57Å; M37-I90 HydrophobicContact CE-CG1 3.96Å; M37-I90 HydrophobicContact CG-CD1 4.09Å; M37-I90 HydrophobicContact SD-CD1 3.45Å; M37-I90 WeakPolarHBondContact SD-CD1 3.44Å; M37-I90 HydrophobicContact SD-CG1 3.68Å; M37-I90 HydrophobicContact SD-CG2 4.08Å; I42-I90 HydrophobicContact CD1-CG2 3.88Å; I42-I90 HydrophobicContact CG2-CG2 4.13Å; D46-I90 WeakPolarHBondContact O-CA 3.36Å; I47-I90 HydrophobicContact CG2-CG1 4.48Å; I90-L92 HydrophobicContact CG2-CD2 3.9Å; I90-L164 VanDerWaalsContact O-CA 3.31Å; I90-L164 WeakPolarHBondContact O-CA 3.49Å; I90-V165 PolarHBondContact N-O 2.82Å; I90-V165 PolarHBondContact O-N 2.68Å; I90-F167 HydrophobicContact CD1-CD2 4.3Å; I90-F167 HydrophobicContact CD1-CE2 4.11Å; I90-V181 HydrophobicContact CD1-CG2 3.48Å; I90-V181 VanDerWaalsContact CD1-CG2 3.48Å; I90-L183 HydrophobicContact CB-CD1 4.31Å; I90-L183 HydrophobicContact CD1-CD1 3.62Å; I90-L183 HydrophobicContact CG2-CD1 3.94Å
91	D	97.9	Very high	86.1	Confident	27 Å²	27	40.9 Å²	40.9	14%	0.144	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	109.7	175.8	-167.2	-26.4	0	0	0	110.6	D46 R93 R163 L164	D46-D91 WeakPolarHBondContact CB-O 3.48Å; D46-D91 PolarHBondContact O-N 2.7Å; D91-R93 PolarHBondContact O-N 2.8Å; D91-R93 WeakPolarHBondContact OD1-CA 3.46Å; D91-R93 PolarHBondContact OD1-N 3.02Å; D91-R163 IonicContact OD1-CZ 3.47Å; D91-R163 IonicContact OD1-NH1 2.74Å; D91-R163 PolarHBondContact OD1-NH1 2.94Å; D91-R163 IonicContact OD2-CZ 3.21Å; D91-R163 IonicContact OD2-NH1 2.74Å; D91-R163 PolarHBondContact OD2-NH1 2.96Å; D91-L164 HydrophobicContact CB-CD2 4.44Å; D91-L164 HydrophobicContact CB-CG 4.5Å
92	L	96.2	Very high	88.3	Confident	15 Å²	15	35.4 Å²	35.4	8%	0.079	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	3.2	-177.1	-56.1	172.7	0	0	0	113.3	L35 I42 I90 S94 H96 I98 R163	L35-L92 HydrophobicContact CB-CD2 4.2Å; L35-L92 HydrophobicContact CD1-CD1 3.87Å; L35-L92 HydrophobicContact CD1-CD2 4.33Å; I42-L92 HydrophobicContact CD1-CD2 3.62Å; I42-L92 HydrophobicContact CG1-CD2 4.36Å; I90-L92 HydrophobicContact CG2-CD2 3.9Å; L92-S94 PolarHBondContact O-N 3.4Å; L92-H96 HydrophobicContact CD1-CB 3.76Å; L92-I98 HydrophobicContact CD1-CD1 3.85Å; L92-I98 HydrophobicContact CD1-CG1 4.47Å; L92-R163 WeakPolarHBondContact CB-O 3.48Å; L92-R163 PolarHBondContact N-O 2.81Å
93	R	93.1	Very high	90.3	Very high	152 Å²	152	31.3 Å²	31.3	57%	0.574	15%	0.146	S	C	*	.	E	Extended strand (participates in β ladder)	trans	60.7	-39	-177.5	-59.7	-71	-177.3	144	4.2	116.2	D46 D91 R163	D46-R93 IonicContact OD1-CZ 2.76Å; D46-R93 IonicContact OD1-NE 2.6Å; D46-R93 PolarHBondContact OD1-NE 3.25Å; D46-R93 IonicContact OD1-NH2 3.45Å; D46-R93 PolarHBondContact OD1-NH2 2.93Å; D91-R93 PolarHBondContact O-N 2.8Å; D91-R93 WeakPolarHBondContact OD1-CA 3.46Å; D91-R93 PolarHBondContact OD1-N 3.02Å; R93-R163 WeakPolarHBondContact O-CD 3.48Å
94	S	92.6	Very high	92.3	Very high	29 Å²	29	29.3 Å²	29.3	20%	0.203	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	168.8	168.8	70	0	0	0	0	111.7	L92 H96 E187	L92-S94 PolarHBondContact O-N 3.4Å; S94-H96 PolarHBondContact O-ND1 2.87Å; S94-H96 PolarHBondContact OG-CE1 3.31Å; S94-H96 VanDerWaalsContact OG-CE1 3.22Å; S94-E187 WeakPolarHBondContact CB-OE1 3.44Å; S94-E187 PolarHBondContact OG-OE1 3.42Å
95	L	94.4	Very high	93.9	Very high	10 Å²	10	24 Å²	24	5%	0.052	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	134.3	176	-68.9	169.7	0	0	0	110	R125 R163 W188 V193 D276	L95-R125 HydrophobicContact CD2-CB 3.84Å; L95-R125 HydrophobicContact CD2-CG 3.82Å; L95-R163 HydrophobicContact CD2-CB 4.12Å; L95-W188 HydrophobicContact CB-CB 3.88Å; L95-W188 HydrophobicContact CB-CG 4.38Å; L95-W188 WeakPolarHBondContact O-CB 3.39Å; L95-W188 PolarHBondContact O-N 3.41Å; L95-V193 HydrophobicContact CD1-CG2 3.91Å; L95-D276 HydrophobicContact CD1-CB 3.83Å
96	H	95.1	Very high	94.9	Very high	26 Å²	26	20.3 Å²	20.3	12%	0.12	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	146.7	178.4	-74.9	75.1	0	0	0	110.8	L35 L92 S94 I98 I161 A162 C186	L35-H96 HydrophobicContact CD1-CB 4.11Å; L92-H96 HydrophobicContact CD1-CB 3.76Å; S94-H96 PolarHBondContact O-ND1 2.87Å; S94-H96 PolarHBondContact OG-CE1 3.31Å; S94-H96 VanDerWaalsContact OG-CE1 3.22Å; H96-I98 HydrophobicContact CB-CG1 4.11Å; H96-I161 WeakPolarHBondContact O-CA 3.39Å; H96-A162 PolarHBondContact N-O 3.07Å; H96-A162 PolarHBondContact O-N 3.21Å; H96-A162 VanDerWaalsContact O-N 3.08Å; H96-C186 CarbonylContact C-O 3.53Å; H96-C186 WeakPolarHBondContact CA-O 3.43Å
97	F	95.4	Very high	94.7	Very high	1 Å²	1	21.5 Å²	21.5	0%	0.004	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	107.8	170.2	-170.9	-83.2	0	0	0	108.2	V26 P28 C31 T99 P159 I161 G185 C186 W188 D234	V26-F97 HydrophobicContact CG1-CB 4.3Å; V26-F97 HydrophobicContact CG1-CD1 3.58Å; V26-F97 HydrophobicContact CG1-CD2 4.24Å; V26-F97 HydrophobicContact CG1-CE1 3.82Å; V26-F97 HydrophobicContact CG1-CE2 4.46Å; V26-F97 HydrophobicContact CG1-CG 3.8Å; V26-F97 HydrophobicContact CG1-CZ 4.26Å; P28-F97 HydrophobicContact CB-CE1 4.25Å; P28-F97 HydrophobicContact CG-CE1 4.01Å; P28-F97 HydrophobicContact CG-CZ 4.05Å; C31-F97 HydrophobicContact CB-CD1 4.42Å; C31-F97 PolarHBondContact SG-O 3.15Å; C31-F97 VanDerWaalsContact SG-O 3.38Å; F97-T99 HydrophobicContact CD1-CG2 3.59Å; F97-T99 HydrophobicContact CE1-CG2 3.51Å; F97-P159 HydrophobicContact CD1-CB 4.3Å; F97-P159 HydrophobicContact CE1-CB 3.63Å; F97-P159 HydrophobicContact CE1-CG 3.88Å; F97-P159 HydrophobicContact CE2-CB 4.22Å; F97-P159 HydrophobicContact CZ-CB 3.58Å; F97-P159 HydrophobicContact CZ-CG 3.76Å; F97-I161 HydrophobicContact CD2-CD1 3.96Å; F97-I161 HydrophobicContact CD2-CG1 3.6Å; F97-I161 HydrophobicContact CE2-CD1 4.24Å; F97-I161 HydrophobicContact CE2-CG1 4.2Å; F97-I161 HydrophobicContact CG-CG1 4.48Å; F97-G185 CarbonylContact O-C 3.6Å; F97-G185 WeakPolarHBondContact O-CA 3.49Å; F97-C186 PolarHBondContact N-O 3.28Å; F97-C186 PolarHBondContact O-N 2.91Å; F97-W188 HydrophobicContact CB-CE3 4.03Å; F97-W188 AromaticContact CD2-CE3 3.72Å; F97-W188 HydrophobicContact CD2-CE3 3.72Å; F97-W188 HydrophobicContact CD2-CH2 4.5Å; F97-W188 AromaticContact CD2-CZ3 3.57Å; F97-W188 HydrophobicContact CD2-CZ3 3.57Å; F97-W188 HydrophobicContact CE2-CZ3 4.11Å; F97-W188 HydrophobicContact CG-CE3 4.29Å; F97-W188 HydrophobicContact CG-CZ3 4.47Å; F97-D234 WeakPolarHBondContact CZ-O 3.26Å
98	I	96.1	Very high	94.2	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.01	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	122.1	-167.8	-53.4	168.1	0	0	0	108.6	L35 L92 H96 P159 I160 A162 V165 L183	L35-I98 HydrophobicContact CD1-CG1 4.12Å; L92-I98 HydrophobicContact CD1-CD1 3.85Å; L92-I98 HydrophobicContact CD1-CG1 4.47Å; H96-I98 HydrophobicContact CB-CG1 4.11Å; I98-P159 WeakPolarHBondContact O-CA 3.31Å; I98-P159 WeakPolarHBondContact O-CB 3.35Å; I98-I160 HydrophobicContact CB-CB 4.29Å; I98-I160 HydrophobicContact CD1-CG2 4.39Å; I98-I160 PolarHBondContact N-O 3.05Å; I98-I160 PolarHBondContact O-N 2.6Å; I98-A162 HydrophobicContact CD1-CB 4.34Å; I98-V165 HydrophobicContact CD1-CG2 3.59Å; I98-L183 HydrophobicContact CD1-CD2 3.94Å; I98-L183 HydrophobicContact CG2-CB 4.42Å; I98-L183 HydrophobicContact CG2-CD2 4.26Å
99	T	93.8	Very high	93.1	Very high	3 Å²	3	23.6 Å²	23.6	2%	0.018	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	-21.4	-167.7	54.8	0	0	0	0	113.6	P28 C31 R32 F97 M156 P159 Y184	P28-T99 HydrophobicContact CB-CG2 4.23Å; C31-T99 HydrophobicContact CB-CG2 4.44Å; C31-T99 WeakPolarHBondContact O-CG2 3.06Å; C31-T99 PolarHBondContact O-OG1 3.23Å; R32-T99 WeakPolarHBondContact CG-OG1 3.41Å; F97-T99 HydrophobicContact CD1-CG2 3.59Å; F97-T99 HydrophobicContact CE1-CG2 3.51Å; T99-M156 PolarHBondContact O-N 2.83Å; T99-P159 HydrophobicContact CG2-CB 4.42Å; T99-Y184 PolarHBondContact N-O 2.97Å; T99-Y184 PolarHBondContact OG1-O 3.44Å
100	L	94.1	Very high	92.3	Very high	15 Å²	15	24.6 Å²	24.6	8%	0.079	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	148.3	-178.6	175.1	89.9	0	0	0	108.5	L153 R154 Y184	L100-L153 HydrophobicContact CD1-CB 4.14Å; L100-L153 HydrophobicContact CD2-CD2 4.2Å; L100-R154 WeakPolarHBondContact CA-O 3.47Å; L100-R154 VanDerWaalsContact CD1-O 3.3Å; L100-R154 WeakPolarHBondContact CD1-O 3.37Å; L100-Y184 HydrophobicContact CB-CD2 4.4Å; L100-Y184 HydrophobicContact CD2-CD2 3.75Å; L100-Y184 HydrophobicContact CD2-CE2 4.27Å; L100-Y184 HydrophobicContact CD2-CG 3.91Å; L100-Y184 HydrophobicContact CG-CD2 4.07Å; L100-Y184 HydrophobicContact CG-CG 4.47Å; L100-Y184 PolarHBondContact N-O 2.95Å; L100-Y184 WeakPolarHBondContact O-CB 3.4Å; L100-Y184 PolarHBondContact O-N 3.14Å
101	V	95.9	Very high	91.5	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.012	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	147.7	169	-66	0	0	0	0	110.5	Y119 I121 L153 R154 M156 F167	V101-Y119 HydrophobicContact CG2-CE2 4.39Å; V101-Y119 WeakPolarHBondContact CG2-OH 3.36Å; V101-I121 HydrophobicContact CB-CD1 4.47Å; V101-I121 HydrophobicContact CG1-CD1 3.89Å; V101-I121 HydrophobicContact CG2-CD1 4Å; V101-L153 CarbonylContact O-C 3.53Å; V101-L153 WeakPolarHBondContact O-CA 3.43Å; V101-R154 HydrophobicContact CG2-CB 4.24Å; V101-R154 PolarHBondContact N-O 2.9Å; V101-R154 PolarHBondContact O-N 3.43Å; V101-M156 HydrophobicContact CG1-CG 4.38Å; V101-M156 HydrophobicContact CG1-SD 4.14Å; V101-M156 HydrophobicContact CG2-SD 3.84Å; V101-F167 HydrophobicContact CB-CE1 3.88Å; V101-F167 HydrophobicContact CB-CZ 3.93Å; V101-F167 HydrophobicContact CG1-CE1 4.05Å; V101-F167 HydrophobicContact CG1-CZ 3.76Å; V101-F167 HydrophobicContact CG2-CE1 4.24Å
102	G	94.9	Very high	90.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	141.9	170.4	0	0	0	0	0	110.7	V181 E182	G102-V181 VanDerWaalsContact O-CA 3.29Å; G102-V181 WeakPolarHBondContact O-CA 3.48Å; G102-E182 PolarHBondContact N-O 3.05Å; G102-E182 PolarHBondContact O-N 2.85Å
103	T	96.3	Very high	90.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	146	175.4	47.4	0	0	0	0	110.4	Y119 N145 A152 F167 M179 R180 V181	T103-Y119 HydrophobicContact CG2-CD1 4.19Å; T103-Y119 HydrophobicContact CG2-CE1 3.47Å; T103-Y119 VanDerWaalsContact CG2-CE1 3.47Å; T103-Y119 HydrophobicContact CG2-CE2 4.32Å; T103-Y119 WeakPolarHBondContact OG1-CE1 3.43Å; T103-N145 PolarHBondContact O-ND2 2.97Å; T103-N145 PolarHBondContact O-OD1 3.2Å; T103-N145 PolarHBondContact OG1-OD1 2.83Å; T103-A152 PolarHBondContact N-O 3.45Å; T103-A152 PolarHBondContact O-N 3.12Å; T103-A152 PolarHBondContact OG1-O 3.12Å; T103-A152 VanDerWaalsContact OG1-O 3.1Å; T103-F167 HydrophobicContact CG2-CD1 4.12Å; T103-F167 HydrophobicContact CG2-CE1 4Å; T103-M179 HydrophobicContact CG2-CE 3.74Å; T103-R180 CarbonylContact C-O 3.35Å; T103-R180 WeakPolarHBondContact CA-O 3.41Å; T103-V181 HydrophobicContact CG2-CG1 4.11Å
104	Q	94.3	Very high	90.2	Very high	8 Å²	8	30.3 Å²	30.3	4%	0.037	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	153.5	-176.7	-170.7	-178.9	41.9	0	0	109.2	L64 D65 N145 Y149 R180	L64-Q104 HydrophobicContact CD1-CB 3.63Å; D65-Q104 PolarHBondContact OD1-NE2 3.5Å; D65-Q104 PolarHBondContact OD1-OE1 2.76Å; Q104-N145 WeakPolarHBondContact CA-ND2 3.36Å; Q104-N145 PolarHBondContact N-OD1 3.04Å; Q104-Y149 PolarHBondContact NE2-O 3.36Å; Q104-R180 HydrophobicContact CB-CB 4.14Å; Q104-R180 PolarHBondContact N-O 3.12Å; Q104-R180 PolarHBondContact O-N 3.43Å
105	G	91.9	Very high	90.2	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	18%	0.179	C	C	.	.			trans	-86.8	-174.8	177.3	0	0	0	0	0	113.4	H107 T148 R180	G105-H107 PolarHBondContact O-N 3.46Å; G105-T148 CarbonylContact C-O 3.57Å; G105-T148 PolarHBondContact N-O 2.94Å; G105-R180 VanDerWaalsContact O-CZ 3.29Å; G105-R180 PolarHBondContact O-NE 3.24Å; G105-R180 PolarHBondContact O-NH2 3.22Å
106	R	93.1	Very high	90.1	Very high	39 Å²	39	29.6 Å²	29.6	15%	0.147	18%	0.176	C	C	.	.			trans	-84.1	105.5	173.5	-169.2	-178	81.8	93.8	-6.9	109.9	D70 A72 A108 G112 E114 T148 C178	D70-R106 WeakPolarHBondContact O-CD 3.36Å; D70-R106 VanDerWaalsContact O-CG 3.23Å; D70-R106 WeakPolarHBondContact O-CG 3.43Å; D70-R106 PolarHBondContact O-NH1 2.83Å; A72-R106 HydrophobicContact CB-CB 3.55Å; A72-R106 HydrophobicContact CB-CG 3.67Å; R106-A108 HydrophobicContact CG-CB 4.32Å; R106-G112 CarbonylContact O-C 3.54Å; R106-G112 WeakPolarHBondContact O-CA 3.18Å; R106-E114 IonicContact CZ-OE1 2.66Å; R106-E114 IonicContact CZ-OE2 2.66Å; R106-E114 VanDerWaalsContact CZ-OE2 3.28Å; R106-E114 PolarHBondContact N-O 2.8Å; R106-E114 VanDerWaalsContact NE-CD 3.33Å; R106-E114 IonicContact NE-OE1 3.79Å; R106-E114 IonicContact NE-OE2 3.07Å; R106-E114 PolarHBondContact NE-OE2 3.33Å; R106-E114 VanDerWaalsContact NH2-CD 3.31Å; R106-E114 IonicContact NH2-OE1 2.73Å; R106-E114 PolarHBondContact NH2-OE1 2.82Å; R106-E114 IonicContact NH2-OE2 3.47Å; R106-E114 PolarHBondContact NH2-OE2 3.38Å; R106-T148 WeakPolarHBondContact O-CB 3.45Å; R106-T148 WeakPolarHBondContact O-CG2 3.39Å; R106-C178 HydrophobicContact CB-CB 3.81Å
107	H	85.4	Confident	89.9	Confident	57 Å²	57	33.3 Å²	33.3	26%	0.264	19%	0.193	S	C	.	.			trans	-87.8	-44.4	-179.3	178	64.9	0	0	0	112.2	E67 G105 G109 G110 M111 G112	E67-H107 WeakPolarHBondContact OE1-CB 3.29Å; E67-H107 IonicContact OE1-CD2 3Å; E67-H107 IonicContact OE1-CG 3.27Å; E67-H107 IonicContact OE2-CD2 3.2Å; G105-H107 PolarHBondContact O-N 3.46Å; H107-G109 PolarHBondContact O-N 2.89Å; H107-G110 VanDerWaalsContact CE1-CA 3.47Å; H107-G110 WeakPolarHBondContact CE1-CA 3.2Å; H107-G110 PolarHBondContact CE1-N 3.3Å; H107-G110 PolarHBondContact NE2-N 3.09Å; H107-G110 WeakPolarHBondContact O-CA 3.29Å; H107-G110 PolarHBondContact O-N 3.4Å; H107-M111 PolarHBondContact O-N 3.18Å; H107-G112 WeakPolarHBondContact O-CA 3.12Å; H107-G112 PolarHBondContact O-N 3.13Å
108	A	83.3	Confident	89.8	Confident	16 Å²	16	37.1 Å²	37.1	13%	0.132	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	50.3	54.5	172.2	0	0	0	0	0	112.8	E67 D70 R106 G110 M111	E67-A108 WeakPolarHBondContact OE2-CA 3.44Å; E67-A108 PolarHBondContact OE2-N 3.12Å; D70-A108 WeakPolarHBondContact O-CB 3.26Å; R106-A108 HydrophobicContact CG-CB 4.32Å; A108-G110 PolarHBondContact O-N 2.94Å; A108-M111 PolarHBondContact O-N 2.83Å; A108-M111 VanDerWaalsContact O-N 3.1Å
109	G	75.9	Confident	89.7	Confident	66 Å²	66	37 Å²	37	68%	0.68	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	59.2	26.6	-177.2	0	0	0	0	0	114.8	E67 H107	E67-G109 PolarHBondContact OE2-N 2.9Å; H107-G109 PolarHBondContact O-N 2.89Å
110	G	80.4	Confident	89.8	Confident	48 Å²	48	39.3 Å²	39.3	50%	0.495	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	88.2	2.5	-178	0	0	0	0	0	115.4	H107 A108	H107-G110 VanDerWaalsContact CE1-CA 3.47Å; H107-G110 WeakPolarHBondContact CE1-CA 3.2Å; H107-G110 PolarHBondContact CE1-N 3.3Å; H107-G110 PolarHBondContact NE2-N 3.09Å; H107-G110 WeakPolarHBondContact O-CA 3.29Å; H107-G110 PolarHBondContact O-N 3.4Å; A108-G110 PolarHBondContact O-N 2.94Å
111	M	80.8	Confident	89.9	Confident	151 Å²	151	38.7 Å²	38.7	74%	0.744	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-18.2	175.2	-62.5	-174	-70.2	0	0	113.3	H107 A108 N113	H107-M111 PolarHBondContact O-N 3.18Å; A108-M111 PolarHBondContact O-N 2.83Å; A108-M111 VanDerWaalsContact O-N 3.1Å; M111-N113 PolarHBondContact O-ND2 3.18Å
112	G	82.3	Confident	90	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.01	23%	0.231	C	C	.	.			trans	-85.2	139	-178.8	0	0	0	0	0	113.8	R106 H107 E114 T148	R106-G112 CarbonylContact O-C 3.54Å; R106-G112 WeakPolarHBondContact O-CA 3.18Å; H107-G112 WeakPolarHBondContact O-CA 3.12Å; H107-G112 PolarHBondContact O-N 3.13Å; G112-E114 WeakPolarHBondContact CA-OE2 3.37Å; G112-T148 WeakPolarHBondContact O-CG2 3.48Å; G112-T148 PolarHBondContact O-OG1 2.72Å; G112-T148 VanDerWaalsContact O-OG1 3.07Å
113	N	88	Confident	90.1	Very high	120 Å²	120	42.3 Å²	42.3	64%	0.642	23%	0.234	S	C	*	.			trans	-128.5	2.6	-176.8	-72.9	-79.4	0	0	0	113.1	M111 F115	M111-N113 PolarHBondContact O-ND2 3.18Å; N113-F115 VanDerWaalsContact O-CD1 3.32Å; N113-F115 WeakPolarHBondContact O-CD1 3.08Å
114	E	90.6	Very high	90.1	Very high	43 Å²	43	42.3 Å²	42.3	20%	0.201	23%	0.234	C	C	.	.			trans	-97.3	123.7	-171	-53.3	86.2	162.5	0	0	111.7	R106 G112 N176 C178	R106-E114 IonicContact CZ-OE1 2.66Å; R106-E114 IonicContact CZ-OE2 2.66Å; R106-E114 VanDerWaalsContact CZ-OE2 3.28Å; R106-E114 PolarHBondContact N-O 2.8Å; R106-E114 VanDerWaalsContact NE-CD 3.33Å; R106-E114 IonicContact NE-OE1 3.79Å; R106-E114 IonicContact NE-OE2 3.07Å; R106-E114 PolarHBondContact NE-OE2 3.33Å; R106-E114 VanDerWaalsContact NH2-CD 3.31Å; R106-E114 IonicContact NH2-OE1 2.73Å; R106-E114 PolarHBondContact NH2-OE1 2.82Å; R106-E114 IonicContact NH2-OE2 3.47Å; R106-E114 PolarHBondContact NH2-OE2 3.38Å; G112-E114 WeakPolarHBondContact CA-OE2 3.37Å; E114-N176 WeakPolarHBondContact CB-O 3.26Å; E114-N176 HydrophobicContact CG-CB 4.01Å; E114-C178 HydrophobicContact CB-CB 4.02Å; E114-C178 VanDerWaalsContact CB-SG 3.57Å
115	F	92.4	Very high	90.1	Very high	24 Å²	24	43 Å²	43	11%	0.105	24%	0.236	C	C	.	.			trans	-154.7	149.7	-177.3	59.7	-85.6	0	0	0	113.4	N113 Q117 N145 R146 N147 T148 C178	N113-F115 VanDerWaalsContact O-CD1 3.32Å; N113-F115 WeakPolarHBondContact O-CD1 3.08Å; F115-Q117 HydrophobicContact CD2-CG 3.99Å; F115-Q117 HydrophobicContact CE2-CG 3.58Å; F115-Q117 HydrophobicContact CZ-CG 4.5Å; F115-Q117 PolarHBondContact O-N 2.94Å; F115-N145 HydrophobicContact CB-CB 4.21Å; F115-N145 HydrophobicContact CD2-CB 3.9Å; F115-N145 WeakPolarHBondContact CD2-O 3.4Å; F115-N145 WeakPolarHBondContact CE2-O 3.38Å; F115-N145 HydrophobicContact CG-CB 4.42Å; F115-R146 WeakPolarHBondContact CZ-O 3.48Å; F115-N147 WeakPolarHBondContact CG-O 3.49Å; F115-T148 HydrophobicContact CB-CG2 4.31Å; F115-T148 HydrophobicContact CD1-CG2 3.81Å; F115-C178 WeakPolarHBondContact CA-O 3.2Å
116	A	91.9	Very high	90	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.256	C	S	.	.			trans	-80.5	103.1	175.8	0	0	0	0	0	111.9	M118 G144 N145 P169 V177 C178 M179	A116-M118 VanDerWaalsContact C-N 3.27Å; A116-M118 PolarHBondContact O-N 3.38Å; A116-G144 WeakPolarHBondContact O-CA 3.39Å; A116-N145 PolarHBondContact O-N 3.27Å; A116-P169 HydrophobicContact CB-CB 4.49Å; A116-V177 HydrophobicContact CB-CG1 3.64Å; A116-C178 PolarHBondContact N-O 3.44Å; A116-M179 HydrophobicContact CB-CE 4Å; A116-M179 HydrophobicContact CB-CG 3.57Å; A116-M179 HydrophobicContact CB-SD 3.74Å
117	Q	92.1	Very high	89.9	Confident	103 Å²	103	46.2 Å²	46.2	48%	0.481	26%	0.262	S	S	.	.	S	Bend	trans	-66	-29.6	172	-69.7	-174.5	11.2	0	0	113.1	F115 G144 M175	F115-Q117 HydrophobicContact CD2-CG 3.99Å; F115-Q117 HydrophobicContact CE2-CG 3.58Å; F115-Q117 HydrophobicContact CZ-CG 4.5Å; F115-Q117 PolarHBondContact O-N 2.94Å; Q117-G144 PolarHBondContact O-N 2.99Å; Q117-M175 HydrophobicContact CG-CE 4.43Å
118	M	92.4	Very high	90.1	Very high	81 Å²	81	48.2 Å²	48.2	40%	0.399	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	148.3	179	-72.7	-178.5	-70.2	0	0	109.9	A116 V141 I142 V170	A116-M118 VanDerWaalsContact C-N 3.27Å; A116-M118 PolarHBondContact O-N 3.38Å; M118-V141 HydrophobicContact CB-CG1 3.95Å; M118-V141 HydrophobicContact CG-CG1 4.02Å; M118-V141 HydrophobicContact SD-CG1 3.78Å; M118-I142 VanDerWaalsContact CA-O 3.31Å; M118-I142 WeakPolarHBondContact CA-O 3.16Å; M118-V170 HydrophobicContact CB-CB 3.9Å; M118-V170 HydrophobicContact CB-CG2 4.13Å; M118-V170 HydrophobicContact CE-CG1 4.41Å; M118-V170 PolarHBondContact O-N 3.12Å
119	Y	93.6	Very high	90.5	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	170.8	173	58	-92.2	0	0	0	111.2	V101 T103 I121 I142 F167 M168 M179	V101-Y119 HydrophobicContact CG2-CE2 4.39Å; V101-Y119 WeakPolarHBondContact CG2-OH 3.36Å; T103-Y119 HydrophobicContact CG2-CD1 4.19Å; T103-Y119 HydrophobicContact CG2-CE1 3.47Å; T103-Y119 VanDerWaalsContact CG2-CE1 3.47Å; T103-Y119 HydrophobicContact CG2-CE2 4.32Å; T103-Y119 WeakPolarHBondContact OG1-CE1 3.43Å; Y119-I121 HydrophobicContact CD2-CG1 4.19Å; Y119-I121 HydrophobicContact CE2-CD1 4.04Å; Y119-I121 HydrophobicContact CE2-CG1 4.16Å; Y119-I142 HydrophobicContact CD2-CB 4Å; Y119-I142 HydrophobicContact CD2-CD1 4.09Å; Y119-I142 HydrophobicContact CD2-CG2 4.39Å; Y119-I142 HydrophobicContact CE1-CG2 4.1Å; Y119-I142 HydrophobicContact CE2-CB 3.73Å; Y119-I142 HydrophobicContact CE2-CD1 3.63Å; Y119-I142 HydrophobicContact CE2-CG1 4.28Å; Y119-I142 HydrophobicContact CE2-CG2 3.66Å; Y119-I142 VanDerWaalsContact CZ-CG2 3.49Å; Y119-I142 PolarHBondContact N-O 2.77Å; Y119-I142 PolarHBondContact O-N 3.47Å; Y119-F167 HydrophobicContact CD2-CD1 4.24Å; Y119-F167 HydrophobicContact CE2-CD1 4.15Å; Y119-F167 HydrophobicContact CE2-CE1 4.32Å; Y119-M168 CarbonylContact C-O 3.47Å; Y119-M168 VanDerWaalsContact CA-O 3.22Å; Y119-M168 WeakPolarHBondContact CA-O 3.26Å; Y119-M168 WeakPolarHBondContact CB-O 3.43Å; Y119-M179 HydrophobicContact CD1-CE 3.97Å; Y119-M179 HydrophobicContact CG-CE 4.09Å
120	K	95.5	Very high	91.3	Very high	51 Å²	51	51.2 Å²	51.2	22%	0.222	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	152.9	169.1	-59.4	172.7	-174.1	170.5	0	108	L84 V141 M168 V170	L84-K120 VanDerWaalsContact CD2-NZ 3.32Å; K120-V141 HydrophobicContact CG-CG2 4.34Å; K120-M168 HydrophobicContact CB-CB 4.39Å; K120-M168 PolarHBondContact N-O 3.04Å; K120-M168 WeakPolarHBondContact O-CB 3.37Å; K120-M168 PolarHBondContact O-N 2.87Å; K120-V170 HydrophobicContact CG-CG2 4.32Å
121	I	97.1	Very high	92	Very high	2 Å²	2	50 Å²	50	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	132.2	171.9	-75	174	0	0	0	109.7	V101 Y119 W133 I142 M156 I160 V165 R166 F167	V101-I121 HydrophobicContact CB-CD1 4.47Å; V101-I121 HydrophobicContact CG1-CD1 3.89Å; V101-I121 HydrophobicContact CG2-CD1 4Å; Y119-I121 HydrophobicContact CD2-CG1 4.19Å; Y119-I121 HydrophobicContact CE2-CD1 4.04Å; Y119-I121 HydrophobicContact CE2-CG1 4.16Å; I121-W133 HydrophobicContact CB-CB 4.3Å; I121-W133 HydrophobicContact CG2-CB 4.27Å; I121-W133 PolarHBondContact O-N 2.92Å; I121-I142 HydrophobicContact CB-CD1 4.37Å; I121-I142 HydrophobicContact CD1-CD1 3.8Å; I121-I142 HydrophobicContact CG1-CD1 4Å; I121-M156 HydrophobicContact CD1-CE 3.76Å; I121-M156 HydrophobicContact CD1-SD 4.17Å; I121-I160 HydrophobicContact CG2-CD1 3.84Å; I121-V165 HydrophobicContact CG2-CG1 3.91Å; I121-R166 WeakPolarHBondContact CA-O 3.48Å; I121-F167 HydrophobicContact CD1-CD1 4.33Å; I121-F167 HydrophobicContact CD1-CE1 3.99Å; I121-F167 HydrophobicContact CD1-CZ 4.5Å; I121-F167 HydrophobicContact CG1-CD1 4.27Å; I121-F167 HydrophobicContact CG1-CE1 4.42Å
122	K	97.1	Very high	92.7	Very high	65 Å²	65	45 Å²	45	28%	0.283	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	150.7	159.1	-69.4	-176.4	-174.1	164.2	0	109.6	W130 I131 S132 R166 M168	K122-W130 HydrophobicContact CB-CE3 4.1Å; K122-I131 CarbonylContact C-O 3.58Å; K122-I131 WeakPolarHBondContact CA-O 3.3Å; K122-I131 WeakPolarHBondContact CB-O 3.39Å; K122-S132 WeakPolarHBondContact CE-OG 3.44Å; K122-R166 HydrophobicContact CB-CB 4.22Å; K122-R166 PolarHBondContact N-O 3.34Å; K122-R166 PolarHBondContact O-N 2.6Å; K122-M168 HydrophobicContact CB-SD 4.4Å; K122-M168 HydrophobicContact CD-SD 3.51Å; K122-M168 VanDerWaalsContact CD-SD 3.51Å; K122-M168 VanDerWaalsContact CE-SD 3.51Å; K122-M168 HydrophobicContact CG-SD 3.75Å
123	Y	97.9	Very high	93.4	Very high	14 Å²	14	45.8 Å²	45.8	6%	0.055	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	163.9	178.6	65.4	-93.3	0	0	0	111.5	I131 W133 I160 A162 L164 D218	Y123-I131 HydrophobicContact CD1-CB 4.49Å; Y123-I131 HydrophobicContact CD1-CG2 4.48Å; Y123-I131 HydrophobicContact CD2-CB 4.27Å; Y123-I131 HydrophobicContact CE1-CB 4.17Å; Y123-I131 HydrophobicContact CE1-CG2 3.75Å; Y123-I131 HydrophobicContact CE2-CB 3.93Å; Y123-I131 HydrophobicContact CE2-CD1 3.85Å; Y123-I131 HydrophobicContact CE2-CG1 4.47Å; Y123-I131 HydrophobicContact CE2-CG2 4.02Å; Y123-I131 VanDerWaalsContact CZ-CG2 3.49Å; Y123-I131 PolarHBondContact N-O 2.97Å; Y123-I131 PolarHBondContact O-N 2.91Å; Y123-I131 WeakPolarHBondContact OH-CG2 3.21Å; Y123-W133 HydrophobicContact CD1-CB 4.2Å; Y123-W133 HydrophobicContact CE1-CB 4Å; Y123-I160 HydrophobicContact CD1-CD1 3.69Å; Y123-I160 HydrophobicContact CD1-CG1 3.95Å; Y123-I160 HydrophobicContact CD1-CG2 3.81Å; Y123-I160 HydrophobicContact CD2-CG2 3.61Å; Y123-I160 HydrophobicContact CE1-CD1 4.06Å; Y123-I160 HydrophobicContact CE1-CG1 3.89Å; Y123-I160 HydrophobicContact CE1-CG2 4.18Å; Y123-I160 HydrophobicContact CE2-CG2 4Å; Y123-I160 HydrophobicContact CG-CD1 4.34Å; Y123-I160 HydrophobicContact CG-CG2 3.49Å; Y123-I160 VanDerWaalsContact CG-CG2 3.49Å; Y123-A162 HydrophobicContact CD2-CB 3.95Å; Y123-A162 HydrophobicContact CG-CB 4.26Å; Y123-L164 CarbonylContact C-O 3.53Å; Y123-L164 VanDerWaalsContact CA-O 3.28Å; Y123-L164 WeakPolarHBondContact CA-O 3.25Å; Y123-D218 VanDerWaalsContact CE2-OD2 3.3Å; Y123-D218 WeakPolarHBondContact CE2-OD2 3.38Å; Y123-D218 VanDerWaalsContact OH-CB 3.29Å; Y123-D218 WeakPolarHBondContact OH-CB 3.34Å; Y123-D218 PolarHBondContact OH-OD2 3.05Å
124	S	96.6	Very high	93.7	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	144.8	-179.7	-174.9	0	0	0	0	111	D126 G127 R129 R163 L164	S124-D126 PolarHBondContact OG-OD1 3.03Å; S124-G127 WeakPolarHBondContact OG-CA 3.18Å; S124-G127 PolarHBondContact OG-N 3.37Å; S124-R129 WeakPolarHBondContact CB-O 3.37Å; S124-R129 PolarHBondContact OG-O 3.42Å; S124-R163 PolarHBondContact O-N 2.84Å; S124-L164 PolarHBondContact N-O 2.91Å; S124-L164 PolarHBondContact O-N 2.9Å
125	R	94.8	Very high	93.7	Very high	22 Å²	22	46.6 Å²	46.6	8%	0.083	23%	0.23	C	C	.	.	S	Bend	trans	-92.5	-34.4	176.1	-72.1	-172.9	-79.3	-82	5.2	111.9	L95 I161 V193 D218	L95-R125 HydrophobicContact CD2-CB 3.84Å; L95-R125 HydrophobicContact CD2-CG 3.82Å; R125-I161 WeakPolarHBondContact CD-O 3.35Å; R125-I161 WeakPolarHBondContact CG-O 3.4Å; R125-I161 PolarHBondContact NH1-O 2.99Å; R125-I161 VanDerWaalsContact NH1-O 3.08Å; R125-V193 HydrophobicContact CB-CG1 4.41Å; R125-V193 PolarHBondContact NE-O 3.37Å; R125-D218 IonicContact CZ-OD1 3.51Å; R125-D218 IonicContact CZ-OD2 2.68Å; R125-D218 IonicContact NH1-OD1 2.64Å; R125-D218 IonicContact NH1-OD2 3.79Å; R125-D218 PolarHBondContact NH1-OD2 3.46Å; R125-D218 IonicContact NH2-OD1 2.91Å; R125-D218 PolarHBondContact NH2-OD1 3.48Å; R125-D218 IonicContact NH2-OD2 3.5Å; R125-D218 PolarHBondContact NH2-OD2 3.42Å
126	D	89.2	Confident	93.4	Very high	78 Å²	78	47 Å²	47	42%	0.417	23%	0.231	S	C	.	.	S	Bend	trans	-101.9	-40.9	-177.4	65.6	-31.9	0	0	0	112.8	S124 S128 R129 R163	S124-D126 PolarHBondContact OG-OD1 3.03Å; D126-S128 VanDerWaalsContact CG-N 3.3Å; D126-S128 PolarHBondContact OD1-N 3.39Å; D126-S128 WeakPolarHBondContact OD2-CB 3.38Å; D126-S128 PolarHBondContact OD2-N 2.79Å; D126-S128 VanDerWaalsContact OD2-N 3.17Å; D126-S128 PolarHBondContact OD2-OG 2.68Å; D126-R129 PolarHBondContact OD1-N 3Å; D126-R129 PolarHBondContact OD2-N 3.2Å; D126-R163 PolarHBondContact O-NH2 3.01Å
127	G	90.3	Very high	93.1	Very high	28 Å²	28	53.2 Å²	53.2	29%	0.289	26%	0.26	S	S	.	.	S	Bend	trans	114.1	-16.2	-172	0	0	0	0	0	113.7	S124 W130	S124-G127 WeakPolarHBondContact OG-CA 3.18Å; S124-G127 PolarHBondContact OG-N 3.37Å; G127-W130 PolarHBondContact O-NE1 3.47Å
128	S	89.7	Confident	92.9	Very high	100 Å²	100	50.2 Å²	50.2	70%	0.699	26%	0.257	S	S	*	.	S	Bend	trans	-95.3	-43.3	177.7	90.8	0	0	0	0	112.2	D126	D126-S128 VanDerWaalsContact CG-N 3.3Å; D126-S128 PolarHBondContact OD1-N 3.39Å; D126-S128 WeakPolarHBondContact OD2-CB 3.38Å; D126-S128 PolarHBondContact OD2-N 2.79Å; D126-S128 VanDerWaalsContact OD2-N 3.17Å; D126-S128 PolarHBondContact OD2-OG 2.68Å
129	R	91.9	Very high	92.8	Very high	84 Å²	84	51.3 Å²	51.3	32%	0.317	26%	0.259	S	S	.	.			trans	-90.8	111.3	180	-175.7	-177.6	-178.9	126.7	-7.4	110.1	S124 D126 I131 E227	S124-R129 WeakPolarHBondContact CB-O 3.37Å; S124-R129 PolarHBondContact OG-O 3.42Å; D126-R129 PolarHBondContact OD1-N 3Å; D126-R129 PolarHBondContact OD2-N 3.2Å; R129-I131 HydrophobicContact CG-CG1 4.46Å; R129-E227 IonicContact CZ-OE2 2.76Å; R129-E227 IonicContact NH1-OE2 3.12Å; R129-E227 PolarHBondContact NH1-OE2 2.87Å
130	W	93.7	Very high	92.8	Very high	61 Å²	61	54.1 Å²	54.1	23%	0.231	27%	0.272	C	S	.	.			trans	-104.1	113.5	179.5	-74.2	86.8	0	0	0	112	Q89 K122 G127 L164 R166	Q89-W130 HydrophobicContact CG-CH2 4.27Å; K122-W130 HydrophobicContact CB-CE3 4.1Å; G127-W130 PolarHBondContact O-NE1 3.47Å; W130-L164 HydrophobicContact CH2-CB 3.56Å; W130-L164 HydrophobicContact CH2-CD2 4.34Å; W130-L164 HydrophobicContact CZ2-CB 4.12Å; W130-L164 HydrophobicContact CZ2-CD2 4.16Å; W130-L164 HydrophobicContact CZ3-CB 4.32Å; W130-R166 HydrophobicContact CE3-CG 4.34Å; W130-R166 HydrophobicContact CH2-CG 3.76Å; W130-R166 VanDerWaalsContact CZ2-CZ 3.46Å; W130-R166 HydrophobicContact CZ3-CB 4.04Å; W130-R166 HydrophobicContact CZ3-CG 3.55Å
131	I	95.3	Very high	92.7	Very high	22 Å²	22	53.7 Å²	53.7	11%	0.113	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	143.4	-178.9	-61.5	168.6	0	0	0	108.5	K122 Y123 R129 D218	K122-I131 CarbonylContact C-O 3.58Å; K122-I131 WeakPolarHBondContact CA-O 3.3Å; K122-I131 WeakPolarHBondContact CB-O 3.39Å; Y123-I131 HydrophobicContact CD1-CB 4.49Å; Y123-I131 HydrophobicContact CD1-CG2 4.48Å; Y123-I131 HydrophobicContact CD2-CB 4.27Å; Y123-I131 HydrophobicContact CE1-CB 4.17Å; Y123-I131 HydrophobicContact CE1-CG2 3.75Å; Y123-I131 HydrophobicContact CE2-CB 3.93Å; Y123-I131 HydrophobicContact CE2-CD1 3.85Å; Y123-I131 HydrophobicContact CE2-CG1 4.47Å; Y123-I131 HydrophobicContact CE2-CG2 4.02Å; Y123-I131 VanDerWaalsContact CZ-CG2 3.49Å; Y123-I131 PolarHBondContact N-O 2.97Å; Y123-I131 PolarHBondContact O-N 2.91Å; Y123-I131 WeakPolarHBondContact OH-CG2 3.21Å; R129-I131 HydrophobicContact CG-CG1 4.46Å; I131-D218 HydrophobicContact CD1-CB 4.09Å; I131-D218 WeakPolarHBondContact CD1-OD2 3.46Å; I131-D218 HydrophobicContact CG2-CB 4.01Å
132	S	95	Very high	92.6	Very high	45 Å²	45	54.2 Å²	54.2	32%	0.315	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	116.9	174.7	-54.2	0	0	0	0	109.6	K122	K122-S132 WeakPolarHBondContact CE-OG 3.44Å
133	W	96.6	Very high	92.4	Very high	18 Å²	18	55.3 Å²	55.3	7%	0.068	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-62.7	146.3	-177.3	-179.4	85.5	0	0	0	111.6	I121 Y123 N135 I142 M156 P158 I160	I121-W133 HydrophobicContact CB-CB 4.3Å; I121-W133 HydrophobicContact CG2-CB 4.27Å; I121-W133 PolarHBondContact O-N 2.92Å; Y123-W133 HydrophobicContact CD1-CB 4.2Å; Y123-W133 HydrophobicContact CE1-CB 4Å; W133-N135 HydrophobicContact CH2-CB 3.53Å; W133-N135 HydrophobicContact CZ2-CB 4.01Å; W133-N135 HydrophobicContact CZ3-CB 4.11Å; W133-I142 HydrophobicContact CE3-CD1 3.88Å; W133-I142 HydrophobicContact CE3-CG1 4.08Å; W133-I142 HydrophobicContact CH2-CG1 4.49Å; W133-I142 HydrophobicContact CZ3-CD1 3.8Å; W133-I142 HydrophobicContact CZ3-CG1 3.61Å; W133-M156 HydrophobicContact CD2-CE 3.55Å; W133-M156 HydrophobicContact CE3-CE 4.08Å; W133-M156 HydrophobicContact CG-CE 3.81Å; W133-M156 HydrophobicContact CH2-CE 4.4Å; W133-M156 HydrophobicContact CZ2-CE 3.96Å; W133-M156 HydrophobicContact CZ3-CE 4.48Å; W133-P158 PolarHBondContact NE1-O 2.94Å; W133-I160 HydrophobicContact CB-CD1 4.13Å; W133-I160 HydrophobicContact CG-CD1 3.96Å; W133-I160 HydrophobicContact CG-CG1 4.35Å
134	R	94.1	Very high	92.1	Very high	142 Å²	142	54.9 Å²	54.9	54%	0.536	28%	0.282	S	S	.	.			trans	-137.3	140.2	175.7	-62.2	171.9	-168.9	-112.3	9.4	107.2	K139 Q140 P158	R134-K139 WeakPolarHBondContact CA-O 3.35Å; R134-Q140 HydrophobicContact CG-CG 3.8Å; R134-P158 WeakPolarHBondContact O-CD 3.36Å
135	N	90.3	Very high	92	Very high	38 Å²	38	55.1 Å²	55.1	20%	0.203	28%	0.284	C	S	.	.			trans	-68.5	171.6	168.6	77.5	-5.6	0	0	0	111.3	W133 Q137 G138 K139 Q157	W133-N135 HydrophobicContact CH2-CB 3.53Å; W133-N135 HydrophobicContact CZ2-CB 4.01Å; W133-N135 HydrophobicContact CZ3-CB 4.11Å; N135-Q137 VanDerWaalsContact CG-OE1 3.25Å; N135-Q137 PolarHBondContact ND2-OE1 3.02Å; N135-Q137 PolarHBondContact O-N 3.15Å; N135-Q137 VanDerWaalsContact OD1-C 3.3Å; N135-Q137 WeakPolarHBondContact OD1-CA 3.18Å; N135-Q137 PolarHBondContact OD1-N 3.15Å; N135-Q137 PolarHBondContact OD1-OE1 3.02Å; N135-G138 PolarHBondContact O-N 3.43Å; N135-G138 PolarHBondContact OD1-N 3.36Å; N135-G138 VanDerWaalsContact OD1-N 3.13Å; N135-K139 PolarHBondContact N-O 2.84Å; N135-K139 WeakPolarHBondContact OD1-CB 3.25Å; N135-K139 PolarHBondContact OD1-N 2.8Å; N135-Q157 VanDerWaalsContact CA-O 3.27Å; N135-Q157 WeakPolarHBondContact CA-O 3.45Å
136	R	87	Confident	91.7	Very high	34 Å²	34	64.1 Å²	64.1	13%	0.128	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-7.7	177	-61.4	-173.9	-173.8	-77.7	3	115	Q157 V216 D234 Y254	R136-Q157 PolarHBondContact N-O 2.6Å; R136-Q157 VanDerWaalsContact N-O 3.17Å; R136-V216 HydrophobicContact CG-CG1 4.27Å; R136-D234 IonicContact CZ-OD2 2.73Å; R136-D234 VanDerWaalsContact CZ-OD2 3.24Å; R136-D234 IonicContact NH1-OD2 2.68Å; R136-D234 PolarHBondContact NH1-OD2 3.28Å; R136-D234 IonicContact NH2-OD1 2.72Å; R136-D234 IonicContact NH2-OD2 3.84Å; R136-D234 PolarHBondContact NH2-OD2 3.48Å; R136-Y254 VanDerWaalsContact CD-OH 3.28Å; R136-Y254 WeakPolarHBondContact CD-OH 3.36Å; R136-Y254 WeakPolarHBondContact CG-OH 3.19Å; R136-Y254 PolarHBondContact NH1-OH 3.48Å
137	Q	85.2	Confident	91.7	Very high	130 Å²	130	61.7 Å²	61.7	61%	0.607	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	13	172.1	-55.1	82.4	26.6	0	0	113.4	N135 K139	N135-Q137 VanDerWaalsContact CG-OE1 3.25Å; N135-Q137 PolarHBondContact ND2-OE1 3.02Å; N135-Q137 PolarHBondContact O-N 3.15Å; N135-Q137 VanDerWaalsContact OD1-C 3.3Å; N135-Q137 WeakPolarHBondContact OD1-CA 3.18Å; N135-Q137 PolarHBondContact OD1-N 3.15Å; N135-Q137 PolarHBondContact OD1-OE1 3.02Å; Q137-K139 VanDerWaalsContact C-N 3.35Å; Q137-K139 PolarHBondContact O-N 2.97Å
138	G	87.9	Confident	91.5	Very high	40 Å²	40	60.9 Å²	60.9	41%	0.412	29%	0.294	S	S	.	.	S	Bend	trans	81.6	-1.4	175.9	0	0	0	0	0	116.3	N135	N135-G138 PolarHBondContact O-N 3.43Å; N135-G138 PolarHBondContact OD1-N 3.36Å; N135-G138 VanDerWaalsContact OD1-N 3.13Å
139	K	90.5	Very high	91.2	Very high	103 Å²	103	62.3 Å²	62.3	45%	0.448	29%	0.285	S	S	.	.			trans	-75.7	127.9	-178.8	-170	-167.2	-179.2	-158.3	0	110.6	R134 N135 Q137 V141	R134-K139 WeakPolarHBondContact CA-O 3.35Å; N135-K139 PolarHBondContact N-O 2.84Å; N135-K139 WeakPolarHBondContact OD1-CB 3.25Å; N135-K139 PolarHBondContact OD1-N 2.8Å; Q137-K139 VanDerWaalsContact C-N 3.35Å; Q137-K139 PolarHBondContact O-N 2.97Å; K139-V141 WeakPolarHBondContact CE-O 3.46Å; K139-V141 PolarHBondContact NZ-O 2.69Å
140	Q	92.8	Very high	90.9	Very high	60 Å²	60	62.8 Å²	62.8	28%	0.28	29%	0.294	S	S	.	.			trans	-90.1	-22.6	177.1	-67.1	-178.2	-13.6	0	0	114.6	R134	R134-Q140 HydrophobicContact CG-CG 3.8Å
141	V	93.4	Very high	90.6	Very high	42 Å²	42	62.9 Å²	62.9	26%	0.255	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-88.8	117.4	-172.8	-179	0	0	0	0	110.4	M118 K120 K139	M118-V141 HydrophobicContact CB-CG1 3.95Å; M118-V141 HydrophobicContact CG-CG1 4.02Å; M118-V141 HydrophobicContact SD-CG1 3.78Å; K120-V141 HydrophobicContact CG-CG2 4.34Å; K139-V141 WeakPolarHBondContact CE-O 3.46Å; K139-V141 PolarHBondContact NZ-O 2.69Å
142	I	95	Very high	90.5	Very high	12 Å²	12	62.7 Å²	62.7	6%	0.062	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	139.2	174	-56.3	167.3	0	0	0	107.8	M118 Y119 I121 W133 R154 M156	M118-I142 VanDerWaalsContact CA-O 3.31Å; M118-I142 WeakPolarHBondContact CA-O 3.16Å; Y119-I142 HydrophobicContact CD2-CB 4Å; Y119-I142 HydrophobicContact CD2-CD1 4.09Å; Y119-I142 HydrophobicContact CD2-CG2 4.39Å; Y119-I142 HydrophobicContact CE1-CG2 4.1Å; Y119-I142 HydrophobicContact CE2-CB 3.73Å; Y119-I142 HydrophobicContact CE2-CD1 3.63Å; Y119-I142 HydrophobicContact CE2-CG1 4.28Å; Y119-I142 HydrophobicContact CE2-CG2 3.66Å; Y119-I142 VanDerWaalsContact CZ-CG2 3.49Å; Y119-I142 PolarHBondContact N-O 2.77Å; Y119-I142 PolarHBondContact O-N 3.47Å; I121-I142 HydrophobicContact CB-CD1 4.37Å; I121-I142 HydrophobicContact CD1-CD1 3.8Å; I121-I142 HydrophobicContact CG1-CD1 4Å; W133-I142 HydrophobicContact CE3-CD1 3.88Å; W133-I142 HydrophobicContact CE3-CG1 4.08Å; W133-I142 HydrophobicContact CH2-CG1 4.49Å; W133-I142 HydrophobicContact CZ3-CD1 3.8Å; W133-I142 HydrophobicContact CZ3-CG1 3.61Å; I142-R154 HydrophobicContact CG2-CB 4.05Å; I142-R154 HydrophobicContact CG2-CG 3.8Å; I142-M156 HydrophobicContact CD1-CE 4.21Å
143	E	93.6	Very high	90.4	Very high	88 Å²	88	64.4 Å²	64.4	41%	0.411	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	125.6	171.1	-72.1	167.8	-155.9	0	0	109.9	R154	E143-R154 PolarHBondContact O-NE 2.8Å; E143-R154 PolarHBondContact O-NH2 3.19Å; E143-R154 IonicContact OE2-CZ 3.57Å; E143-R154 IonicContact OE2-NH1 3.79Å; E143-R154 IonicContact OE2-NH2 3.48Å; E143-R154 PolarHBondContact OE2-NH2 3.29Å
144	G	91.8	Very high	90.2	Very high	5 Å²	5	67.4 Å²	67.4	5%	0.052	32%	0.316	C	S	.	.			trans	-95.4	-129.6	174.6	0	0	0	0	0	112.8	A116 Q117	A116-G144 WeakPolarHBondContact O-CA 3.39Å; Q117-G144 PolarHBondContact O-N 2.99Å
145	N	93.2	Very high	90	Very high	6 Å²	6	64.3 Å²	64.3	3%	0.032	31%	0.311	C	S	.	.			trans	-86	163.3	-166.9	-60.4	90	0	0	0	113.7	T103 Q104 F115 A116 N147 D150 A152	T103-N145 PolarHBondContact O-ND2 2.97Å; T103-N145 PolarHBondContact O-OD1 3.2Å; T103-N145 PolarHBondContact OG1-OD1 2.83Å; Q104-N145 WeakPolarHBondContact CA-ND2 3.36Å; Q104-N145 PolarHBondContact N-OD1 3.04Å; F115-N145 HydrophobicContact CB-CB 4.21Å; F115-N145 HydrophobicContact CD2-CB 3.9Å; F115-N145 WeakPolarHBondContact CD2-O 3.4Å; F115-N145 WeakPolarHBondContact CE2-O 3.38Å; F115-N145 HydrophobicContact CG-CB 4.42Å; A116-N145 PolarHBondContact O-N 3.27Å; N145-N147 WeakPolarHBondContact CB-O 3.44Å; N145-D150 PolarHBondContact ND2-O 3.45Å; N145-A152 WeakPolarHBondContact ND2-CB 3.42Å; N145-A152 PolarHBondContact ND2-N 2.97Å
146	R	90.3	Very high	90.2	Very high	210 Å²	210	62.7 Å²	62.7	79%	0.792	30%	0.302	S	S	*	.	S	Bend	trans	-118.7	-6.1	175.2	-63.2	-175.6	178.5	-167.5	-0.8	113.6	F115	F115-R146 WeakPolarHBondContact CZ-O 3.48Å
147	N	87.8	Confident	90.3	Very high	28 Å²	28	66.6 Å²	66.6	15%	0.15	32%	0.322	C	S	.	.	S	Bend	trans	-158.6	-173	177.1	58.8	45.1	0	0	0	108	F115 N145 Y149 D150	F115-N147 WeakPolarHBondContact CG-O 3.49Å; N145-N147 WeakPolarHBondContact CB-O 3.44Å; N147-Y149 HydrophobicContact CB-CD1 4.22Å; N147-Y149 HydrophobicContact CB-CE1 3.78Å; N147-Y149 WeakPolarHBondContact ND2-CE2 3.43Å; N147-Y149 VanDerWaalsContact ND2-CZ 3.3Å; N147-Y149 PolarHBondContact ND2-OH 2.97Å; N147-Y149 PolarHBondContact OD1-N 3.47Å; N147-D150 PolarHBondContact ND2-OD2 2.87Å; N147-D150 WeakPolarHBondContact OD1-CB 3.4Å; N147-D150 PolarHBondContact OD1-N 3.28Å
148	T	86.9	Confident	90.7	Very high	11 Å²	11	61 Å²	61	7%	0.067	30%	0.296	C	S	.	.	S	Bend	trans	-93.2	-12.1	-175.6	48.3	0	0	0	0	116.2	G105 R106 G112 F115	G105-T148 CarbonylContact C-O 3.57Å; G105-T148 PolarHBondContact N-O 2.94Å; R106-T148 WeakPolarHBondContact O-CB 3.45Å; R106-T148 WeakPolarHBondContact O-CG2 3.39Å; G112-T148 WeakPolarHBondContact O-CG2 3.48Å; G112-T148 PolarHBondContact O-OG1 2.72Å; G112-T148 VanDerWaalsContact O-OG1 3.07Å; F115-T148 HydrophobicContact CB-CG2 4.31Å; F115-T148 HydrophobicContact CD1-CG2 3.81Å
149	Y	82.6	Confident	91	Very high	130 Å²	130	60 Å²	60	51%	0.51	28%	0.283	S	S	.	.	S	Bend	trans	-110.7	-37.5	-170.8	51.3	-95	0	0	0	113.9	Q104 N147	Q104-Y149 PolarHBondContact NE2-O 3.36Å; N147-Y149 HydrophobicContact CB-CD1 4.22Å; N147-Y149 HydrophobicContact CB-CE1 3.78Å; N147-Y149 WeakPolarHBondContact ND2-CE2 3.43Å; N147-Y149 VanDerWaalsContact ND2-CZ 3.3Å; N147-Y149 PolarHBondContact ND2-OH 2.97Å; N147-Y149 PolarHBondContact OD1-N 3.47Å
150	D	85.3	Confident	91.2	Very high	93 Å²	93	55.2 Å²	55.2	50%	0.497	26%	0.262	S	S	.	.	S	Bend	trans	-71.9	132	-178	-71.9	-33.6	0	0	0	111.6	N145 N147 A152	N145-D150 PolarHBondContact ND2-O 3.45Å; N147-D150 PolarHBondContact ND2-OD2 2.87Å; N147-D150 WeakPolarHBondContact OD1-CB 3.4Å; N147-D150 PolarHBondContact OD1-N 3.28Å; D150-A152 PolarHBondContact O-N 2.99Å
151	I	89.4	Confident	91.3	Very high	64 Å²	64	52.8 Å²	52.8	33%	0.328	25%	0.251	S	S	.	.			trans	-76	114.4	173.6	-57.6	164.2	0	0	0	109.6	L64 D65 L153	L64-I151 HydrophobicContact CD1-CG1 4.45Å; L64-I151 HydrophobicContact CD1-CG2 4.22Å; L64-I151 HydrophobicContact CD2-CD1 3.99Å; L64-I151 HydrophobicContact CD2-CG1 4.24Å; L64-I151 HydrophobicContact CD2-CG2 3.95Å; L64-I151 HydrophobicContact CG-CG1 4.42Å; D65-I151 WeakPolarHBondContact OD2-CD1 3.37Å; I151-L153 HydrophobicContact CG2-CD2 3.7Å; I151-L153 HydrophobicContact CG2-CG 3.99Å; I151-L153 PolarHBondContact O-N 2.85Å
152	A	91.6	Very high	91.5	Very high	17 Å²	17	50.8 Å²	50.8	14%	0.14	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	95.8	171.6	0	0	0	0	0	110.1	T103 N145 D150	T103-A152 PolarHBondContact N-O 3.45Å; T103-A152 PolarHBondContact O-N 3.12Å; T103-A152 PolarHBondContact OG1-O 3.12Å; T103-A152 VanDerWaalsContact OG1-O 3.1Å; N145-A152 WeakPolarHBondContact ND2-CB 3.42Å; N145-A152 PolarHBondContact ND2-N 2.97Å; D150-A152 PolarHBondContact O-N 2.99Å
153	L	92.5	Very high	91.5	Very high	82 Å²	82	53.2 Å²	53.2	43%	0.429	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	134.2	172.4	-62.3	178.2	0	0	0	110.8	L100 V101 I151 Y184	L100-L153 HydrophobicContact CD1-CB 4.14Å; L100-L153 HydrophobicContact CD2-CD2 4.2Å; V101-L153 CarbonylContact O-C 3.53Å; V101-L153 WeakPolarHBondContact O-CA 3.43Å; I151-L153 HydrophobicContact CG2-CD2 3.7Å; I151-L153 HydrophobicContact CG2-CG 3.99Å; I151-L153 PolarHBondContact O-N 2.85Å; L153-Y184 HydrophobicContact CD2-CE2 3.76Å
154	R	93.3	Very high	91.8	Very high	80 Å²	80	49.4 Å²	49.4	30%	0.302	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	128.2	179	-63.9	-63.8	-175.9	168.3	2.5	112.2	L100 V101 I142 E143	L100-R154 WeakPolarHBondContact CA-O 3.47Å; L100-R154 VanDerWaalsContact CD1-O 3.3Å; L100-R154 WeakPolarHBondContact CD1-O 3.37Å; V101-R154 HydrophobicContact CG2-CB 4.24Å; V101-R154 PolarHBondContact N-O 2.9Å; V101-R154 PolarHBondContact O-N 3.43Å; I142-R154 HydrophobicContact CG2-CB 4.05Å; I142-R154 HydrophobicContact CG2-CG 3.8Å; E143-R154 PolarHBondContact O-NE 2.8Å; E143-R154 PolarHBondContact O-NH2 3.19Å; E143-R154 IonicContact OE2-CZ 3.57Å; E143-R154 IonicContact OE2-NH1 3.79Å; E143-R154 IonicContact OE2-NH2 3.48Å; E143-R154 PolarHBondContact OE2-NH2 3.29Å
155	D	90.5	Very high	92.1	Very high	78 Å²	78	49.3 Å²	49.3	42%	0.417	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	130.8	177.2	-80	-74.2	0	0	0	112.3	R32 Q157	R32-D155 IonicContact CZ-OD1 3.66Å; R32-D155 IonicContact NH1-OD1 3.99Å; R32-D155 PolarHBondContact NH1-OD1 3.36Å; R32-D155 IonicContact NH2-OD1 3.33Å; R32-D155 PolarHBondContact NH2-OD1 2.84Å; R32-D155 IonicContact NH2-OD2 3.64Å; D155-Q157 HydrophobicContact CB-CG 4.25Å; D155-Q157 PolarHBondContact O-N 2.74Å
156	M	93.1	Very high	92.3	Very high	4 Å²	4	51.5 Å²	51.5	2%	0.02	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	99.6	172.5	-53.5	-48	-69.4	0	0	107.9	T99 V101 I121 W133 I142 P158 P159 I160	T99-M156 PolarHBondContact O-N 2.83Å; V101-M156 HydrophobicContact CG1-CG 4.38Å; V101-M156 HydrophobicContact CG1-SD 4.14Å; V101-M156 HydrophobicContact CG2-SD 3.84Å; I121-M156 HydrophobicContact CD1-CE 3.76Å; I121-M156 HydrophobicContact CD1-SD 4.17Å; W133-M156 HydrophobicContact CD2-CE 3.55Å; W133-M156 HydrophobicContact CE3-CE 4.08Å; W133-M156 HydrophobicContact CG-CE 3.81Å; W133-M156 HydrophobicContact CH2-CE 4.4Å; W133-M156 HydrophobicContact CZ2-CE 3.96Å; W133-M156 HydrophobicContact CZ3-CE 4.48Å; I142-M156 HydrophobicContact CD1-CE 4.21Å; M156-P158 CarbonylContact C-O 3.57Å; M156-P158 CarbonylContact O-C 3.51Å; M156-P159 WeakPolarHBondContact O-CA 3.46Å; M156-I160 HydrophobicContact CE-CD1 3.57Å; M156-I160 HydrophobicContact CE-CG1 4.41Å
157	Q	90.6	Very high	92.6	Very high	116 Å²	116	41.5 Å²	41.5	54%	0.542	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	97.6	174.8	-63.8	-176.2	7.1	0	0	109.8	N135 R136 D155	N135-Q157 VanDerWaalsContact CA-O 3.27Å; N135-Q157 WeakPolarHBondContact CA-O 3.45Å; R136-Q157 PolarHBondContact N-O 2.6Å; R136-Q157 VanDerWaalsContact N-O 3.17Å; D155-Q157 HydrophobicContact CB-CG 4.25Å; D155-Q157 PolarHBondContact O-N 2.74Å
158	P	92.4	Very high	92.9	Very high	11 Å²	11	40.9 Å²	40.9	7%	0.071	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-71.5	159.1	6	35.2	-41.5	0	0	0	113.8	W133 R134 M156 V216	W133-P158 PolarHBondContact NE1-O 2.94Å; R134-P158 WeakPolarHBondContact O-CD 3.36Å; M156-P158 CarbonylContact C-O 3.57Å; M156-P158 CarbonylContact O-C 3.51Å; P158-V216 HydrophobicContact CB-CB 4.15Å; P158-V216 HydrophobicContact CB-CG1 4.17Å; P158-V216 HydrophobicContact CB-CG2 4.1Å; P158-V216 HydrophobicContact CG-CB 3.94Å; P158-V216 HydrophobicContact CG-CG1 4.07Å; P158-V216 HydrophobicContact CG-CG2 4.37Å
159	P	94.1	Very high	93.2	Very high	20 Å²	20	40.6 Å²	40.6	13%	0.13	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	167.4	165.2	-24.6	36.3	0	0	0	112.8	P28 F97 I98 T99 M156	P28-P159 HydrophobicContact CB-CG 4.39Å; P28-P159 HydrophobicContact CG-CG 4.45Å; F97-P159 HydrophobicContact CD1-CB 4.3Å; F97-P159 HydrophobicContact CE1-CB 3.63Å; F97-P159 HydrophobicContact CE1-CG 3.88Å; F97-P159 HydrophobicContact CE2-CB 4.22Å; F97-P159 HydrophobicContact CZ-CB 3.58Å; F97-P159 HydrophobicContact CZ-CG 3.76Å; I98-P159 WeakPolarHBondContact O-CA 3.31Å; I98-P159 WeakPolarHBondContact O-CB 3.35Å; T99-P159 HydrophobicContact CG2-CB 4.42Å; M156-P159 WeakPolarHBondContact O-CA 3.46Å
160	I	94.8	Very high	93.5	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	130.6	179.1	-69	171.9	0	0	0	109.9	I98 I121 Y123 W133 M156 A162	I98-I160 HydrophobicContact CB-CB 4.29Å; I98-I160 HydrophobicContact CD1-CG2 4.39Å; I98-I160 PolarHBondContact N-O 3.05Å; I98-I160 PolarHBondContact O-N 2.6Å; I121-I160 HydrophobicContact CG2-CD1 3.84Å; Y123-I160 HydrophobicContact CD1-CD1 3.69Å; Y123-I160 HydrophobicContact CD1-CG1 3.95Å; Y123-I160 HydrophobicContact CD1-CG2 3.81Å; Y123-I160 HydrophobicContact CD2-CG2 3.61Å; Y123-I160 HydrophobicContact CE1-CD1 4.06Å; Y123-I160 HydrophobicContact CE1-CG1 3.89Å; Y123-I160 HydrophobicContact CE1-CG2 4.18Å; Y123-I160 HydrophobicContact CE2-CG2 4Å; Y123-I160 HydrophobicContact CG-CD1 4.34Å; Y123-I160 HydrophobicContact CG-CG2 3.49Å; Y123-I160 VanDerWaalsContact CG-CG2 3.49Å; W133-I160 HydrophobicContact CB-CD1 4.13Å; W133-I160 HydrophobicContact CG-CD1 3.96Å; W133-I160 HydrophobicContact CG-CG1 4.35Å; M156-I160 HydrophobicContact CE-CD1 3.57Å; M156-I160 HydrophobicContact CE-CG1 4.41Å; I160-A162 HydrophobicContact CG2-CB 3.53Å
161	I	96.3	Very high	93.1	Very high	10 Å²	10	33.2 Å²	33.2	5%	0.051	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	109.9	164.9	-63.2	162.9	0	0	0	108.2	H96 F97 R125 W188 L229	H96-I161 WeakPolarHBondContact O-CA 3.39Å; F97-I161 HydrophobicContact CD2-CD1 3.96Å; F97-I161 HydrophobicContact CD2-CG1 3.6Å; F97-I161 HydrophobicContact CE2-CD1 4.24Å; F97-I161 HydrophobicContact CE2-CG1 4.2Å; F97-I161 HydrophobicContact CG-CG1 4.48Å; R125-I161 WeakPolarHBondContact CD-O 3.35Å; R125-I161 WeakPolarHBondContact CG-O 3.4Å; R125-I161 PolarHBondContact NH1-O 2.99Å; R125-I161 VanDerWaalsContact NH1-O 3.08Å; I161-W188 HydrophobicContact CD1-CD2 4.13Å; I161-W188 HydrophobicContact CD1-CE3 4.2Å; I161-W188 HydrophobicContact CD1-CH2 3.67Å; I161-W188 HydrophobicContact CD1-CZ2 3.58Å; I161-W188 HydrophobicContact CD1-CZ3 3.98Å; I161-W188 HydrophobicContact CG1-CD2 4.27Å; I161-W188 HydrophobicContact CG1-CE3 4.35Å; I161-W188 HydrophobicContact CG2-CD2 4.15Å; I161-W188 HydrophobicContact CG2-CG 3.91Å; I161-L229 HydrophobicContact CB-CD1 3.82Å; I161-L229 HydrophobicContact CD1-CD1 3.8Å; I161-L229 HydrophobicContact CG1-CD1 4.42Å; I161-L229 HydrophobicContact CG2-CD1 3.74Å
162	A	96.8	Very high	92.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	160.7	-172.6	0	0	0	0	0	113.2	H96 I98 Y123 I160 V165	H96-A162 PolarHBondContact N-O 3.07Å; H96-A162 PolarHBondContact O-N 3.21Å; H96-A162 VanDerWaalsContact O-N 3.08Å; I98-A162 HydrophobicContact CD1-CB 4.34Å; Y123-A162 HydrophobicContact CD2-CB 3.95Å; Y123-A162 HydrophobicContact CG-CB 4.26Å; I160-A162 HydrophobicContact CG2-CB 3.53Å; A162-V165 HydrophobicContact CB-CG2 4.27Å
163	R	95.9	Very high	90.9	Very high	63 Å²	63	41.8 Å²	41.8	24%	0.238	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-38.9	165.9	178.8	178.7	76.2	87.6	-7.7	111.1	D91 L92 R93 L95 S124 D126	D91-R163 IonicContact OD1-CZ 3.47Å; D91-R163 IonicContact OD1-NH1 2.74Å; D91-R163 PolarHBondContact OD1-NH1 2.94Å; D91-R163 IonicContact OD2-CZ 3.21Å; D91-R163 IonicContact OD2-NH1 2.74Å; D91-R163 PolarHBondContact OD2-NH1 2.96Å; L92-R163 WeakPolarHBondContact CB-O 3.48Å; L92-R163 PolarHBondContact N-O 2.81Å; R93-R163 WeakPolarHBondContact O-CD 3.48Å; L95-R163 HydrophobicContact CD2-CB 4.12Å; S124-R163 PolarHBondContact O-N 2.84Å; D126-R163 PolarHBondContact O-NH2 3.01Å
164	L	98.1	Very high	89.6	Confident	8 Å²	8	42 Å²	42	4%	0.042	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	141.1	177.8	-43.1	88.5	0	0	0	110.6	I90 D91 Y123 S124 W130	I90-L164 VanDerWaalsContact O-CA 3.31Å; I90-L164 WeakPolarHBondContact O-CA 3.49Å; D91-L164 HydrophobicContact CB-CD2 4.44Å; D91-L164 HydrophobicContact CB-CG 4.5Å; Y123-L164 CarbonylContact C-O 3.53Å; Y123-L164 VanDerWaalsContact CA-O 3.28Å; Y123-L164 WeakPolarHBondContact CA-O 3.25Å; S124-L164 PolarHBondContact N-O 2.91Å; S124-L164 PolarHBondContact O-N 2.9Å; W130-L164 HydrophobicContact CH2-CB 3.56Å; W130-L164 HydrophobicContact CH2-CD2 4.34Å; W130-L164 HydrophobicContact CZ2-CB 4.12Å; W130-L164 HydrophobicContact CZ2-CD2 4.16Å; W130-L164 HydrophobicContact CZ3-CB 4.32Å
165	V	98.4	Very high	88.4	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.012	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	142.3	177.2	-175.5	0	0	0	0	109.9	Q89 I90 I98 I121 A162 F167 L183	Q89-V165 CarbonylContact C-O 3.55Å; Q89-V165 VanDerWaalsContact CA-O 3.29Å; Q89-V165 WeakPolarHBondContact CA-O 3.36Å; I90-V165 PolarHBondContact N-O 2.82Å; I90-V165 PolarHBondContact O-N 2.68Å; I98-V165 HydrophobicContact CD1-CG2 3.59Å; I121-V165 HydrophobicContact CG2-CG1 3.91Å; A162-V165 HydrophobicContact CB-CG2 4.27Å; V165-F167 HydrophobicContact CG1-CE2 4.24Å; V165-L183 HydrophobicContact CB-CD2 3.77Å; V165-L183 HydrophobicContact CG1-CD2 3.9Å; V165-L183 HydrophobicContact CG2-CD2 3.63Å
166	R	97.8	Very high	88	Confident	52 Å²	52	41.8 Å²	41.8	20%	0.196	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	116.1	176.3	-81.7	176.6	-176.3	164.7	1.6	110.3	F87 L88 Q89 I121 K122 W130 M168	F87-R166 HydrophobicContact CB-CB 4.08Å; F87-R166 HydrophobicContact CB-CG 4.1Å; F87-R166 HydrophobicContact CD2-CG 3.76Å; F87-R166 HydrophobicContact CE2-CG 4.37Å; F87-R166 HydrophobicContact CG-CB 4.43Å; F87-R166 HydrophobicContact CG-CG 3.92Å; L88-R166 CarbonylContact O-C 3.58Å; L88-R166 VanDerWaalsContact O-CA 3.28Å; L88-R166 WeakPolarHBondContact O-CA 3.42Å; Q89-R166 HydrophobicContact CB-CG 3.82Å; Q89-R166 HydrophobicContact CG-CG 4.01Å; I121-R166 WeakPolarHBondContact CA-O 3.48Å; K122-R166 HydrophobicContact CB-CB 4.22Å; K122-R166 PolarHBondContact N-O 3.34Å; K122-R166 PolarHBondContact O-N 2.6Å; W130-R166 HydrophobicContact CE3-CG 4.34Å; W130-R166 HydrophobicContact CH2-CG 3.76Å; W130-R166 VanDerWaalsContact CZ2-CZ 3.46Å; W130-R166 HydrophobicContact CZ3-CB 4.04Å; W130-R166 HydrophobicContact CZ3-CG 3.55Å; R166-M168 HydrophobicContact CB-CG 4.41Å
167	F	97.3	Very high	87.8	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	117.1	166.4	-70.2	-96.2	0	0	0	108.5	F87 L88 I90 V101 T103 Y119 I121 V165 M179 V181 L183	F87-F167 CarbonylContact C-O 3.47Å; F87-F167 VanDerWaalsContact CA-O 3.22Å; F87-F167 WeakPolarHBondContact CA-O 3.38Å; L88-F167 PolarHBondContact N-O 2.94Å; L88-F167 PolarHBondContact O-N 3.18Å; I90-F167 HydrophobicContact CD1-CD2 4.3Å; I90-F167 HydrophobicContact CD1-CE2 4.11Å; V101-F167 HydrophobicContact CB-CE1 3.88Å; V101-F167 HydrophobicContact CB-CZ 3.93Å; V101-F167 HydrophobicContact CG1-CE1 4.05Å; V101-F167 HydrophobicContact CG1-CZ 3.76Å; V101-F167 HydrophobicContact CG2-CE1 4.24Å; T103-F167 HydrophobicContact CG2-CD1 4.12Å; T103-F167 HydrophobicContact CG2-CE1 4Å; Y119-F167 HydrophobicContact CD2-CD1 4.24Å; Y119-F167 HydrophobicContact CE2-CD1 4.15Å; Y119-F167 HydrophobicContact CE2-CE1 4.32Å; I121-F167 HydrophobicContact CD1-CD1 4.33Å; I121-F167 HydrophobicContact CD1-CE1 3.99Å; I121-F167 HydrophobicContact CD1-CZ 4.5Å; I121-F167 HydrophobicContact CG1-CD1 4.27Å; I121-F167 HydrophobicContact CG1-CE1 4.42Å; V165-F167 HydrophobicContact CG1-CE2 4.24Å; F167-M179 HydrophobicContact CB-CE 4.22Å; F167-M179 HydrophobicContact CD1-CE 4.27Å; F167-V181 HydrophobicContact CB-CG1 4.41Å; F167-V181 HydrophobicContact CD1-CB 4.43Å; F167-V181 HydrophobicContact CD1-CG1 3.99Å; F167-V181 HydrophobicContact CD2-CB 4.21Å; F167-V181 HydrophobicContact CD2-CG1 4.18Å; F167-V181 HydrophobicContact CD2-CG2 3.89Å; F167-V181 HydrophobicContact CE1-CB 4.24Å; F167-V181 HydrophobicContact CE1-CG1 4.26Å; F167-V181 HydrophobicContact CE2-CB 4.02Å; F167-V181 HydrophobicContact CE2-CG1 4.45Å; F167-V181 HydrophobicContact CE2-CG2 3.78Å; F167-V181 HydrophobicContact CG-CB 4.41Å; F167-V181 HydrophobicContact CG-CG1 3.94Å; F167-V181 HydrophobicContact CG-CG2 4.49Å; F167-V181 HydrophobicContact CZ-CB 4.03Å; F167-V181 HydrophobicContact CZ-CG1 4.48Å; F167-V181 HydrophobicContact CZ-CG2 4.28Å; F167-L183 HydrophobicContact CE2-CD1 4.15Å; F167-L183 HydrophobicContact CE2-CD2 4.31Å; F167-L183 HydrophobicContact CE2-CG 4.09Å; F167-L183 HydrophobicContact CZ-CG 4.2Å
168	M	94.2	Very high	87.9	Confident	15 Å²	15	36.6 Å²	36.6	7%	0.074	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	101.4	-176.9	-51.7	-163.4	73.3	0	0	109.5	L84 E86 F87 Y119 K120 K122 R166	L84-M168 WeakPolarHBondContact O-CE 2.85Å; E86-M168 WeakPolarHBondContact O-CA 3.31Å; E86-M168 WeakPolarHBondContact O-CE 3.48Å; F87-M168 HydrophobicContact CB-CE 4.33Å; F87-M168 HydrophobicContact CB-CG 4.05Å; F87-M168 HydrophobicContact CD1-CE 4.44Å; Y119-M168 CarbonylContact C-O 3.47Å; Y119-M168 VanDerWaalsContact CA-O 3.22Å; Y119-M168 WeakPolarHBondContact CA-O 3.26Å; Y119-M168 WeakPolarHBondContact CB-O 3.43Å; K120-M168 HydrophobicContact CB-CB 4.39Å; K120-M168 PolarHBondContact N-O 3.04Å; K120-M168 WeakPolarHBondContact O-CB 3.37Å; K120-M168 PolarHBondContact O-N 2.87Å; K122-M168 HydrophobicContact CB-SD 4.4Å; K122-M168 HydrophobicContact CD-SD 3.51Å; K122-M168 VanDerWaalsContact CD-SD 3.51Å; K122-M168 VanDerWaalsContact CE-SD 3.51Å; K122-M168 HydrophobicContact CG-SD 3.75Å; R166-M168 HydrophobicContact CB-CG 4.41Å
169	P	92.1	Very high	88	Confident	6 Å²	6	36.1 Å²	36.1	4%	0.039	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	140.6	177.9	22.9	-32	0	0	0	111.3	W73 E86 A116 I171 V177 M179	W73-P169 HydrophobicContact CH2-CG 4.07Å; W73-P169 HydrophobicContact CZ3-CG 4.18Å; E86-P169 HydrophobicContact CB-CG 4.48Å; A116-P169 HydrophobicContact CB-CB 4.49Å; P169-I171 HydrophobicContact CB-CG1 4.25Å; P169-I171 HydrophobicContact CG-CG1 4.33Å; P169-I171 PolarHBondContact O-N 3.34Å; P169-V177 HydrophobicContact CB-CG1 3.66Å; P169-M179 HydrophobicContact CB-SD 3.86Å; P169-M179 HydrophobicContact CG-SD 4.25Å
170	V	88.3	Confident	88.1	Confident	47 Å²	47	35.2 Å²	35.2	29%	0.285	18%	0.181	S	C	.	.			trans	-88.4	98	166.2	178.5	0	0	0	0	106.9	M118 K120	M118-V170 HydrophobicContact CB-CB 3.9Å; M118-V170 HydrophobicContact CB-CG2 4.13Å; M118-V170 HydrophobicContact CE-CG1 4.41Å; M118-V170 PolarHBondContact O-N 3.12Å; K120-V170 HydrophobicContact CG-CG2 4.32Å
171	I	77.6	Confident	88.3	Confident	21 Å²	21	35.1 Å²	35.1	11%	0.108	18%	0.181	C	C	.	.			trans	-81.2	134.9	179	-53	176.6	0	0	0	108.9	P75 I77 E86 P169 V177	P75-I171 HydrophobicContact CG-CD1 4.07Å; I77-I171 HydrophobicContact CD1-CG2 4.3Å; I77-I171 HydrophobicContact CG1-CD1 4.48Å; E86-I171 HydrophobicContact CB-CD1 4.38Å; E86-I171 HydrophobicContact CG-CD1 4.22Å; P169-I171 HydrophobicContact CB-CG1 4.25Å; P169-I171 HydrophobicContact CG-CG1 4.33Å; P169-I171 PolarHBondContact O-N 3.34Å; I171-V177 HydrophobicContact CG1-CB 4.39Å; I171-V177 HydrophobicContact CG1-CG2 4.34Å; I171-V177 HydrophobicContact CG2-CG2 4.5Å
172	D	70.3	Confident	88.3	Confident	97 Å²	97	34.7 Å²	34.7	52%	0.519	18%	0.178	S	C	.	.			trans	-114.8	152.7	167.9	176.7	38.7	0	0	0	109	S174 M175	D172-S174 PolarHBondContact O-N 3.1Å; D172-S174 WeakPolarHBondContact OD2-CB 3.39Å; D172-S174 PolarHBondContact OD2-OG 3Å; D172-M175 PolarHBondContact O-N 3.04Å
173	H	64.9	Low	88.3	Confident	164 Å²	164	34.7 Å²	34.7	76%	0.759	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-5.5	-175.5	-55.9	-75.7	0	0	0	114.2	H83	H83-H173 AromaticContact CE1-CE1 3.85Å; H83-H173 AromaticContact NE2-CE1 3.2Å; H83-H173 PolarHBondContact NE2-CE1 3.02Å; H83-H173 AromaticContact NE2-ND1 3.99Å; H83-H173 AromaticContact NE2-NE2 3.96Å
174	S	64.3	Low	88.2	Confident	87 Å²	87	32.9 Å²	32.9	61%	0.608	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-21.7	-174.7	61	0	0	0	0	114.8	D172	D172-S174 PolarHBondContact O-N 3.1Å; D172-S174 WeakPolarHBondContact OD2-CB 3.39Å; D172-S174 PolarHBondContact OD2-OG 3Å
175	M	68.6	Low	87.9	Confident	72 Å²	72	32.5 Å²	32.5	36%	0.355	17%	0.17	S	C	.	.	S	Bend	trans	-147.4	143.6	-176.7	-60.4	-160.6	-47.8	0	0	113.4	Q117 D172	Q117-M175 HydrophobicContact CG-CE 4.43Å; D172-M175 PolarHBondContact O-N 3.04Å
176	N	82.5	Confident	87.4	Confident	80 Å²	80	33.8 Å²	33.8	43%	0.428	18%	0.178	S	C	.	.			trans	-66.4	137.6	162.6	-70.4	1.5	0	0	0	109.6	I77 E114	I77-N176 HydrophobicContact CD1-CB 4.23Å; E114-N176 WeakPolarHBondContact CB-O 3.26Å; E114-N176 HydrophobicContact CG-CB 4.01Å
177	V	89.2	Confident	87.1	Confident	7 Å²	7	36 Å²	36	4%	0.042	19%	0.191	C	C	.	.			trans	-112.1	134	-179.9	175.4	0	0	0	0	109.2	P75 A116 P169 I171 M179	P75-V177 VanDerWaalsContact CD-O 3.32Å; P75-V177 WeakPolarHBondContact CD-O 3.25Å; A116-V177 HydrophobicContact CB-CG1 3.64Å; P169-V177 HydrophobicContact CB-CG1 3.66Å; I171-V177 HydrophobicContact CG1-CB 4.39Å; I171-V177 HydrophobicContact CG1-CG2 4.34Å; I171-V177 HydrophobicContact CG2-CG2 4.5Å; V177-M179 HydrophobicContact CG1-CG 4.49Å
178	C	93	Very high	86.9	Confident	4 Å²	4	36.4 Å²	36.4	3%	0.027	19%	0.193	C	C	.	.			trans	-130.2	155.9	169.1	-59.9	0	0	0	0	109.2	A72 W73 C74 R106 E114 F115 A116	A72-C178 HydrophobicContact CB-CB 3.82Å; W73-C178 CarbonylContact O-C 3.39Å; W73-C178 VanDerWaalsContact O-CA 3.26Å; W73-C178 WeakPolarHBondContact O-CA 3.42Å; W73-C178 WeakPolarHBondContact O-CB 3.34Å; C74-C178 HydrophobicContact CB-CB 4.09Å; C74-C178 WeakPolarHBondContact CB-SG 3.5Å; C74-C178 WeakPolarHBondContact SG-CB 3.21Å; C74-C178 CovalentContact SG-SG 2.04Å; C74-C178 PolarHBondContact SG-SG 2.86Å; R106-C178 HydrophobicContact CB-CB 3.81Å; E114-C178 HydrophobicContact CB-CB 4.02Å; E114-C178 VanDerWaalsContact CB-SG 3.57Å; F115-C178 WeakPolarHBondContact CA-O 3.2Å; A116-C178 PolarHBondContact N-O 3.44Å
179	M	94.5	Very high	86.6	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-139.3	137.3	179.6	-59.7	-174.3	71.1	0	0	112	W73 T103 A116 Y119 F167 P169 V177 V181	W73-M179 HydrophobicContact CE3-CB 4.08Å; W73-M179 HydrophobicContact CZ3-CB 4.33Å; W73-M179 HydrophobicContact CZ3-CG 4.4Å; W73-M179 HydrophobicContact CZ3-SD 4.37Å; W73-M179 PolarHBondContact N-O 3.36Å; W73-M179 PolarHBondContact O-N 3.18Å; T103-M179 HydrophobicContact CG2-CE 3.74Å; A116-M179 HydrophobicContact CB-CE 4Å; A116-M179 HydrophobicContact CB-CG 3.57Å; A116-M179 HydrophobicContact CB-SD 3.74Å; Y119-M179 HydrophobicContact CD1-CE 3.97Å; Y119-M179 HydrophobicContact CG-CE 4.09Å; F167-M179 HydrophobicContact CB-CE 4.22Å; F167-M179 HydrophobicContact CD1-CE 4.27Å; P169-M179 HydrophobicContact CB-SD 3.86Å; P169-M179 HydrophobicContact CG-SD 4.25Å; V177-M179 HydrophobicContact CG1-CG 4.49Å; M179-V181 HydrophobicContact CB-CG1 4.19Å; M179-V181 HydrophobicContact CE-CG1 4.06Å
180	R	96.4	Very high	86.5	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.008	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	140	156.7	-71.8	-176.4	-68.6	177.1	-3.1	108.2	G62 R63 G66 E67 G71 A72 T103 Q104 G105	G62-R180 CarbonylContact O-C 3.55Å; G62-R180 WeakPolarHBondContact O-CA 3.33Å; R63-R180 WeakPolarHBondContact O-CB 3.41Å; R63-R180 VanDerWaalsContact O-CD 3.25Å; R63-R180 WeakPolarHBondContact O-CD 3.44Å; R63-R180 VanDerWaalsContact O-CG 3.32Å; R63-R180 WeakPolarHBondContact O-CG 3.26Å; G66-R180 WeakPolarHBondContact O-CD 3.35Å; G66-R180 PolarHBondContact O-NH1 2.88Å; E67-R180 IonicContact OE1-CZ 3.73Å; E67-R180 IonicContact OE1-NH1 3.84Å; E67-R180 PolarHBondContact OE1-NH1 3.45Å; E67-R180 IonicContact OE1-NH2 2.68Å; E67-R180 PolarHBondContact OE1-NH2 2.9Å; G71-R180 VanDerWaalsContact O-CD 3.31Å; G71-R180 WeakPolarHBondContact O-CD 3.41Å; G71-R180 PolarHBondContact O-NE 2.91Å; A72-R180 HydrophobicContact CB-CG 3.94Å; T103-R180 CarbonylContact C-O 3.35Å; T103-R180 WeakPolarHBondContact CA-O 3.41Å; Q104-R180 HydrophobicContact CB-CB 4.14Å; Q104-R180 PolarHBondContact N-O 3.12Å; Q104-R180 PolarHBondContact O-N 3.43Å; G105-R180 VanDerWaalsContact O-CZ 3.29Å; G105-R180 PolarHBondContact O-NE 3.24Å; G105-R180 PolarHBondContact O-NH2 3.22Å
181	V	97.8	Very high	86.6	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	156.5	-170.5	-48.1	0	0	0	0	113.1	M37 G62 L64 L88 I90 G102 T103 F167 M179	M37-V181 WeakPolarHBondContact CB-O 3.44Å; M37-V181 HydrophobicContact CE-CG2 4.02Å; M37-V181 WeakPolarHBondContact CG-O 3.17Å; G62-V181 PolarHBondContact O-N 2.92Å; L64-V181 PolarHBondContact N-O 3.19Å; L64-V181 VanDerWaalsContact N-O 3.08Å; L88-V181 HydrophobicContact CD2-CG1 4.19Å; L88-V181 HydrophobicContact CD2-CG2 3.75Å; I90-V181 HydrophobicContact CD1-CG2 3.48Å; I90-V181 VanDerWaalsContact CD1-CG2 3.48Å; G102-V181 VanDerWaalsContact O-CA 3.29Å; G102-V181 WeakPolarHBondContact O-CA 3.48Å; T103-V181 HydrophobicContact CG2-CG1 4.11Å; F167-V181 HydrophobicContact CB-CG1 4.41Å; F167-V181 HydrophobicContact CD1-CB 4.43Å; F167-V181 HydrophobicContact CD1-CG1 3.99Å; F167-V181 HydrophobicContact CD2-CB 4.21Å; F167-V181 HydrophobicContact CD2-CG1 4.18Å; F167-V181 HydrophobicContact CD2-CG2 3.89Å; F167-V181 HydrophobicContact CE1-CB 4.24Å; F167-V181 HydrophobicContact CE1-CG1 4.26Å; F167-V181 HydrophobicContact CE2-CB 4.02Å; F167-V181 HydrophobicContact CE2-CG1 4.45Å; F167-V181 HydrophobicContact CE2-CG2 3.78Å; F167-V181 HydrophobicContact CG-CB 4.41Å; F167-V181 HydrophobicContact CG-CG1 3.94Å; F167-V181 HydrophobicContact CG-CG2 4.49Å; F167-V181 HydrophobicContact CZ-CB 4.03Å; F167-V181 HydrophobicContact CZ-CG1 4.48Å; F167-V181 HydrophobicContact CZ-CG2 4.28Å; M179-V181 HydrophobicContact CB-CG1 4.19Å; M179-V181 HydrophobicContact CE-CG1 4.06Å
182	E	97.3	Very high	87.4	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	150.8	167	-178.3	58.2	-82.1	0	0	109.6	A34 G36 M37 S38 L64 G102 Y184	A34-E182 HydrophobicContact CB-CG 4.11Å; G36-E182 PolarHBondContact N-OE1 3.14Å; M37-E182 WeakPolarHBondContact CA-OE2 3.46Å; M37-E182 HydrophobicContact CB-CB 4.39Å; M37-E182 WeakPolarHBondContact CB-OE1 3.31Å; M37-E182 WeakPolarHBondContact CB-OE2 3.2Å; M37-E182 WeakPolarHBondContact CG-OE1 3.46Å; M37-E182 PolarHBondContact N-OE1 3.07Å; M37-E182 VanDerWaalsContact N-OE1 3.12Å; M37-E182 PolarHBondContact N-OE2 3.07Å; S38-E182 PolarHBondContact N-OE2 3.19Å; L64-E182 HydrophobicContact CB-CB 3.85Å; L64-E182 HydrophobicContact CD2-CB 3.83Å; L64-E182 HydrophobicContact CG-CB 4.35Å; G102-E182 PolarHBondContact N-O 3.05Å; G102-E182 PolarHBondContact O-N 2.85Å; E182-Y184 HydrophobicContact CB-CE2 3.92Å; E182-Y184 HydrophobicContact CG-CD2 4.33Å; E182-Y184 HydrophobicContact CG-CE1 4.01Å; E182-Y184 HydrophobicContact CG-CE2 3.76Å
183	L	96.5	Very high	88.5	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	143.9	171.4	-58.7	99.6	0	0	0	109.7	A34 L35 M37 I90 I98 V165 F167	A34-L183 WeakPolarHBondContact CA-O 3.31Å; L35-L183 HydrophobicContact CB-CB 4.29Å; L35-L183 HydrophobicContact CD1-CB 3.94Å; L35-L183 HydrophobicContact CG-CB 4.29Å; L35-L183 WeakPolarHBondContact CG-O 3.34Å; L35-L183 PolarHBondContact N-O 3.27Å; M37-L183 HydrophobicContact CG-CD1 4.28Å; I90-L183 HydrophobicContact CB-CD1 4.31Å; I90-L183 HydrophobicContact CD1-CD1 3.62Å; I90-L183 HydrophobicContact CG2-CD1 3.94Å; I98-L183 HydrophobicContact CD1-CD2 3.94Å; I98-L183 HydrophobicContact CG2-CB 4.42Å; I98-L183 HydrophobicContact CG2-CD2 4.26Å; V165-L183 HydrophobicContact CB-CD2 3.77Å; V165-L183 HydrophobicContact CG1-CD2 3.9Å; V165-L183 HydrophobicContact CG2-CD2 3.63Å; F167-L183 HydrophobicContact CE2-CD1 4.15Å; F167-L183 HydrophobicContact CE2-CD2 4.31Å; F167-L183 HydrophobicContact CE2-CG 4.09Å; F167-L183 HydrophobicContact CZ-CG 4.2Å
184	Y	93.3	Very high	89.9	Confident	25 Å²	25	27 Å²	27	10%	0.098	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	132.4	178.7	-57.5	-94.2	0	0	0	110.4	Y33 A34 T99 L100 L153 E182	Y33-Y184 CarbonylContact O-C 3.53Å; Y33-Y184 VanDerWaalsContact O-CA 3.23Å; Y33-Y184 WeakPolarHBondContact O-CA 3.48Å; A34-Y184 HydrophobicContact CB-CD1 3.95Å; A34-Y184 HydrophobicContact CB-CE1 3.79Å; T99-Y184 PolarHBondContact N-O 2.97Å; T99-Y184 PolarHBondContact OG1-O 3.44Å; L100-Y184 HydrophobicContact CB-CD2 4.4Å; L100-Y184 HydrophobicContact CD2-CD2 3.75Å; L100-Y184 HydrophobicContact CD2-CE2 4.27Å; L100-Y184 HydrophobicContact CD2-CG 3.91Å; L100-Y184 HydrophobicContact CG-CD2 4.07Å; L100-Y184 HydrophobicContact CG-CG 4.47Å; L100-Y184 PolarHBondContact N-O 2.95Å; L100-Y184 WeakPolarHBondContact O-CB 3.4Å; L100-Y184 PolarHBondContact O-N 3.14Å; L153-Y184 HydrophobicContact CD2-CE2 3.76Å; E182-Y184 HydrophobicContact CB-CE2 3.92Å; E182-Y184 HydrophobicContact CG-CD2 4.33Å; E182-Y184 HydrophobicContact CG-CE1 4.01Å; E182-Y184 HydrophobicContact CG-CE2 3.76Å
185	G	90.8	Very high	91.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.2	-147.9	-170.4	0	0	0	0	0	113.7	C31 R32 Y33 F97	C31-G185 CarbonylContact C-O 3.52Å; C31-G185 WeakPolarHBondContact O-CA 3.47Å; C31-G185 VanDerWaalsContact SG-C 3.55Å; R32-G185 PolarHBondContact N-O 2.79Å; Y33-G185 WeakPolarHBondContact CD2-O 3.49Å; Y33-G185 PolarHBondContact N-O 2.92Å; Y33-G185 PolarHBondContact O-N 2.74Å; F97-G185 CarbonylContact O-C 3.6Å; F97-G185 WeakPolarHBondContact O-CA 3.49Å
186	C	89.3	Confident	92.9	Very high	29 Å²	29	21 Å²	21	20%	0.196	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	166.3	169.4	64.3	0	0	0	0	110	C31 Y33 H96 F97	C31-C186 HydrophobicContact CB-CB 4.05Å; C31-C186 WeakPolarHBondContact CB-SG 3.45Å; C31-C186 WeakPolarHBondContact SG-CB 3.19Å; C31-C186 PolarHBondContact SG-N 2.55Å; C31-C186 CovalentContact SG-SG 2.04Å; C31-C186 PolarHBondContact SG-SG 3.3Å; Y33-C186 HydrophobicContact CD2-CB 4.15Å; Y33-C186 HydrophobicContact CE2-CB 4.46Å; H96-C186 CarbonylContact C-O 3.53Å; H96-C186 WeakPolarHBondContact CA-O 3.43Å; F97-C186 PolarHBondContact N-O 3.28Å; F97-C186 PolarHBondContact O-N 2.91Å
187	E	91.4	Very high	93.5	Very high	100 Å²	100	17.4 Å²	17.4	47%	0.467	9%	0.092	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	137.7	178.4	-173.5	168.2	-135.5	0	0	111.9	S94 L189	S94-E187 WeakPolarHBondContact CB-OE1 3.44Å; S94-E187 PolarHBondContact OG-OE1 3.42Å; E187-L189 VanDerWaalsContact C-N 3.35Å; E187-L189 HydrophobicContact CB-CD2 4.38Å; E187-L189 HydrophobicContact CG-CD2 4.06Å; E187-L189 PolarHBondContact O-N 2.77Å
188	W	92.2	Very high	93.8	Very high	8 Å²	8	18.6 Å²	18.6	3%	0.03	10%	0.1	C	C	.	.			trans	-84.2	75.9	-179.2	-177.3	-117.9	0	0	0	111	V26 L95 F97 I161 D190 G191 L192	V26-W188 HydrophobicContact CB-CZ3 4.37Å; V26-W188 HydrophobicContact CG2-CE3 3.93Å; V26-W188 HydrophobicContact CG2-CZ3 3.75Å; L95-W188 HydrophobicContact CB-CB 3.88Å; L95-W188 HydrophobicContact CB-CG 4.38Å; L95-W188 WeakPolarHBondContact O-CB 3.39Å; L95-W188 PolarHBondContact O-N 3.41Å; F97-W188 HydrophobicContact CB-CE3 4.03Å; F97-W188 AromaticContact CD2-CE3 3.72Å; F97-W188 HydrophobicContact CD2-CE3 3.72Å; F97-W188 HydrophobicContact CD2-CH2 4.5Å; F97-W188 AromaticContact CD2-CZ3 3.57Å; F97-W188 HydrophobicContact CD2-CZ3 3.57Å; F97-W188 HydrophobicContact CE2-CZ3 4.11Å; F97-W188 HydrophobicContact CG-CE3 4.29Å; F97-W188 HydrophobicContact CG-CZ3 4.47Å; I161-W188 HydrophobicContact CD1-CD2 4.13Å; I161-W188 HydrophobicContact CD1-CE3 4.2Å; I161-W188 HydrophobicContact CD1-CH2 3.67Å; I161-W188 HydrophobicContact CD1-CZ2 3.58Å; I161-W188 HydrophobicContact CD1-CZ3 3.98Å; I161-W188 HydrophobicContact CG1-CD2 4.27Å; I161-W188 HydrophobicContact CG1-CE3 4.35Å; I161-W188 HydrophobicContact CG2-CD2 4.15Å; I161-W188 HydrophobicContact CG2-CG 3.91Å; W188-D190 HydrophobicContact CD2-CB 4.22Å; W188-D190 HydrophobicContact CH2-CB 4.22Å; W188-D190 HydrophobicContact CZ2-CB 3.83Å; W188-D190 PolarHBondContact O-N 2.77Å; W188-G191 PolarHBondContact O-N 3.26Å; W188-G191 VanDerWaalsContact O-N 3.15Å; W188-L192 HydrophobicContact CZ2-CB 4.27Å; W188-L192 PolarHBondContact NE1-O 3.2Å
189	L	88.4	Confident	93.9	Very high	98 Å²	98	20.2 Å²	20.2	51%	0.513	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-26.5	-174.3	-63.1	179.3	0	0	0	114.3	E187 G191 R279	E187-L189 VanDerWaalsContact C-N 3.35Å; E187-L189 HydrophobicContact CB-CD2 4.38Å; E187-L189 HydrophobicContact CG-CD2 4.06Å; E187-L189 PolarHBondContact O-N 2.77Å; L189-G191 VanDerWaalsContact C-N 3.28Å; L189-G191 PolarHBondContact O-N 3.25Å; L189-R279 PolarHBondContact O-NH1 2.86Å
190	D	89.3	Confident	93.9	Very high	3 Å²	3	20.9 Å²	20.9	2%	0.016	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-43.4	174.4	-163.7	-58.1	0	0	0	111.2	W188 L192 R279 T362 F363	W188-D190 HydrophobicContact CD2-CB 4.22Å; W188-D190 HydrophobicContact CH2-CB 4.22Å; W188-D190 HydrophobicContact CZ2-CB 3.83Å; W188-D190 PolarHBondContact O-N 2.77Å; D190-L192 VanDerWaalsContact C-N 3.27Å; D190-L192 PolarHBondContact O-N 3.44Å; D190-L192 WeakPolarHBondContact OD1-CB 3.43Å; D190-R279 PolarHBondContact O-NH1 3.06Å; D190-T362 WeakPolarHBondContact OD2-CA 3.45Å; D190-F363 PolarHBondContact OD2-N 2.92Å
191	G	90.2	Very high	93.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.131	C	C	.	.			trans	80.3	0.1	176.9	0	0	0	0	0	115.4	W188 L189 V193 F275 D276 R279	W188-G191 PolarHBondContact O-N 3.26Å; W188-G191 VanDerWaalsContact O-N 3.15Å; L189-G191 VanDerWaalsContact C-N 3.28Å; L189-G191 PolarHBondContact O-N 3.25Å; G191-V193 PolarHBondContact O-N 2.97Å; G191-F275 WeakPolarHBondContact O-CA 3.26Å; G191-D276 PolarHBondContact O-N 3Å; G191-R279 VanDerWaalsContact CA-NH2 3.28Å
192	L	94.4	Very high	93.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	127.7	175.8	-173.4	66.6	0	0	0	111.1	W188 D190 S194 Y195 L229 T233 F273 F275 F363	W188-L192 HydrophobicContact CZ2-CB 4.27Å; W188-L192 PolarHBondContact NE1-O 3.2Å; D190-L192 VanDerWaalsContact C-N 3.27Å; D190-L192 PolarHBondContact O-N 3.44Å; D190-L192 WeakPolarHBondContact OD1-CB 3.43Å; L192-S194 WeakPolarHBondContact CD1-O 3.34Å; L192-Y195 HydrophobicContact CD2-CD1 4.37Å; L192-L229 HydrophobicContact CD2-CD2 4.08Å; L192-L229 HydrophobicContact CG-CD2 3.99Å; L192-T233 HydrophobicContact CD2-CG2 3.62Å; L192-F273 HydrophobicContact CD1-CB 3.67Å; L192-F273 HydrophobicContact CD1-CD1 3.92Å; L192-F273 HydrophobicContact CD1-CG 4.3Å; L192-F273 HydrophobicContact CD2-CD1 4.16Å; L192-F275 HydrophobicContact CB-CD1 4.1Å; L192-F275 HydrophobicContact CB-CE1 3.92Å; L192-F275 HydrophobicContact CD1-CD1 4.17Å; L192-F275 HydrophobicContact CD1-CE1 3.75Å; L192-F275 HydrophobicContact CD1-CE2 4.19Å; L192-F275 HydrophobicContact CD1-CZ 3.77Å; L192-F275 HydrophobicContact CG-CE1 4.43Å; L192-F363 HydrophobicContact CD2-CE2 4.28Å
193	V	93.6	Very high	93.6	Very high	43 Å²	43	27.7 Å²	27.7	26%	0.261	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-34.5	-177.7	174.5	0	0	0	0	111.7	L95 R125 G191 L229 E274 D276	L95-V193 HydrophobicContact CD1-CG2 3.91Å; R125-V193 HydrophobicContact CB-CG1 4.41Å; R125-V193 PolarHBondContact NE-O 3.37Å; G191-V193 PolarHBondContact O-N 2.97Å; V193-L229 WeakPolarHBondContact O-CG 3.35Å; V193-E274 PolarHBondContact N-O 2.93Å; V193-D276 HydrophobicContact CG2-CB 3.81Å
194	S	95.8	Very high	93.3	Very high	8 Å²	8	33.3 Å²	33.3	6%	0.056	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	159.8	169.8	71.4	0	0	0	0	112.1	L192 G228 E274	L192-S194 WeakPolarHBondContact CD1-O 3.34Å; S194-G228 CarbonylContact C-O 3.58Å; S194-G228 VanDerWaalsContact CA-O 3.24Å; S194-G228 WeakPolarHBondContact CA-O 3.49Å; S194-G228 WeakPolarHBondContact CB-O 3.33Å; S194-E274 PolarHBondContact N-O 2.86Å; S194-E274 PolarHBondContact O-N 2.89Å
195	Y	97.3	Very high	93.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	143.1	158.5	59	-96.2	0	0	0	111	L192 A197 D214 Y217 M225 G228 L229 G230 L232 T233 M272	L192-Y195 HydrophobicContact CD2-CD1 4.37Å; Y195-A197 HydrophobicContact CD2-CB 4.46Å; Y195-D214 PolarHBondContact OH-OD2 2.89Å; Y195-Y217 AromaticContact CD2-CE2 3.97Å; Y195-Y217 HydrophobicContact CD2-CE2 3.97Å; Y195-Y217 AromaticContact CE2-CD2 3.85Å; Y195-Y217 HydrophobicContact CE2-CD2 3.85Å; Y195-Y217 AromaticContact CE2-CE2 3.53Å; Y195-Y217 HydrophobicContact CE2-CE2 3.53Å; Y195-Y217 AromaticContact CZ-CD2 3.95Å; Y195-Y217 AromaticContact CZ-CE2 3.89Å; Y195-Y217 PolarHBondContact O-OH 3.24Å; Y195-M225 HydrophobicContact CE2-CE 4.45Å; Y195-G228 PolarHBondContact N-O 2.92Å; Y195-L229 HydrophobicContact CD1-CD2 3.77Å; Y195-L229 HydrophobicContact CE1-CD2 4.05Å; Y195-G230 VanDerWaalsContact OH-C 3.29Å; Y195-G230 WeakPolarHBondContact OH-CA 3.42Å; Y195-G230 PolarHBondContact OH-N 3.3Å; Y195-G230 VanDerWaalsContact OH-N 3.16Å; Y195-L232 HydrophobicContact CD2-CD1 4.46Å; Y195-L232 HydrophobicContact CE1-CB 4.07Å; Y195-L232 HydrophobicContact CE2-CB 4.36Å; Y195-L232 HydrophobicContact CE2-CD1 3.94Å; Y195-L232 HydrophobicContact CE2-CG 4.46Å; Y195-L232 PolarHBondContact OH-N 3.07Å; Y195-T233 HydrophobicContact CD1-CG2 3.94Å; Y195-T233 HydrophobicContact CE1-CG2 3.64Å; Y195-M272 CarbonylContact C-O 3.54Å; Y195-M272 WeakPolarHBondContact CA-O 3.47Å
196	N	96.8	Very high	92.6	Very high	34 Å²	34	40.2 Å²	40.2	18%	0.182	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	125.2	175.2	-62.7	-5.5	0	0	0	108.5	M225 T226 E227 I271 M272	N196-M225 CarbonylContact C-O 3.48Å; N196-M225 VanDerWaalsContact CA-O 3.23Å; N196-M225 WeakPolarHBondContact CA-O 3.46Å; N196-T226 HydrophobicContact CB-CG2 4.29Å; N196-T226 VanDerWaalsContact OD1-CA 3.27Å; N196-T226 WeakPolarHBondContact OD1-CA 3.49Å; N196-E227 PolarHBondContact OD1-N 2.96Å; N196-I271 WeakPolarHBondContact O-CA 3.34Å; N196-M272 HydrophobicContact CB-CB 4.43Å; N196-M272 PolarHBondContact N-O 2.87Å; N196-M272 PolarHBondContact O-N 3.43Å
197	A	96.6	Very high	92.2	Very high	3 Å²	3	42.9 Å²	42.9	3%	0.025	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	155.8	-175.1	0	0	0	0	0	112	Y195 S224 M225 I271	Y195-A197 HydrophobicContact CD2-CB 4.46Å; A197-S224 WeakPolarHBondContact O-CB 3.27Å; A197-M225 HydrophobicContact CB-CE 3.93Å; A197-M225 PolarHBondContact N-O 2.96Å; A197-M225 WeakPolarHBondContact O-CB 3.42Å; A197-M225 PolarHBondContact O-N 3.09Å; A197-I271 HydrophobicContact CB-CD1 4.5Å; A197-I271 HydrophobicContact CB-CG1 4.06Å; A197-I271 HydrophobicContact CB-CG2 4.18Å
198	P	96	Very high	91.9	Very high	32 Å²	32	42.4 Å²	42.4	21%	0.208	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	142.2	166.9	-23.5	34.4	0	0	0	111.2	G200 W259 F264 V269 E270	P198-G200 PolarHBondContact O-N 2.7Å; P198-W259 PolarHBondContact O-NE1 2.67Å; P198-F264 HydrophobicContact CB-CE1 3.9Å; P198-F264 HydrophobicContact CB-CZ 3.76Å; P198-F264 HydrophobicContact CG-CE1 3.71Å; P198-F264 HydrophobicContact CG-CZ 4.05Å; P198-V269 HydrophobicContact CG-CG1 4.08Å; P198-E270 VanDerWaalsContact CD-O 3.28Å; P198-E270 WeakPolarHBondContact CD-O 3.47Å
199	A	95.1	Very high	91.9	Very high	39 Å²	39	44.3 Å²	44.3	32%	0.322	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-61.1	135.4	177.2	0	0	0	0	0	111.1	M225	A199-M225 HydrophobicContact CB-CG 4.38Å
200	G	93.9	Very high	92.1	Very high	14 Å²	14	39.7 Å²	39.7	14%	0.144	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-66.5	151.9	177.8	0	0	0	0	0	112.7	P198 L212 G258	P198-G200 PolarHBondContact O-N 2.7Å; G200-L212 CarbonylContact C-O 3.55Å; G200-L212 VanDerWaalsContact CA-O 3.24Å; G200-L212 WeakPolarHBondContact CA-O 3.41Å; G200-G258 WeakPolarHBondContact CA-O 3.38Å
201	Q	94.9	Very high	92.3	Very high	52 Å²	52	44.1 Å²	44.1	24%	0.243	25%	0.254	C	S	.	.			trans	-113.9	168.4	-161.1	-58.6	-174.3	-65.5	0	0	113.5	L212 G258 S263 W355	Q201-L212 WeakPolarHBondContact O-CB 3.45Å; Q201-L212 PolarHBondContact O-N 2.79Å; Q201-G258 PolarHBondContact N-O 3.35Å; Q201-S263 PolarHBondContact NE2-OG 3.38Å; Q201-W355 HydrophobicContact CB-CH2 4.26Å; Q201-W355 HydrophobicContact CB-CZ3 4.15Å
202	Q	94.7	Very high	92.5	Very high	88 Å²	88	44.1 Å²	44.1	41%	0.411	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	120.8	175.8	-177.1	-174.9	-42.7	0	0	110.6	N204 P209 V210 Y211	Q202-N204 PolarHBondContact NE2-OD1 3.29Å; Q202-P209 HydrophobicContact CG-CB 4.16Å; Q202-V210 CarbonylContact C-O 3.45Å; Q202-V210 WeakPolarHBondContact CA-O 3.45Å; Q202-Y211 HydrophobicContact CB-CD1 4.35Å; Q202-Y211 HydrophobicContact CG-CD1 3.99Å; Q202-Y211 HydrophobicContact CG-CE1 3.92Å
203	M	94.7	Very high	92.5	Very high	5 Å²	5	46.7 Å²	46.7	3%	0.025	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	123.9	171.8	178.8	-164.8	-71.5	0	0	109.7	L205 V210 L212 F242 V296 W355	M203-L205 HydrophobicContact CG-CD2 4.2Å; M203-L205 HydrophobicContact CG-CG 4.34Å; M203-L205 PolarHBondContact O-N 3.34Å; M203-L205 HydrophobicContact SD-CD1 4.43Å; M203-L205 HydrophobicContact SD-CD2 3.67Å; M203-L205 HydrophobicContact SD-CG 3.98Å; M203-V210 HydrophobicContact CB-CB 4.22Å; M203-V210 PolarHBondContact N-O 3.12Å; M203-V210 PolarHBondContact O-N 3.02Å; M203-L212 HydrophobicContact CB-CD1 3.77Å; M203-L212 HydrophobicContact CE-CD1 4.12Å; M203-F242 HydrophobicContact CE-CE2 3.87Å; M203-F242 HydrophobicContact CE-CZ 3.75Å; M203-F242 HydrophobicContact SD-CE2 3.6Å; M203-F242 VanDerWaalsContact SD-CE2 3.6Å; M203-F242 HydrophobicContact SD-CZ 3.62Å; M203-V296 HydrophobicContact CE-CG2 3.79Å; M203-W355 HydrophobicContact CB-CD2 4.49Å; M203-W355 HydrophobicContact CB-CE3 4.48Å; M203-W355 HydrophobicContact CB-CH2 3.61Å; M203-W355 HydrophobicContact CB-CZ2 3.58Å; M203-W355 HydrophobicContact CB-CZ3 4.07Å; M203-W355 HydrophobicContact CE-CB 4.04Å; M203-W355 HydrophobicContact CE-CD2 3.5Å; M203-W355 VanDerWaalsContact CE-CD2 3.5Å; M203-W355 HydrophobicContact CE-CE3 3.95Å; M203-W355 HydrophobicContact CE-CG 3.54Å; M203-W355 HydrophobicContact CG-CD2 4.45Å; M203-W355 HydrophobicContact CG-CH2 4.34Å; M203-W355 HydrophobicContact CG-CZ2 3.8Å
204	N	91.4	Very high	92.5	Very high	118 Å²	118	45 Å²	45	63%	0.631	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	93.7	179.2	-67.5	-47.6	0	0	0	110.7	Q202	Q202-N204 PolarHBondContact NE2-OD1 3.29Å
205	L	87.8	Confident	92.2	Very high	30 Å²	30	46.5 Å²	46.5	16%	0.157	27%	0.268	C	S	.	.			trans	-80.9	154.5	171.1	-63.3	-179.6	0	0	0	110.7	M203 A207 Y208 V210 T243	M203-L205 HydrophobicContact CG-CD2 4.2Å; M203-L205 HydrophobicContact CG-CG 4.34Å; M203-L205 PolarHBondContact O-N 3.34Å; M203-L205 HydrophobicContact SD-CD1 4.43Å; M203-L205 HydrophobicContact SD-CD2 3.67Å; M203-L205 HydrophobicContact SD-CG 3.98Å; L205-A207 PolarHBondContact O-N 2.97Å; L205-Y208 WeakPolarHBondContact CB-O 3.27Å; L205-Y208 HydrophobicContact CD1-CE2 4.47Å; L205-Y208 PolarHBondContact N-O 3Å; L205-Y208 PolarHBondContact O-N 2.91Å; L205-V210 HydrophobicContact CD1-CG2 3.61Å; L205-V210 HydrophobicContact CG-CG2 4.01Å; L205-T243 HydrophobicContact CD1-CG2 3.76Å
206	P	81.8	Confident	92	Very high	141 Å²	141	47.9 Å²	47.9	92%	0.916	28%	0.276	S	S	*	.	S	Bend	trans	-61.5	-14.1	-176.4	-26.4	35.7	0	0	0	116.4
207	A	80.4	Confident	91.9	Very high	85 Å²	85	47 Å²	47	70%	0.702	27%	0.27	S	S	*	.	S	Bend	trans	-103	-34.5	-179.1	0	0	0	0	0	113.6	L205	L205-A207 PolarHBondContact O-N 2.97Å
208	Y	84.1	Confident	91.8	Very high	89 Å²	89	48 Å²	48	35%	0.349	28%	0.275	S	S	.	.	S	Bend	trans	-166	155.3	-177.8	48	-100.8	0	0	0	110.7	L205 V210 T243 P252	L205-Y208 WeakPolarHBondContact CB-O 3.27Å; L205-Y208 HydrophobicContact CD1-CE2 4.47Å; L205-Y208 PolarHBondContact N-O 3Å; L205-Y208 PolarHBondContact O-N 2.91Å; Y208-V210 HydrophobicContact CD2-CG2 3.96Å; Y208-V210 HydrophobicContact CE2-CG2 3.77Å; Y208-T243 HydrophobicContact CE2-CG2 4.31Å; Y208-T243 VanDerWaalsContact OH-CB 3.31Å; Y208-T243 WeakPolarHBondContact OH-CB 3.45Å; Y208-T243 PolarHBondContact OH-OG1 3Å; Y208-P252 HydrophobicContact CD2-CB 4.05Å; Y208-P252 HydrophobicContact CD2-CG 4.1Å; Y208-P252 HydrophobicContact CE2-CB 3.64Å; Y208-P252 HydrophobicContact CE2-CG 3.92Å
209	P	91.9	Very high	91.6	Very high	49 Å²	49	47.3 Å²	47.3	32%	0.318	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	144.4	167.7	31.2	-34.8	0	0	0	111.2	Q202 Y211	Q202-P209 HydrophobicContact CG-CB 4.16Å; P209-Y211 HydrophobicContact CB-CE2 4Å; P209-Y211 HydrophobicContact CG-CE2 3.82Å
210	V	93.6	Very high	91.4	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129.2	174.6	176.7	0	0	0	0	107.2	Q202 M203 L205 Y208 L212 F242 T243 P252	Q202-V210 CarbonylContact C-O 3.45Å; Q202-V210 WeakPolarHBondContact CA-O 3.45Å; M203-V210 HydrophobicContact CB-CB 4.22Å; M203-V210 PolarHBondContact N-O 3.12Å; M203-V210 PolarHBondContact O-N 3.02Å; L205-V210 HydrophobicContact CD1-CG2 3.61Å; L205-V210 HydrophobicContact CG-CG2 4.01Å; Y208-V210 HydrophobicContact CD2-CG2 3.96Å; Y208-V210 HydrophobicContact CE2-CG2 3.77Å; V210-L212 HydrophobicContact CG1-CD1 4.36Å; V210-L212 HydrophobicContact CG1-CD2 3.8Å; V210-L212 HydrophobicContact CG1-CG 3.93Å; V210-F242 HydrophobicContact CG1-CD2 4.11Å; V210-F242 HydrophobicContact CG1-CE2 4.09Å; V210-T243 HydrophobicContact CG2-CG2 4.19Å; V210-P252 WeakPolarHBondContact CA-O 3.31Å; V210-P252 WeakPolarHBondContact CG1-O 3.4Å; V210-P252 HydrophobicContact CG2-CB 4.24Å
211	Y	93.4	Very high	91.1	Very high	97 Å²	97	50.9 Å²	50.9	38%	0.38	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	107.3	-174.1	-62.3	-89.2	0	0	0	109.8	Q202 P209 W251 P252 G253	Q202-Y211 HydrophobicContact CB-CD1 4.35Å; Q202-Y211 HydrophobicContact CG-CD1 3.99Å; Q202-Y211 HydrophobicContact CG-CE1 3.92Å; P209-Y211 HydrophobicContact CB-CE2 4Å; P209-Y211 HydrophobicContact CG-CE2 3.82Å; Y211-W251 PolarHBondContact O-NE1 2.98Å; Y211-P252 PolarHBondContact N-O 3.1Å; Y211-P252 VanDerWaalsContact N-O 3.1Å; Y211-G253 CarbonylContact O-C 3.56Å
212	L	95	Very high	90.4	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.311	C	S	.	.			trans	-107	41.5	-171.3	-54.4	154.5	0	0	0	110.3	G200 Q201 M203 V210 F242 Y256 V257 G258 W355 L357	G200-L212 CarbonylContact C-O 3.55Å; G200-L212 VanDerWaalsContact CA-O 3.24Å; G200-L212 WeakPolarHBondContact CA-O 3.41Å; Q201-L212 WeakPolarHBondContact O-CB 3.45Å; Q201-L212 PolarHBondContact O-N 2.79Å; M203-L212 HydrophobicContact CB-CD1 3.77Å; M203-L212 HydrophobicContact CE-CD1 4.12Å; V210-L212 HydrophobicContact CG1-CD1 4.36Å; V210-L212 HydrophobicContact CG1-CD2 3.8Å; V210-L212 HydrophobicContact CG1-CG 3.93Å; L212-F242 HydrophobicContact CD2-CD2 4.33Å; L212-Y256 CarbonylContact C-O 3.5Å; L212-Y256 VanDerWaalsContact CA-O 3.25Å; L212-Y256 WeakPolarHBondContact CA-O 3.3Å; L212-V257 WeakPolarHBondContact O-CA 3.39Å; L212-G258 PolarHBondContact O-N 3.07Å; L212-W355 HydrophobicContact CD1-CE3 3.98Å; L212-W355 HydrophobicContact CD1-CZ3 3.77Å; L212-L357 HydrophobicContact CD1-CD2 3.61Å; L212-L357 HydrophobicContact CD2-CD1 4.18Å; L212-L357 HydrophobicContact CD2-CD2 4.06Å; L212-L357 HydrophobicContact CG-CD2 4.3Å
213	N	93.4	Very high	89.5	Confident	53 Å²	53	60.2 Å²	60.2	28%	0.283	33%	0.327	S	S	.	.	S	Bend	trans	-97.5	145.9	179.3	68.6	-87.9	0	0	0	110.3	S215	N213-S215 PolarHBondContact O-N 3.04Å; N213-S215 VanDerWaalsContact O-N 3.12Å
214	D	94.4	Very high	89.2	Confident	7 Å²	7	61.1 Å²	61.1	4%	0.037	33%	0.334	C	S	.	.			trans	-66	116.8	167.8	-159.5	-51.3	0	0	0	109	Y195 V216 Y217 M225 Q231 V257	Y195-D214 PolarHBondContact OH-OD2 2.89Å; D214-V216 PolarHBondContact OD1-N 2.99Å; D214-V216 VanDerWaalsContact OD1-N 3.11Å; D214-Y217 WeakPolarHBondContact OD1-CB 3.25Å; D214-Y217 PolarHBondContact OD1-N 2.7Å; D214-M225 HydrophobicContact CB-CE 4.17Å; D214-M225 HydrophobicContact CB-SD 3.67Å; D214-Q231 PolarHBondContact OD1-N 3.08Å; D214-Q231 PolarHBondContact OD2-N 3Å; D214-V257 HydrophobicContact CB-CG2 3.82Å
215	S	89.8	Confident	89.3	Confident	41 Å²	41	55.6 Å²	55.6	29%	0.287	31%	0.305	S	S	.	.	S	Bend	trans	-95.1	-13.9	-174.7	69	0	0	0	0	113.7	N213 Q231 Y254	N213-S215 PolarHBondContact O-N 3.04Å; N213-S215 VanDerWaalsContact O-N 3.12Å; S215-Q231 PolarHBondContact OG-OE1 3.26Å; S215-Y254 WeakPolarHBondContact OG-CE2 3.48Å; S215-Y254 PolarHBondContact OG-OH 3.18Å
216	V	92.6	Very high	89.6	Confident	28 Å²	28	55.8 Å²	55.8	17%	0.17	31%	0.307	C	S	.	.	S	Bend	trans	-118.1	-0.5	-176.4	-48.4	0	0	0	0	113.4	R136 P158 D214 D218 Q231 Y254	R136-V216 HydrophobicContact CG-CG1 4.27Å; P158-V216 HydrophobicContact CB-CB 4.15Å; P158-V216 HydrophobicContact CB-CG1 4.17Å; P158-V216 HydrophobicContact CB-CG2 4.1Å; P158-V216 HydrophobicContact CG-CB 3.94Å; P158-V216 HydrophobicContact CG-CG1 4.07Å; P158-V216 HydrophobicContact CG-CG2 4.37Å; D214-V216 PolarHBondContact OD1-N 2.99Å; D214-V216 VanDerWaalsContact OD1-N 3.11Å; V216-D218 PolarHBondContact O-N 3.12Å; V216-Q231 HydrophobicContact CG1-CG 4.43Å; V216-Q231 HydrophobicContact CG2-CG 3.65Å; V216-Y254 WeakPolarHBondContact CG1-OH 3.48Å
217	Y	95.3	Very high	90	Very high	17 Å²	17	54.2 Å²	54.2	7%	0.067	29%	0.288	C	S	.	.			trans	-49.2	118.4	179.7	-167.8	-99.9	0	0	0	112.8	Y195 D214 I221 M225 T226 E227 G228 L229	Y195-Y217 AromaticContact CD2-CE2 3.97Å; Y195-Y217 HydrophobicContact CD2-CE2 3.97Å; Y195-Y217 AromaticContact CE2-CD2 3.85Å; Y195-Y217 HydrophobicContact CE2-CD2 3.85Å; Y195-Y217 AromaticContact CE2-CE2 3.53Å; Y195-Y217 HydrophobicContact CE2-CE2 3.53Å; Y195-Y217 AromaticContact CZ-CD2 3.95Å; Y195-Y217 AromaticContact CZ-CE2 3.89Å; Y195-Y217 PolarHBondContact O-OH 3.24Å; D214-Y217 WeakPolarHBondContact OD1-CB 3.25Å; D214-Y217 PolarHBondContact OD1-N 2.7Å; Y217-I221 HydrophobicContact CD1-CD1 4.23Å; Y217-I221 HydrophobicContact CD1-CG1 3.82Å; Y217-M225 HydrophobicContact CD1-CB 3.95Å; Y217-M225 HydrophobicContact CD1-CG 4.49Å; Y217-M225 HydrophobicContact CD2-CB 4.38Å; Y217-M225 HydrophobicContact CE1-CB 3.59Å; Y217-M225 HydrophobicContact CE2-CB 4.07Å; Y217-M225 HydrophobicContact CG-CB 4.32Å; Y217-M225 HydrophobicContact CG-SD 4.36Å; Y217-T226 WeakPolarHBondContact OH-CA 3.39Å; Y217-T226 PolarHBondContact OH-N 2.87Å; Y217-T226 PolarHBondContact OH-O 2.92Å; Y217-E227 PolarHBondContact OH-N 3.49Å; Y217-G228 VanDerWaalsContact CE2-C 3.48Å; Y217-G228 WeakPolarHBondContact CE2-O 3.44Å; Y217-G228 WeakPolarHBondContact OH-CA 3.46Å; Y217-G228 PolarHBondContact OH-N 2.68Å; Y217-L229 CarbonylContact C-O 3.57Å; Y217-L229 WeakPolarHBondContact CA-O 3.45Å
218	D	94.1	Very high	90.6	Very high	22 Å²	22	50.1 Å²	50.1	12%	0.118	25%	0.254	C	S	.	.			trans	-93.2	3.7	-171	78.6	3	0	0	0	114.5	Y123 R125 I131 V216 G228 L229	Y123-D218 VanDerWaalsContact CE2-OD2 3.3Å; Y123-D218 WeakPolarHBondContact CE2-OD2 3.38Å; Y123-D218 VanDerWaalsContact OH-CB 3.29Å; Y123-D218 WeakPolarHBondContact OH-CB 3.34Å; Y123-D218 PolarHBondContact OH-OD2 3.05Å; R125-D218 IonicContact CZ-OD1 3.51Å; R125-D218 IonicContact CZ-OD2 2.68Å; R125-D218 IonicContact NH1-OD1 2.64Å; R125-D218 IonicContact NH1-OD2 3.79Å; R125-D218 PolarHBondContact NH1-OD2 3.46Å; R125-D218 IonicContact NH2-OD1 2.91Å; R125-D218 PolarHBondContact NH2-OD1 3.48Å; R125-D218 IonicContact NH2-OD2 3.5Å; R125-D218 PolarHBondContact NH2-OD2 3.42Å; I131-D218 HydrophobicContact CD1-CB 4.09Å; I131-D218 WeakPolarHBondContact CD1-OD2 3.46Å; I131-D218 HydrophobicContact CG2-CB 4.01Å; V216-D218 PolarHBondContact O-N 3.12Å; D218-G228 WeakPolarHBondContact OD1-CA 3.28Å; D218-L229 PolarHBondContact N-O 2.71Å; D218-L229 PolarHBondContact OD1-N 3.19Å
219	G	92.4	Very high	91.2	Very high	18 Å²	18	46.2 Å²	46.2	19%	0.186	24%	0.239	C	C	.	.	S	Bend	trans	-84.9	-158.7	176.5	0	0	0	0	0	113.7	T226 G228	G219-T226 CarbonylContact C-O 3.58Å; G219-T226 WeakPolarHBondContact CA-O 3.12Å; G219-G228 VanDerWaalsContact CA-CA 3.45Å
220	A	89.2	Confident	91.4	Very high	33 Å²	33	44.1 Å²	44.1	27%	0.273	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	140.6	167.4	0	0	0	0	0	110	M225 T226	A220-M225 CarbonylContact O-C 3.54Å; A220-M225 WeakPolarHBondContact O-CA 3.24Å; A220-T226 PolarHBondContact N-O 3.05Å; A220-T226 PolarHBondContact O-N 3.32Å
221	I	88.3	Confident	91.4	Very high	96 Å²	96	44.4 Å²	44.4	49%	0.492	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	115.8	172.6	-50.8	176.5	0	0	0	107.2	Y217 M225	Y217-I221 HydrophobicContact CD1-CD1 4.23Å; Y217-I221 HydrophobicContact CD1-CG1 3.82Å; I221-M225 HydrophobicContact CG1-CG 4.43Å; I221-M225 HydrophobicContact CG2-CG 4.49Å
222	I	80.9	Confident	91.5	Very high	142 Å²	142	39.8 Å²	39.8	73%	0.728	21%	0.21	S	C	*	.	S	Bend	trans	-131.2	-76.3	179.5	-52.2	178.2	0	0	0	109.6	S224	I222-S224 PolarHBondContact N-O 3.01Å; I222-S224 VanDerWaalsContact N-O 3.14Å
223	Y	75.1	Confident	91.5	Very high	193 Å²	193	39.9 Å²	39.9	76%	0.757	21%	0.21	S	C	*	.	S	Bend	trans	-113.6	-29.4	169.5	50.7	-95.5	0	0	0	110.9
224	S	88.9	Confident	91.3	Very high	24 Å²	24	37.8 Å²	37.8	17%	0.168	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	169.1	167	57.3	0	0	0	0	109.3	A197 I222	A197-S224 WeakPolarHBondContact O-CB 3.27Å; I222-S224 PolarHBondContact N-O 3.01Å; I222-S224 VanDerWaalsContact N-O 3.14Å
225	M	93.9	Very high	91	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.015	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	126.1	169.1	-52.1	-172.4	-56.5	0	0	107.5	Y195 N196 A197 A199 D214 Y217 A220 I221 V257	Y195-M225 HydrophobicContact CE2-CE 4.45Å; N196-M225 CarbonylContact C-O 3.48Å; N196-M225 VanDerWaalsContact CA-O 3.23Å; N196-M225 WeakPolarHBondContact CA-O 3.46Å; A197-M225 HydrophobicContact CB-CE 3.93Å; A197-M225 PolarHBondContact N-O 2.96Å; A197-M225 WeakPolarHBondContact O-CB 3.42Å; A197-M225 PolarHBondContact O-N 3.09Å; A199-M225 HydrophobicContact CB-CG 4.38Å; D214-M225 HydrophobicContact CB-CE 4.17Å; D214-M225 HydrophobicContact CB-SD 3.67Å; Y217-M225 HydrophobicContact CD1-CB 3.95Å; Y217-M225 HydrophobicContact CD1-CG 4.49Å; Y217-M225 HydrophobicContact CD2-CB 4.38Å; Y217-M225 HydrophobicContact CE1-CB 3.59Å; Y217-M225 HydrophobicContact CE2-CB 4.07Å; Y217-M225 HydrophobicContact CG-CB 4.32Å; Y217-M225 HydrophobicContact CG-SD 4.36Å; A220-M225 CarbonylContact O-C 3.54Å; A220-M225 WeakPolarHBondContact O-CA 3.24Å; I221-M225 HydrophobicContact CG1-CG 4.43Å; I221-M225 HydrophobicContact CG2-CG 4.49Å; M225-V257 HydrophobicContact CE-CG1 4.29Å
226	T	93.3	Very high	91	Very high	34 Å²	34	37.8 Å²	37.8	21%	0.209	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	146.6	-179.1	60.3	0	0	0	0	114.1	N196 Y217 G219 A220 G228	N196-T226 HydrophobicContact CB-CG2 4.29Å; N196-T226 VanDerWaalsContact OD1-CA 3.27Å; N196-T226 WeakPolarHBondContact OD1-CA 3.49Å; Y217-T226 WeakPolarHBondContact OH-CA 3.39Å; Y217-T226 PolarHBondContact OH-N 2.87Å; Y217-T226 PolarHBondContact OH-O 2.92Å; G219-T226 CarbonylContact C-O 3.58Å; G219-T226 WeakPolarHBondContact CA-O 3.12Å; A220-T226 PolarHBondContact N-O 3.05Å; A220-T226 PolarHBondContact O-N 3.32Å; T226-G228 VanDerWaalsContact C-N 3.31Å; T226-G228 PolarHBondContact O-N 3.13Å
227	E	90.3	Very high	90.9	Very high	107 Å²	107	37.9 Å²	37.9	50%	0.5	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	60.9	32.4	173.4	-52	176.5	151	0	0	114.4	R129 N196 Y217	R129-E227 IonicContact CZ-OE2 2.76Å; R129-E227 IonicContact NH1-OE2 3.12Å; R129-E227 PolarHBondContact NH1-OE2 2.87Å; N196-E227 PolarHBondContact OD1-N 2.96Å; Y217-E227 PolarHBondContact OH-N 3.49Å
228	G	94.1	Very high	90.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	172.9	-179.6	0	0	0	0	0	114.7	S194 Y195 Y217 D218 G219 T226	S194-G228 CarbonylContact C-O 3.58Å; S194-G228 VanDerWaalsContact CA-O 3.24Å; S194-G228 WeakPolarHBondContact CA-O 3.49Å; S194-G228 WeakPolarHBondContact CB-O 3.33Å; Y195-G228 PolarHBondContact N-O 2.92Å; Y217-G228 VanDerWaalsContact CE2-C 3.48Å; Y217-G228 WeakPolarHBondContact CE2-O 3.44Å; Y217-G228 WeakPolarHBondContact OH-CA 3.46Å; Y217-G228 PolarHBondContact OH-N 2.68Å; D218-G228 WeakPolarHBondContact OD1-CA 3.28Å; G219-G228 VanDerWaalsContact CA-CA 3.45Å; T226-G228 VanDerWaalsContact C-N 3.31Å; T226-G228 PolarHBondContact O-N 3.13Å
229	L	96.4	Very high	90.5	Very high	6 Å²	6	39.8 Å²	39.8	3%	0.031	21%	0.212	C	C	.	.			trans	-123	160.6	167.6	-62.7	174.9	0	0	0	108.3	I161 L192 V193 Y195 Y217 D218 T233	I161-L229 HydrophobicContact CB-CD1 3.82Å; I161-L229 HydrophobicContact CD1-CD1 3.8Å; I161-L229 HydrophobicContact CG1-CD1 4.42Å; I161-L229 HydrophobicContact CG2-CD1 3.74Å; L192-L229 HydrophobicContact CD2-CD2 4.08Å; L192-L229 HydrophobicContact CG-CD2 3.99Å; V193-L229 WeakPolarHBondContact O-CG 3.35Å; Y195-L229 HydrophobicContact CD1-CD2 3.77Å; Y195-L229 HydrophobicContact CE1-CD2 4.05Å; Y217-L229 CarbonylContact C-O 3.57Å; Y217-L229 WeakPolarHBondContact CA-O 3.45Å; D218-L229 PolarHBondContact N-O 2.71Å; D218-L229 PolarHBondContact OD1-N 3.19Å; L229-T233 HydrophobicContact CD2-CG2 4.25Å
230	G	94.6	Very high	90.6	Very high	5 Å²	5	42.2 Å²	42.2	5%	0.052	22%	0.221	C	C	.	.			trans	-169.1	-150.5	-168	0	0	0	0	0	112	Y195 L232 T233 D234	Y195-G230 VanDerWaalsContact OH-C 3.29Å; Y195-G230 WeakPolarHBondContact OH-CA 3.42Å; Y195-G230 PolarHBondContact OH-N 3.3Å; Y195-G230 VanDerWaalsContact OH-N 3.16Å; G230-L232 VanDerWaalsContact C-N 3.31Å; G230-L232 PolarHBondContact O-N 3.05Å; G230-T233 PolarHBondContact N-OG1 3.06Å; G230-T233 CarbonylContact O-C 3.53Å; G230-T233 PolarHBondContact O-N 2.92Å; G230-T233 PolarHBondContact O-OG1 2.81Å; G230-D234 PolarHBondContact O-N 2.96Å
231	Q	94.4	Very high	90.7	Very high	6 Å²	6	42.7 Å²	42.7	3%	0.028	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-60.5	-37	-173.5	-66.3	-166.7	-122.8	0	0	113.4	D214 S215 V216 T233 D234 Y254 V257 S359	D214-Q231 PolarHBondContact OD1-N 3.08Å; D214-Q231 PolarHBondContact OD2-N 3Å; S215-Q231 PolarHBondContact OG-OE1 3.26Å; V216-Q231 HydrophobicContact CG1-CG 4.43Å; V216-Q231 HydrophobicContact CG2-CG 3.65Å; Q231-T233 PolarHBondContact O-N 2.83Å; Q231-D234 PolarHBondContact O-N 3.48Å; Q231-Y254 PolarHBondContact NE2-O 3.46Å; Q231-V257 HydrophobicContact CB-CG2 4.38Å; Q231-S359 CarbonylContact C-O 3.58Å
232	L	96.1	Very high	91	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-61.3	2.2	175.5	-60.3	179.1	0	0	0	115	Y195 G230 V257 W259 F358 S359 E360 I361	Y195-L232 HydrophobicContact CD2-CD1 4.46Å; Y195-L232 HydrophobicContact CE1-CB 4.07Å; Y195-L232 HydrophobicContact CE2-CB 4.36Å; Y195-L232 HydrophobicContact CE2-CD1 3.94Å; Y195-L232 HydrophobicContact CE2-CG 4.46Å; Y195-L232 PolarHBondContact OH-N 3.07Å; G230-L232 VanDerWaalsContact C-N 3.31Å; G230-L232 PolarHBondContact O-N 3.05Å; L232-V257 HydrophobicContact CD1-CB 4.47Å; L232-V257 HydrophobicContact CD1-CG2 4.46Å; L232-V257 HydrophobicContact CD2-CB 4.01Å; L232-V257 HydrophobicContact CD2-CG2 3.92Å; L232-V257 HydrophobicContact CG-CB 4.26Å; L232-V257 HydrophobicContact CG-CG2 3.88Å; L232-W259 HydrophobicContact CD1-CH2 4.34Å; L232-F358 HydrophobicContact CD2-CB 3.68Å; L232-F358 WeakPolarHBondContact CD2-O 3.44Å; L232-S359 WeakPolarHBondContact CA-O 3.47Å; L232-E360 CarbonylContact O-C 3.59Å; L232-I361 HydrophobicContact CB-CG1 4.37Å; L232-I361 HydrophobicContact CD1-CD1 4.13Å; L232-I361 PolarHBondContact O-N 3.31Å
233	T	94.3	Very high	91.4	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.012	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-146.2	10	-175.9	50.2	0	0	0	0	113	L192 Y195 L229 G230 Q231 E360	L192-T233 HydrophobicContact CD2-CG2 3.62Å; Y195-T233 HydrophobicContact CD1-CG2 3.94Å; Y195-T233 HydrophobicContact CE1-CG2 3.64Å; L229-T233 HydrophobicContact CD2-CG2 4.25Å; G230-T233 PolarHBondContact N-OG1 3.06Å; G230-T233 CarbonylContact O-C 3.53Å; G230-T233 PolarHBondContact O-N 2.92Å; G230-T233 PolarHBondContact O-OG1 2.81Å; Q231-T233 PolarHBondContact O-N 2.83Å; T233-E360 WeakPolarHBondContact CA-OE1 3.26Å
234	D	89.5	Confident	92	Very high	9 Å²	9	27.4 Å²	27.4	5%	0.048	15%	0.153	C	C	.	.	S	Bend	trans	-91.9	5.9	-171.7	89.9	-6.2	0	0	0	114.8	F97 R136 G230 Q231 V236	F97-D234 WeakPolarHBondContact CZ-O 3.26Å; R136-D234 IonicContact CZ-OD2 2.73Å; R136-D234 VanDerWaalsContact CZ-OD2 3.24Å; R136-D234 IonicContact NH1-OD2 2.68Å; R136-D234 PolarHBondContact NH1-OD2 3.28Å; R136-D234 IonicContact NH2-OD1 2.72Å; R136-D234 IonicContact NH2-OD2 3.84Å; R136-D234 PolarHBondContact NH2-OD2 3.48Å; G230-D234 PolarHBondContact O-N 2.96Å; Q231-D234 PolarHBondContact O-N 3.48Å; D234-V236 VanDerWaalsContact OD1-CB 3.26Å; D234-V236 WeakPolarHBondContact OD1-CB 3.24Å; D234-V236 VanDerWaalsContact OD1-CG2 3.25Å; D234-V236 WeakPolarHBondContact OD1-CG2 3.34Å; D234-V236 PolarHBondContact OD1-N 3.37Å
235	G	88.3	Confident	91.8	Very high	14 Å²	14	27.8 Å²	27.8	14%	0.144	16%	0.156	C	C	.	.	S	Bend	trans	83.6	9.4	176.2	0	0	0	0	0	114.1	P28 E360	P28-G235 WeakPolarHBondContact CD-O 3.24Å; G235-E360 WeakPolarHBondContact CA-OE2 3.34Å; G235-E360 PolarHBondContact N-OE2 2.98Å
236	V	88.3	Confident	90.8	Very high	34 Å²	34	33.4 Å²	33.4	21%	0.206	18%	0.181	C	C	.	.			trans	-109.3	115.9	-176.9	-175.6	0	0	0	0	110.8	D234 E360	D234-V236 VanDerWaalsContact OD1-CB 3.26Å; D234-V236 WeakPolarHBondContact OD1-CB 3.24Å; D234-V236 VanDerWaalsContact OD1-CG2 3.25Å; D234-V236 WeakPolarHBondContact OD1-CG2 3.34Å; D234-V236 PolarHBondContact OD1-N 3.37Å; V236-E360 PolarHBondContact N-OE2 3.03Å
237	C	90.7	Very high	89.9	Confident	30 Å²	30	33 Å²	33	20%	0.203	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-83.9	132.6	166.7	-56.9	0	0	0	0	109.7	Q25 H246 F332	Q25-C237 PolarHBondContact NE2-SG 3.24Å; C237-H246 PolarHBondContact O-CD2 3.42Å; C237-F332 VanDerWaalsContact SG-CZ 3.56Å
238	G	90.4	Very high	88.8	Confident	6 Å²	6	35.3 Å²	35.3	6%	0.062	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-78.2	158	175.6	0	0	0	0	0	113.8	Y256 H287 S359	G238-Y256 PolarHBondContact O-OH 3.45Å; G238-H287 PolarHBondContact O-CE1 3.47Å; G238-S359 PolarHBondContact N-OG 2.99Å; G238-S359 VanDerWaalsContact N-OG 3.11Å
239	E	92	Very high	87.7	Confident	72 Å²	72	41.6 Å²	41.6	34%	0.336	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-65.7	159.4	-178.4	-73.7	-81.3	-156.6	0	0	114.6	D241 L244 H246 Y256 N289	E239-D241 VanDerWaalsContact C-N 3.34Å; E239-D241 PolarHBondContact O-N 3.47Å; E239-L244 HydrophobicContact CB-CB 4.45Å; E239-L244 HydrophobicContact CG-CB 4.46Å; E239-H246 IonicContact OE1-CE1 3.52Å; E239-H246 PolarHBondContact OE1-CE1 2.89Å; E239-H246 IonicContact OE1-ND1 3.55Å; E239-H246 PolarHBondContact OE1-ND1 2.81Å; E239-H246 IonicContact OE2-CE1 2.71Å; E239-Y256 WeakPolarHBondContact O-CE2 3.46Å; E239-Y256 PolarHBondContact O-OH 2.85Å; E239-N289 PolarHBondContact O-ND2 3.46Å
240	D	93	Very high	86.7	Confident	70 Å²	70	42.5 Å²	42.5	37%	0.374	23%	0.234	S	C	.	.	S	Bend	trans	-56.7	-44.1	173.5	-90.5	2.3	0	0	0	112.5	N289 S329 A330	D240-N289 PolarHBondContact O-ND2 3.07Å; D240-S329 VanDerWaalsContact CG-CA 3.47Å; D240-S329 WeakPolarHBondContact OD1-CA 3.45Å; D240-S329 VanDerWaalsContact OD1-CB 3.25Å; D240-S329 WeakPolarHBondContact OD1-CB 3.38Å; D240-S329 WeakPolarHBondContact OD2-CA 3.29Å; D240-S329 WeakPolarHBondContact OD2-CB 3.05Å; D240-S329 PolarHBondContact OD2-OG 3.19Å; D240-A330 PolarHBondContact OD1-N 3.02Å
241	D	92.9	Very high	86.2	Confident	42 Å²	42	46.5 Å²	46.5	23%	0.225	25%	0.248	C	C	.	.	S	Bend	trans	-90.4	101.4	165.9	-168.6	-28.3	0	0	0	108.7	E239 T243 L244 M291	E239-D241 VanDerWaalsContact C-N 3.34Å; E239-D241 PolarHBondContact O-N 3.47Å; D241-T243 VanDerWaalsContact CG-OG1 3.3Å; D241-T243 PolarHBondContact O-N 3.14Å; D241-T243 VanDerWaalsContact OD1-CB 3.3Å; D241-T243 WeakPolarHBondContact OD1-CB 3.41Å; D241-T243 WeakPolarHBondContact OD1-CG2 3.33Å; D241-T243 PolarHBondContact OD1-N 3.28Å; D241-T243 PolarHBondContact OD1-OG1 2.98Å; D241-L244 HydrophobicContact CB-CD1 4.3Å; D241-L244 HydrophobicContact CB-CG 4.27Å; D241-L244 WeakPolarHBondContact O-CB 3.4Å; D241-L244 PolarHBondContact O-N 3.47Å; D241-M291 HydrophobicContact CB-CE 3.69Å
242	F	92.9	Very high	86	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-8.7	178.7	67.6	-95.7	0	0	0	114.2	M203 V210 L212 L244 G253 Y256 M291 R294 V296 L357	M203-F242 HydrophobicContact CE-CE2 3.87Å; M203-F242 HydrophobicContact CE-CZ 3.75Å; M203-F242 HydrophobicContact SD-CE2 3.6Å; M203-F242 VanDerWaalsContact SD-CE2 3.6Å; M203-F242 HydrophobicContact SD-CZ 3.62Å; V210-F242 HydrophobicContact CG1-CD2 4.11Å; V210-F242 HydrophobicContact CG1-CE2 4.09Å; L212-F242 HydrophobicContact CD2-CD2 4.33Å; F242-L244 VanDerWaalsContact C-N 3.27Å; F242-G253 WeakPolarHBondContact O-CA 3.25Å; F242-G253 PolarHBondContact O-N 3.28Å; F242-Y256 HydrophobicContact CB-CD2 3.57Å; F242-Y256 HydrophobicContact CB-CE2 3.66Å; F242-Y256 HydrophobicContact CB-CG 4.39Å; F242-M291 HydrophobicContact CD1-CB 4.18Å; F242-M291 HydrophobicContact CD1-SD 4.11Å; F242-M291 HydrophobicContact CE1-CB 4.12Å; F242-M291 HydrophobicContact CE1-CG 4.41Å; F242-M291 HydrophobicContact CE1-SD 3.86Å; F242-R294 HydrophobicContact CE1-CB 4.06Å; F242-R294 HydrophobicContact CE1-CG 4.4Å; F242-R294 HydrophobicContact CZ-CB 4.07Å; F242-R294 VanDerWaalsContact CZ-CD 3.46Å; F242-R294 HydrophobicContact CZ-CG 4.43Å; F242-V296 HydrophobicContact CD1-CG2 4.29Å; F242-V296 HydrophobicContact CE1-CB 4.3Å; F242-V296 HydrophobicContact CE1-CG2 3.6Å; F242-V296 HydrophobicContact CZ-CG2 3.93Å; F242-L357 HydrophobicContact CB-CD1 3.83Å; F242-L357 HydrophobicContact CD1-CD1 3.76Å; F242-L357 HydrophobicContact CD2-CD1 3.8Å; F242-L357 HydrophobicContact CE1-CD1 4.24Å; F242-L357 HydrophobicContact CE2-CD1 4.29Å; F242-L357 HydrophobicContact CG-CD1 3.51Å; F242-L357 HydrophobicContact CZ-CD1 4.48Å
243	T	90.2	Very high	85.7	Confident	10 Å²	10	48.2 Å²	48.2	6%	0.061	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-10.3	171.7	70.6	0	0	0	0	113.1	L205 Y208 V210 D241 P252	L205-T243 HydrophobicContact CD1-CG2 3.76Å; Y208-T243 HydrophobicContact CE2-CG2 4.31Å; Y208-T243 VanDerWaalsContact OH-CB 3.31Å; Y208-T243 WeakPolarHBondContact OH-CB 3.45Å; Y208-T243 PolarHBondContact OH-OG1 3Å; V210-T243 HydrophobicContact CG2-CG2 4.19Å; D241-T243 VanDerWaalsContact CG-OG1 3.3Å; D241-T243 PolarHBondContact O-N 3.14Å; D241-T243 VanDerWaalsContact OD1-CB 3.3Å; D241-T243 WeakPolarHBondContact OD1-CB 3.41Å; D241-T243 WeakPolarHBondContact OD1-CG2 3.33Å; D241-T243 PolarHBondContact OD1-N 3.28Å; D241-T243 PolarHBondContact OD1-OG1 2.98Å; T243-P252 WeakPolarHBondContact O-CA 3.04Å; T243-P252 WeakPolarHBondContact O-CB 3.45Å
244	L	88.4	Confident	85.6	Confident	100 Å²	100	48.3 Å²	48.3	52%	0.524	26%	0.259	S	S	.	.	S	Bend	trans	-95.3	170.3	169.1	-54.5	-178.5	0	0	0	110.6	E239 D241 F242	E239-L244 HydrophobicContact CB-CB 4.45Å; E239-L244 HydrophobicContact CG-CB 4.46Å; D241-L244 HydrophobicContact CB-CD1 4.3Å; D241-L244 HydrophobicContact CB-CG 4.27Å; D241-L244 WeakPolarHBondContact O-CB 3.4Å; D241-L244 PolarHBondContact O-N 3.47Å; F242-L244 VanDerWaalsContact C-N 3.27Å
245	S	83.6	Confident	85.7	Confident	33 Å²	33	48 Å²	48	23%	0.231	26%	0.258	C	S	.	.			trans	-152.4	143.2	176.2	167.6	0	0	0	0	110.2	V247 D255	S245-V247 PolarHBondContact O-N 3.28Å; S245-V247 WeakPolarHBondContact OG-CB 3.28Å; S245-V247 PolarHBondContact OG-N 3.15Å; S245-D255 VanDerWaalsContact CA-OD2 3.26Å; S245-D255 WeakPolarHBondContact CA-OD2 3.37Å; S245-D255 WeakPolarHBondContact CB-OD1 3.38Å; S245-D255 PolarHBondContact OG-OD1 2.75Å
246	H	74.2	Confident	86.1	Confident	120 Å²	120	47.4 Å²	47.4	56%	0.556	25%	0.251	S	S	*	.	S	Bend	trans	-70.3	-17.2	169.8	-68.4	-38.6	0	0	0	112.8	C237 E239 D255	C237-H246 PolarHBondContact O-CD2 3.42Å; E239-H246 IonicContact OE1-CE1 3.52Å; E239-H246 PolarHBondContact OE1-CE1 2.89Å; E239-H246 IonicContact OE1-ND1 3.55Å; E239-H246 PolarHBondContact OE1-ND1 2.81Å; E239-H246 IonicContact OE2-CE1 2.71Å; H246-D255 PolarHBondContact N-OD2 3Å
247	V	72.6	Confident	86.5	Confident	27 Å²	27	45.8 Å²	45.8	16%	0.164	24%	0.241	C	C	.	.	S	Bend	trans	-83.2	123.9	-174.3	179.6	0	0	0	0	111.1	S245 N249 G250 Y254	S245-V247 PolarHBondContact O-N 3.28Å; S245-V247 WeakPolarHBondContact OG-CB 3.28Å; S245-V247 PolarHBondContact OG-N 3.15Å; V247-N249 PolarHBondContact O-N 3.4Å; V247-G250 PolarHBondContact O-N 3.34Å; V247-Y254 HydrophobicContact CB-CD1 3.99Å; V247-Y254 HydrophobicContact CB-CE1 4.14Å; V247-Y254 HydrophobicContact CG1-CD1 4.42Å; V247-Y254 HydrophobicContact CG1-CE1 4.21Å; V247-Y254 HydrophobicContact CG2-CD1 3.81Å; V247-Y254 HydrophobicContact CG2-CE1 3.72Å
248	H	67.9	Low	86.8	Confident	155 Å²	155	44.3 Å²	44.3	72%	0.718	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	121.7	177.7	-173	62.6	0	0	0	111.4	G250	H248-G250 VanDerWaalsContact C-N 3.29Å
249	N	71	Confident	87.2	Confident	131 Å²	131	44 Å²	44	70%	0.701	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.7	22.1	-169.6	-49.1	-53.7	0	0	0	115.1	V247	V247-N249 PolarHBondContact O-N 3.4Å
250	G	75.5	Confident	87.4	Confident	26 Å²	26	41.8 Å²	41.8	27%	0.268	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-63.3	150.5	161.5	0	0	0	0	0	111.5	V247 H248	V247-G250 PolarHBondContact O-N 3.34Å; H248-G250 VanDerWaalsContact C-N 3.29Å
251	W	84.4	Confident	87.6	Confident	88 Å²	88	41 Å²	41	33%	0.333	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-86.3	162.6	172.9	55	75.6	0	0	0	111.4	Y211 G253 Y254	Y211-W251 PolarHBondContact O-NE1 2.98Å; W251-G253 PolarHBondContact O-N 3.09Å; W251-Y254 AromaticContact CD2-CD2 3.8Å; W251-Y254 HydrophobicContact CD2-CD2 3.8Å; W251-Y254 AromaticContact CE2-CD2 3.59Å; W251-Y254 AromaticContact CE3-CD2 3.95Å; W251-Y254 HydrophobicContact CE3-CD2 3.95Å; W251-Y254 HydrophobicContact CE3-CE2 4.5Å; W251-Y254 HydrophobicContact CG-CD2 4.49Å; W251-Y254 AromaticContact CH2-CD2 3.81Å; W251-Y254 HydrophobicContact CH2-CD2 3.81Å; W251-Y254 AromaticContact CH2-CE2 3.77Å; W251-Y254 HydrophobicContact CH2-CE2 3.77Å; W251-Y254 AromaticContact CZ2-CD2 3.63Å; W251-Y254 HydrophobicContact CZ2-CD2 3.63Å; W251-Y254 AromaticContact CZ2-CE2 3.94Å; W251-Y254 HydrophobicContact CZ2-CE2 3.94Å; W251-Y254 AromaticContact CZ3-CD2 3.96Å; W251-Y254 HydrophobicContact CZ3-CD2 3.96Å; W251-Y254 HydrophobicContact CZ3-CE2 4.06Å; W251-Y254 WeakPolarHBondContact O-CB 3.46Å; W251-Y254 PolarHBondContact O-N 3.45Å
252	P	89.4	Confident	87.7	Confident	43 Å²	43	45.8 Å²	45.8	28%	0.279	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	123.2	173.6	-25.5	35.9	0	0	0	111.3	Y208 V210 Y211 T243	Y208-P252 HydrophobicContact CD2-CB 4.05Å; Y208-P252 HydrophobicContact CD2-CG 4.1Å; Y208-P252 HydrophobicContact CE2-CB 3.64Å; Y208-P252 HydrophobicContact CE2-CG 3.92Å; V210-P252 WeakPolarHBondContact CA-O 3.31Å; V210-P252 WeakPolarHBondContact CG1-O 3.4Å; V210-P252 HydrophobicContact CG2-CB 4.24Å; Y211-P252 PolarHBondContact N-O 3.1Å; Y211-P252 VanDerWaalsContact N-O 3.1Å; T243-P252 WeakPolarHBondContact O-CA 3.04Å; T243-P252 WeakPolarHBondContact O-CB 3.45Å
253	G	89.7	Confident	87.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	96.2	-6.9	-172.6	0	0	0	0	0	115.5	Y211 F242 W251 D255 Y256	Y211-G253 CarbonylContact O-C 3.56Å; F242-G253 WeakPolarHBondContact O-CA 3.25Å; F242-G253 PolarHBondContact O-N 3.28Å; W251-G253 PolarHBondContact O-N 3.09Å; G253-D255 VanDerWaalsContact C-N 3.29Å; G253-D255 PolarHBondContact O-N 2.86Å; G253-D255 VanDerWaalsContact O-N 3.14Å; G253-Y256 PolarHBondContact O-N 3.41Å
254	Y	92.8	Very high	87.9	Confident	4 Å²	4	50 Å²	50	2%	0.016	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-43	-170.8	-177	-86.2	0	0	0	113.5	R136 S215 V216 Q231 V247 W251 Y256	R136-Y254 VanDerWaalsContact CD-OH 3.28Å; R136-Y254 WeakPolarHBondContact CD-OH 3.36Å; R136-Y254 WeakPolarHBondContact CG-OH 3.19Å; R136-Y254 PolarHBondContact NH1-OH 3.48Å; S215-Y254 WeakPolarHBondContact OG-CE2 3.48Å; S215-Y254 PolarHBondContact OG-OH 3.18Å; V216-Y254 WeakPolarHBondContact CG1-OH 3.48Å; Q231-Y254 PolarHBondContact NE2-O 3.46Å; V247-Y254 HydrophobicContact CB-CD1 3.99Å; V247-Y254 HydrophobicContact CB-CE1 4.14Å; V247-Y254 HydrophobicContact CG1-CD1 4.42Å; V247-Y254 HydrophobicContact CG1-CE1 4.21Å; V247-Y254 HydrophobicContact CG2-CD1 3.81Å; V247-Y254 HydrophobicContact CG2-CE1 3.72Å; W251-Y254 AromaticContact CD2-CD2 3.8Å; W251-Y254 HydrophobicContact CD2-CD2 3.8Å; W251-Y254 AromaticContact CE2-CD2 3.59Å; W251-Y254 AromaticContact CE3-CD2 3.95Å; W251-Y254 HydrophobicContact CE3-CD2 3.95Å; W251-Y254 HydrophobicContact CE3-CE2 4.5Å; W251-Y254 HydrophobicContact CG-CD2 4.49Å; W251-Y254 AromaticContact CH2-CD2 3.81Å; W251-Y254 HydrophobicContact CH2-CD2 3.81Å; W251-Y254 AromaticContact CH2-CE2 3.77Å; W251-Y254 HydrophobicContact CH2-CE2 3.77Å; W251-Y254 AromaticContact CZ2-CD2 3.63Å; W251-Y254 HydrophobicContact CZ2-CD2 3.63Å; W251-Y254 AromaticContact CZ2-CE2 3.94Å; W251-Y254 HydrophobicContact CZ2-CE2 3.94Å; W251-Y254 AromaticContact CZ3-CD2 3.96Å; W251-Y254 HydrophobicContact CZ3-CD2 3.96Å; W251-Y254 HydrophobicContact CZ3-CE2 4.06Å; W251-Y254 WeakPolarHBondContact O-CB 3.46Å; W251-Y254 PolarHBondContact O-N 3.45Å; Y254-Y256 PolarHBondContact O-N 3.11Å; Y254-Y256 VanDerWaalsContact O-N 3.14Å
255	D	92.6	Very high	87.8	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.021	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-0.7	-174	-61	-1.8	0	0	0	113.7	S245 H246 G253 S359	S245-D255 VanDerWaalsContact CA-OD2 3.26Å; S245-D255 WeakPolarHBondContact CA-OD2 3.37Å; S245-D255 WeakPolarHBondContact CB-OD1 3.38Å; S245-D255 PolarHBondContact OG-OD1 2.75Å; H246-D255 PolarHBondContact N-OD2 3Å; G253-D255 VanDerWaalsContact C-N 3.29Å; G253-D255 PolarHBondContact O-N 2.86Å; G253-D255 VanDerWaalsContact O-N 3.14Å; D255-S359 WeakPolarHBondContact O-CB 3.04Å
256	Y	95.8	Very high	88	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.302	C	S	.	.			trans	-129.5	134.7	-172.5	-77.8	-80	0	0	0	113.7	L212 G238 E239 F242 G253 Y254 N289 A330 L357	L212-Y256 CarbonylContact C-O 3.5Å; L212-Y256 VanDerWaalsContact CA-O 3.25Å; L212-Y256 WeakPolarHBondContact CA-O 3.3Å; G238-Y256 PolarHBondContact O-OH 3.45Å; E239-Y256 WeakPolarHBondContact O-CE2 3.46Å; E239-Y256 PolarHBondContact O-OH 2.85Å; F242-Y256 HydrophobicContact CB-CD2 3.57Å; F242-Y256 HydrophobicContact CB-CE2 3.66Å; F242-Y256 HydrophobicContact CB-CG 4.39Å; G253-Y256 PolarHBondContact O-N 3.41Å; Y254-Y256 PolarHBondContact O-N 3.11Å; Y254-Y256 VanDerWaalsContact O-N 3.14Å; Y256-N289 HydrophobicContact CD1-CB 4.42Å; Y256-N289 HydrophobicContact CE1-CB 3.7Å; Y256-N289 HydrophobicContact CE2-CB 4.48Å; Y256-N289 PolarHBondContact OH-ND2 2.98Å; Y256-A330 VanDerWaalsContact OH-CB 3.31Å; Y256-A330 WeakPolarHBondContact OH-CB 3.36Å; Y256-L357 HydrophobicContact CD1-CB 3.74Å; Y256-L357 HydrophobicContact CE1-CB 4.38Å; Y256-L357 HydrophobicContact CG-CB 4.2Å
257	V	97.3	Very high	89	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	129.9	161.6	-168.8	0	0	0	0	108.4	L212 D214 M225 Q231 L232 W259 F358	L212-V257 WeakPolarHBondContact O-CA 3.39Å; D214-V257 HydrophobicContact CB-CG2 3.82Å; M225-V257 HydrophobicContact CE-CG1 4.29Å; Q231-V257 HydrophobicContact CB-CG2 4.38Å; L232-V257 HydrophobicContact CD1-CB 4.47Å; L232-V257 HydrophobicContact CD1-CG2 4.46Å; L232-V257 HydrophobicContact CD2-CB 4.01Å; L232-V257 HydrophobicContact CD2-CG2 3.92Å; L232-V257 HydrophobicContact CG-CB 4.26Å; L232-V257 HydrophobicContact CG-CG2 3.88Å; V257-W259 HydrophobicContact CB-CH2 4.37Å; V257-W259 HydrophobicContact CB-CZ2 4.44Å; V257-W259 HydrophobicContact CG1-CH2 4.06Å; V257-W259 HydrophobicContact CG1-CZ2 3.65Å; V257-F358 PolarHBondContact N-O 3.11Å; V257-F358 PolarHBondContact O-N 3.49Å
258	G	97.1	Very high	90.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	146	-166.8	0	0	0	0	0	115.2	G200 Q201 L212 M356	G200-G258 WeakPolarHBondContact CA-O 3.38Å; Q201-G258 PolarHBondContact N-O 3.35Å; L212-G258 PolarHBondContact O-N 3.07Å; G258-M356 WeakPolarHBondContact CA-O 3.28Å
259	W	97.3	Very high	91.5	Very high	0 Å²	0	41 Å²	41	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	152.1	-177	-51.1	-83.1	0	0	0	111.3	P198 L232 V257 F264 V269 I271 F351 W355 M356 F358	P198-W259 PolarHBondContact O-NE1 2.67Å; L232-W259 HydrophobicContact CD1-CH2 4.34Å; V257-W259 HydrophobicContact CB-CH2 4.37Å; V257-W259 HydrophobicContact CB-CZ2 4.44Å; V257-W259 HydrophobicContact CG1-CH2 4.06Å; V257-W259 HydrophobicContact CG1-CZ2 3.65Å; W259-F264 HydrophobicContact CB-CE2 3.85Å; W259-F264 HydrophobicContact CB-CZ 4.38Å; W259-F264 AromaticContact CD1-CZ 3.99Å; W259-F264 HydrophobicContact CG-CE2 4.34Å; W259-F264 HydrophobicContact CG-CZ 4.4Å; W259-V269 HydrophobicContact CB-CG2 3.82Å; W259-V269 HydrophobicContact CD2-CG1 3.96Å; W259-V269 HydrophobicContact CD2-CG2 3.96Å; W259-V269 HydrophobicContact CE3-CG1 4.25Å; W259-V269 HydrophobicContact CE3-CG2 4.17Å; W259-V269 HydrophobicContact CG-CG1 4.39Å; W259-V269 HydrophobicContact CG-CG2 3.83Å; W259-V269 HydrophobicContact CZ2-CG1 4.28Å; W259-I271 HydrophobicContact CH2-CD1 3.94Å; W259-I271 HydrophobicContact CZ2-CD1 4.41Å; W259-F351 HydrophobicContact CB-CE1 4.25Å; W259-F351 HydrophobicContact CB-CZ 3.98Å; W259-F351 WeakPolarHBondContact O-CE1 3.44Å; W259-W355 VanDerWaalsContact C-CE3 3.48Å; W259-W355 WeakPolarHBondContact O-CA 3.49Å; W259-W355 VanDerWaalsContact O-CE3 3.27Å; W259-M356 HydrophobicContact CE3-CE 4.4Å; W259-M356 PolarHBondContact N-O 3.41Å; W259-M356 PolarHBondContact O-N 3.18Å; W259-F358 AromaticContact CH2-CD2 3.92Å; W259-F358 HydrophobicContact CH2-CD2 3.92Å; W259-F358 HydrophobicContact CH2-CE2 4.49Å; W259-F358 HydrophobicContact CZ3-CB 4.45Å; W259-F358 AromaticContact CZ3-CD2 3.56Å; W259-F358 HydrophobicContact CZ3-CD2 3.56Å; W259-F358 AromaticContact CZ3-CE2 3.94Å; W259-F358 HydrophobicContact CZ3-CE2 3.94Å; W259-F358 HydrophobicContact CZ3-CG 4.07Å
260	N	96.8	Very high	92.8	Very high	24 Å²	24	38.5 Å²	38.5	13%	0.128	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	131.2	179.5	175.5	-74.6	0	0	0	110.9	D262 S263 F264 A354 W355	N260-D262 VanDerWaalsContact C-N 3.31Å; N260-D262 PolarHBondContact O-N 3.05Å; N260-D262 VanDerWaalsContact OD1-CB 3.25Å; N260-D262 WeakPolarHBondContact OD1-CB 3.3Å; N260-D262 PolarHBondContact OD1-N 2.59Å; N260-S263 WeakPolarHBondContact O-CB 3.45Å; N260-S263 PolarHBondContact O-N 3.12Å; N260-F264 WeakPolarHBondContact O-CD2 3.22Å; N260-A354 CarbonylContact C-O 3.47Å; N260-A354 WeakPolarHBondContact CA-O 3.07Å; N260-W355 HydrophobicContact CB-CD2 3.92Å; N260-W355 HydrophobicContact CB-CE3 3.98Å; N260-W355 HydrophobicContact CB-CH2 3.76Å; N260-W355 HydrophobicContact CB-CZ2 3.71Å; N260-W355 HydrophobicContact CB-CZ3 3.91Å; N260-W355 VanDerWaalsContact ND2-CE2 3.28Å; N260-W355 PolarHBondContact ND2-NE1 3.08Å; N260-W355 VanDerWaalsContact ND2-NE1 3.18Å
261	N	96.8	Very high	93.8	Very high	53 Å²	53	37.3 Å²	37.3	28%	0.283	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-56.4	-37.7	-174.9	-168.9	23.2	0	0	0	113.7	S263 F264 F351 A354	N261-S263 PolarHBondContact O-N 3.12Å; N261-F264 PolarHBondContact O-N 3.32Å; N261-F351 HydrophobicContact CB-CB 4.08Å; N261-F351 HydrophobicContact CB-CD1 3.92Å; N261-F351 HydrophobicContact CB-CD2 3.96Å; N261-F351 HydrophobicContact CB-CE1 4.31Å; N261-F351 HydrophobicContact CB-CE2 4.36Å; N261-F351 HydrophobicContact CB-CG 3.73Å; N261-F351 WeakPolarHBondContact OD1-CD2 3.29Å; N261-A354 PolarHBondContact N-O 3.01Å
262	D	95	Very high	94.4	Very high	144 Å²	144	35 Å²	35	77%	0.77	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-63.5	-18	-179.7	-57.5	-34.5	0	0	0	112.7	N260	N260-D262 VanDerWaalsContact C-N 3.31Å; N260-D262 PolarHBondContact O-N 3.05Å; N260-D262 VanDerWaalsContact OD1-CB 3.25Å; N260-D262 WeakPolarHBondContact OD1-CB 3.3Å; N260-D262 PolarHBondContact OD1-N 2.59Å
263	S	93.7	Very high	94.8	Very high	60 Å²	60	33 Å²	33	42%	0.42	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-82.5	-10.4	175.4	-57.8	0	0	0	0	113.9	Q201 N260 N261	Q201-S263 PolarHBondContact NE2-OG 3.38Å; N260-S263 WeakPolarHBondContact O-CB 3.45Å; N260-S263 PolarHBondContact O-N 3.12Å; N261-S263 PolarHBondContact O-N 3.12Å
264	F	94.6	Very high	95.1	Very high	39 Å²	39	35.8 Å²	35.8	17%	0.171	22%	0.217	C	C	.	.			trans	-124.7	90.8	-172.2	-66.3	-89.6	0	0	0	111.1	P198 W259 N260 N261 G266 G267 S268 V269 F351	P198-F264 HydrophobicContact CB-CE1 3.9Å; P198-F264 HydrophobicContact CB-CZ 3.76Å; P198-F264 HydrophobicContact CG-CE1 3.71Å; P198-F264 HydrophobicContact CG-CZ 4.05Å; W259-F264 HydrophobicContact CB-CE2 3.85Å; W259-F264 HydrophobicContact CB-CZ 4.38Å; W259-F264 AromaticContact CD1-CZ 3.99Å; W259-F264 HydrophobicContact CG-CE2 4.34Å; W259-F264 HydrophobicContact CG-CZ 4.4Å; N260-F264 WeakPolarHBondContact O-CD2 3.22Å; N261-F264 PolarHBondContact O-N 3.32Å; F264-G266 PolarHBondContact O-N 3.4Å; F264-G267 PolarHBondContact O-N 2.98Å; F264-S268 WeakPolarHBondContact CD1-O 3.48Å; F264-V269 HydrophobicContact CD2-CG2 4.46Å; F264-V269 HydrophobicContact CE1-CG2 4.39Å; F264-V269 HydrophobicContact CE2-CG2 4.33Å; F264-V269 HydrophobicContact CZ-CG2 4.28Å; F264-F351 HydrophobicContact CB-CE2 3.98Å; F264-F351 AromaticContact CD2-CE2 3.93Å; F264-F351 HydrophobicContact CD2-CE2 3.93Å; F264-F351 AromaticContact CD2-CZ 3.83Å; F264-F351 HydrophobicContact CD2-CZ 3.83Å; F264-F351 HydrophobicContact CE2-CZ 4.38Å; F264-F351 HydrophobicContact CG-CE2 4.09Å; F264-F351 HydrophobicContact CG-CZ 4.43Å
265	P	86.6	Confident	95.2	Very high	144 Å²	144	36.4 Å²	36.4	94%	0.935	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-15.3	-178.2	-27.1	35.6	0	0	0	115.9
266	G	87	Confident	95.1	Very high	57 Å²	57	38.5 Å²	38.5	59%	0.588	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.4	5.9	172.8	0	0	0	0	0	115	F264 S268	F264-G266 PolarHBondContact O-N 3.4Å; G266-S268 PolarHBondContact O-N 3.42Å; G266-S268 PolarHBondContact O-OG 3.11Å
267	G	94.2	Very high	94.9	Very high	24 Å²	24	44.6 Å²	44.6	25%	0.247	25%	0.254	C	S	.	.	S	Bend	trans	63.7	19.2	179.2	0	0	0	0	0	114.9	F264 Y350 F351	F264-G267 PolarHBondContact O-N 2.98Å; G267-Y350 WeakPolarHBondContact O-CA 3.45Å; G267-Y350 WeakPolarHBondContact O-CD1 3.36Å; G267-F351 WeakPolarHBondContact O-CD2 3.42Å; G267-F351 PolarHBondContact O-N 3.13Å; G267-F351 VanDerWaalsContact O-N 3.16Å
268	S	96.9	Very high	94.7	Very high	20 Å²	20	46.6 Å²	46.6	14%	0.14	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	154.1	-175.3	50.7	0	0	0	0	114.3	F264 G266 F349	F264-S268 WeakPolarHBondContact CD1-O 3.48Å; G266-S268 PolarHBondContact O-N 3.42Å; G266-S268 PolarHBondContact O-OG 3.11Å; S268-F349 CarbonylContact C-O 3.53Å; S268-F349 WeakPolarHBondContact CA-O 3.5Å; S268-F349 WeakPolarHBondContact CB-O 3.49Å
269	V	97.3	Very high	94.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	123.9	169.7	178.5	0	0	0	0	108.3	P198 W259 F264 I271 F349 F351 M356	P198-V269 HydrophobicContact CG-CG1 4.08Å; W259-V269 HydrophobicContact CB-CG2 3.82Å; W259-V269 HydrophobicContact CD2-CG1 3.96Å; W259-V269 HydrophobicContact CD2-CG2 3.96Å; W259-V269 HydrophobicContact CE3-CG1 4.25Å; W259-V269 HydrophobicContact CE3-CG2 4.17Å; W259-V269 HydrophobicContact CG-CG1 4.39Å; W259-V269 HydrophobicContact CG-CG2 3.83Å; W259-V269 HydrophobicContact CZ2-CG1 4.28Å; F264-V269 HydrophobicContact CD2-CG2 4.46Å; F264-V269 HydrophobicContact CE1-CG2 4.39Å; F264-V269 HydrophobicContact CE2-CG2 4.33Å; F264-V269 HydrophobicContact CZ-CG2 4.28Å; V269-I271 HydrophobicContact CG1-CD1 4.49Å; V269-I271 HydrophobicContact CG1-CG1 4.07Å; V269-F349 PolarHBondContact N-O 3.25Å; V269-F349 PolarHBondContact O-N 2.93Å; V269-F351 HydrophobicContact CG2-CE1 4.4Å; V269-F351 HydrophobicContact CG2-CE2 3.83Å; V269-F351 HydrophobicContact CG2-CZ 3.51Å; V269-M356 HydrophobicContact CB-CE 3.72Å; V269-M356 HydrophobicContact CG2-CE 3.43Å; V269-M356 VanDerWaalsContact CG2-CE 3.43Å
270	E	97.1	Very high	94.2	Very high	79 Å²	79	49.1 Å²	49.1	37%	0.369	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	126.6	172.6	-176.4	163.5	104.8	0	0	110.4	P198 K346 C347 Q348	P198-E270 VanDerWaalsContact CD-O 3.28Å; P198-E270 WeakPolarHBondContact CD-O 3.47Å; E270-K346 VanDerWaalsContact CD-NZ 3.34Å; E270-K346 HydrophobicContact CG-CD 4.25Å; E270-K346 HydrophobicContact CG-CG 3.84Å; E270-K346 WeakPolarHBondContact OE1-CD 3.37Å; E270-K346 IonicContact OE1-NZ 3.65Å; E270-K346 PolarHBondContact OE1-NZ 3.04Å; E270-K346 IonicContact OE2-NZ 3.81Å; E270-K346 PolarHBondContact OE2-NZ 3.26Å; E270-C347 WeakPolarHBondContact CA-O 3.44Å; E270-Q348 HydrophobicContact CB-CG 4.27Å; E270-Q348 HydrophobicContact CG-CG 4.15Å; E270-Q348 WeakPolarHBondContact OE2-CG 3.35Å; E270-Q348 PolarHBondContact OE2-NE2 3.36Å
271	I	97.9	Very high	94.1	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	127.8	171.8	-51.4	-179.5	0	0	0	108.4	N196 A197 W259 V269 F273 C347 F349 F358 I361	N196-I271 WeakPolarHBondContact O-CA 3.34Å; A197-I271 HydrophobicContact CB-CD1 4.5Å; A197-I271 HydrophobicContact CB-CG1 4.06Å; A197-I271 HydrophobicContact CB-CG2 4.18Å; W259-I271 HydrophobicContact CH2-CD1 3.94Å; W259-I271 HydrophobicContact CZ2-CD1 4.41Å; V269-I271 HydrophobicContact CG1-CD1 4.49Å; V269-I271 HydrophobicContact CG1-CG1 4.07Å; I271-F273 HydrophobicContact CB-CE2 3.83Å; I271-F273 HydrophobicContact CB-CZ 3.91Å; I271-F273 HydrophobicContact CG2-CD1 4.39Å; I271-F273 HydrophobicContact CG2-CD2 4.19Å; I271-F273 HydrophobicContact CG2-CE1 3.77Å; I271-F273 HydrophobicContact CG2-CE2 3.55Å; I271-F273 HydrophobicContact CG2-CZ 3.31Å; I271-C347 PolarHBondContact N-O 3.07Å; I271-C347 PolarHBondContact O-N 3.04Å; I271-F349 HydrophobicContact CB-CE2 4.26Å; I271-F349 HydrophobicContact CD1-CD2 4.2Å; I271-F349 HydrophobicContact CD1-CE2 3.97Å; I271-F349 HydrophobicContact CG1-CD2 4.29Å; I271-F349 HydrophobicContact CG1-CE2 4.2Å; I271-F358 HydrophobicContact CD1-CD2 4.3Å; I271-F358 HydrophobicContact CD1-CE2 4.25Å; I271-I361 HydrophobicContact CD1-CD1 4.3Å
272	M	97.4	Very high	93.8	Very high	39 Å²	39	47.1 Å²	47.1	19%	0.192	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	129.5	175.7	-171.6	179.5	77.7	0	0	110	Y195 N196 E274 W312 I345 K346	Y195-M272 CarbonylContact C-O 3.54Å; Y195-M272 WeakPolarHBondContact CA-O 3.47Å; N196-M272 HydrophobicContact CB-CB 4.43Å; N196-M272 PolarHBondContact N-O 2.87Å; N196-M272 PolarHBondContact O-N 3.43Å; M272-E274 HydrophobicContact CE-CG 4.16Å; M272-W312 HydrophobicContact CG-CH2 4.16Å; M272-W312 HydrophobicContact SD-CH2 4.1Å; M272-W312 HydrophobicContact SD-CZ2 3.85Å; M272-I345 CarbonylContact C-O 3.19Å; M272-I345 WeakPolarHBondContact CA-O 3.36Å; M272-K346 HydrophobicContact CB-CG 4.33Å; M272-K346 HydrophobicContact CG-CB 4.37Å; M272-K346 HydrophobicContact CG-CG 4.48Å
273	F	97.6	Very high	93.8	Very high	1 Å²	1	40.8 Å²	40.8	0%	0.004	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129.2	-176.2	-59.3	-88.1	0	0	0	109.2	L192 I271 F275 A344 I345 C347 I361 F363	L192-F273 HydrophobicContact CD1-CB 3.67Å; L192-F273 HydrophobicContact CD1-CD1 3.92Å; L192-F273 HydrophobicContact CD1-CG 4.3Å; L192-F273 HydrophobicContact CD2-CD1 4.16Å; I271-F273 HydrophobicContact CB-CE2 3.83Å; I271-F273 HydrophobicContact CB-CZ 3.91Å; I271-F273 HydrophobicContact CG2-CD1 4.39Å; I271-F273 HydrophobicContact CG2-CD2 4.19Å; I271-F273 HydrophobicContact CG2-CE1 3.77Å; I271-F273 HydrophobicContact CG2-CE2 3.55Å; I271-F273 HydrophobicContact CG2-CZ 3.31Å; F273-F275 HydrophobicContact CB-CE2 3.69Å; F273-F275 HydrophobicContact CB-CZ 3.92Å; F273-A344 CarbonylContact O-C 3.57Å; F273-A344 WeakPolarHBondContact O-CA 3.4Å; F273-A344 WeakPolarHBondContact O-CB 3.32Å; F273-I345 PolarHBondContact N-O 2.96Å; F273-I345 PolarHBondContact O-N 2.85Å; F273-C347 HydrophobicContact CE2-CB 4.06Å; F273-I361 HydrophobicContact CE1-CB 4.44Å; F273-I361 HydrophobicContact CE1-CD1 4.19Å; F273-I361 HydrophobicContact CE1-CG2 3.85Å; F273-I361 HydrophobicContact CZ-CD1 3.89Å; F273-I361 HydrophobicContact CZ-CG2 3.92Å; F273-F363 HydrophobicContact CB-CE2 4.44Å; F273-F363 HydrophobicContact CB-CZ 4.12Å; F273-F363 AromaticContact CD1-CE2 3.57Å; F273-F363 HydrophobicContact CD1-CE2 3.57Å; F273-F363 AromaticContact CD1-CZ 3.57Å; F273-F363 HydrophobicContact CD1-CZ 3.57Å; F273-F363 AromaticContact CD2-CZ 3.73Å; F273-F363 HydrophobicContact CD2-CZ 3.73Å; F273-F363 AromaticContact CE1-CE2 3.87Å; F273-F363 HydrophobicContact CE1-CE2 3.87Å; F273-F363 AromaticContact CE1-CZ 3.81Å; F273-F363 HydrophobicContact CE1-CZ 3.81Å; F273-F363 AromaticContact CE2-CZ 3.96Å; F273-F363 HydrophobicContact CE2-CZ 3.96Å; F273-F363 AromaticContact CG-CE2 3.96Å; F273-F363 HydrophobicContact CG-CE2 3.96Å; F273-F363 AromaticContact CG-CZ 3.53Å; F273-F363 HydrophobicContact CG-CZ 3.53Å; F273-F363 HydrophobicContact CZ-CE2 4.47Å; F273-F363 AromaticContact CZ-CZ 3.99Å; F273-F363 HydrophobicContact CZ-CZ 3.99Å
274	E	95.8	Very high	93.9	Very high	59 Å²	59	37.9 Å²	37.9	28%	0.276	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	134.5	178.6	-59.3	-158.8	136.2	0	0	111	V193 S194 M272 R307 A344	V193-E274 PolarHBondContact N-O 2.93Å; S194-E274 PolarHBondContact N-O 2.86Å; S194-E274 PolarHBondContact O-N 2.89Å; M272-E274 HydrophobicContact CE-CG 4.16Å; E274-R307 IonicContact OE1-CZ 2.77Å; E274-R307 IonicContact OE1-NH1 3.33Å; E274-R307 IonicContact OE1-NH2 3.28Å; E274-R307 PolarHBondContact OE1-NH2 2.79Å; E274-A344 HydrophobicContact CG-CB 4.08Å
275	F	94.7	Very high	93.9	Very high	17 Å²	17	38 Å²	38	8%	0.075	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	159.2	-168.9	-60.3	-95.8	0	0	0	112.3	G191 L192 F273 R277 F281 S343 I345 F363	G191-F275 WeakPolarHBondContact O-CA 3.26Å; L192-F275 HydrophobicContact CB-CD1 4.1Å; L192-F275 HydrophobicContact CB-CE1 3.92Å; L192-F275 HydrophobicContact CD1-CD1 4.17Å; L192-F275 HydrophobicContact CD1-CE1 3.75Å; L192-F275 HydrophobicContact CD1-CE2 4.19Å; L192-F275 HydrophobicContact CD1-CZ 3.77Å; L192-F275 HydrophobicContact CG-CE1 4.43Å; F273-F275 HydrophobicContact CB-CE2 3.69Å; F273-F275 HydrophobicContact CB-CZ 3.92Å; F275-R277 PolarHBondContact O-N 2.72Å; F275-F281 AromaticContact CD1-CE1 3.99Å; F275-F281 HydrophobicContact CD1-CE1 3.99Å; F275-F281 AromaticContact CD1-CZ 3.7Å; F275-F281 HydrophobicContact CD1-CZ 3.7Å; F275-F281 HydrophobicContact CD2-CE1 4.45Å; F275-F281 HydrophobicContact CD2-CE2 4.46Å; F275-F281 AromaticContact CD2-CZ 3.69Å; F275-F281 HydrophobicContact CD2-CZ 3.69Å; F275-F281 AromaticContact CE1-CE1 3.56Å; F275-F281 HydrophobicContact CE1-CE1 3.56Å; F275-F281 AromaticContact CE1-CZ 3.7Å; F275-F281 HydrophobicContact CE1-CZ 3.7Å; F275-F281 HydrophobicContact CE2-CE1 4.07Å; F275-F281 AromaticContact CE2-CZ 3.69Å; F275-F281 HydrophobicContact CE2-CZ 3.69Å; F275-F281 HydrophobicContact CG-CE1 4.43Å; F275-F281 AromaticContact CG-CZ 3.72Å; F275-F281 HydrophobicContact CG-CZ 3.72Å; F275-F281 AromaticContact CZ-CE1 3.61Å; F275-F281 HydrophobicContact CZ-CE1 3.61Å; F275-F281 AromaticContact CZ-CZ 3.69Å; F275-F281 HydrophobicContact CZ-CZ 3.69Å; F275-S343 PolarHBondContact N-O 3.03Å; F275-I345 HydrophobicContact CE2-CB 4.38Å; F275-I345 HydrophobicContact CE2-CD1 3.95Å; F275-I345 HydrophobicContact CE2-CG1 3.86Å; F275-I345 HydrophobicContact CZ-CD1 4.18Å; F275-F363 HydrophobicContact CE1-CB 4.13Å; F275-F363 HydrophobicContact CE1-CD1 4.44Å; F275-F363 AromaticContact CE1-CD2 3.81Å; F275-F363 HydrophobicContact CE1-CD2 3.81Å; F275-F363 HydrophobicContact CE1-CE2 4.37Å; F275-F363 AromaticContact CE1-CG 3.87Å; F275-F363 HydrophobicContact CE1-CG 3.87Å; F275-F363 HydrophobicContact CZ-CB 4.41Å; F275-F363 AromaticContact CZ-CD1 3.88Å; F275-F363 HydrophobicContact CZ-CD1 3.88Å; F275-F363 AromaticContact CZ-CD2 3.72Å; F275-F363 HydrophobicContact CZ-CD2 3.72Å; F275-F363 HydrophobicContact CZ-CE1 4.03Å; F275-F363 AromaticContact CZ-CE2 3.9Å; F275-F363 HydrophobicContact CZ-CE2 3.9Å; F275-F363 AromaticContact CZ-CG 3.73Å; F275-F363 HydrophobicContact CZ-CG 3.73Å; F275-F363 HydrophobicContact CZ-CZ 4.06Å
276	D	90.9	Very high	94.4	Very high	48 Å²	48	31.1 Å²	31.1	26%	0.257	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	-19.2	-174	72.8	-30.3	0	0	0	115.3	L95 G191 V193 R279	L95-D276 HydrophobicContact CD1-CB 3.83Å; G191-D276 PolarHBondContact O-N 3Å; V193-D276 HydrophobicContact CG2-CB 3.81Å; D276-R279 IonicContact OD1-CZ 3.55Å; D276-R279 VanDerWaalsContact OD1-CZ 3.25Å; D276-R279 IonicContact OD1-NE 3.54Å; D276-R279 PolarHBondContact OD1-NE 3.14Å; D276-R279 IonicContact OD1-NH2 2.72Å; D276-R279 PolarHBondContact OD1-NH2 3.12Å; D276-R279 IonicContact OD2-NH2 2.67Å; D276-R279 PolarHBondContact OD2-NH2 2.91Å
277	R	90.6	Very high	94.9	Very high	129 Å²	129	29.1 Å²	29.1	49%	0.487	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	172.4	177.4	67	-156.5	72.1	-123.1	1.3	110.5	F275 R279	F275-R277 PolarHBondContact O-N 2.72Å; R277-R279 HydrophobicContact CG-CG 4.04Å; R277-R279 PolarHBondContact O-N 2.93Å
278	I	92.9	Very high	95	Very high	41 Å²	41	28 Å²	28	21%	0.21	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	125.8	170.4	-51.4	174	0	0	0	109.5	M341 A342 Y370	I278-M341 HydrophobicContact CG2-CE 3.56Å; I278-A342 CarbonylContact C-O 3.58Å; I278-A342 WeakPolarHBondContact CA-O 3.43Å; I278-Y370 WeakPolarHBondContact CD1-OH 3.22Å
279	R	92.5	Very high	95	Very high	14 Å²	14	27.1 Å²	27.1	5%	0.053	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	154.3	-173.6	-77.3	166.7	173.3	-95.9	1.5	111.4	L189 D190 G191 D276 R277 F281 M341 A342 S365	L189-R279 PolarHBondContact O-NH1 2.86Å; D190-R279 PolarHBondContact O-NH1 3.06Å; G191-R279 VanDerWaalsContact CA-NH2 3.28Å; D276-R279 IonicContact OD1-CZ 3.55Å; D276-R279 VanDerWaalsContact OD1-CZ 3.25Å; D276-R279 IonicContact OD1-NE 3.54Å; D276-R279 PolarHBondContact OD1-NE 3.14Å; D276-R279 IonicContact OD1-NH2 2.72Å; D276-R279 PolarHBondContact OD1-NH2 3.12Å; D276-R279 IonicContact OD2-NH2 2.67Å; D276-R279 PolarHBondContact OD2-NH2 2.91Å; R277-R279 HydrophobicContact CG-CG 4.04Å; R277-R279 PolarHBondContact O-N 2.93Å; R279-F281 HydrophobicContact CB-CD2 4.26Å; R279-F281 HydrophobicContact CB-CE2 3.59Å; R279-F281 HydrophobicContact CB-CZ 3.75Å; R279-F281 WeakPolarHBondContact O-CD2 3.45Å; R279-M341 WeakPolarHBondContact O-CA 3.37Å; R279-A342 PolarHBondContact N-O 2.7Å; R279-A342 PolarHBondContact O-N 2.67Å; R279-S365 PolarHBondContact NH1-OG 2.63Å; R279-S365 VanDerWaalsContact NH1-OG 3.13Å
280	N	92.3	Very high	94.9	Very high	40 Å²	40	27.6 Å²	27.6	21%	0.214	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	106.6	177.5	177.5	7	0	0	0	109.7	N339 M341 S365 D366	N280-N339 VanDerWaalsContact OD1-C 3.27Å; N280-N339 WeakPolarHBondContact OD1-CA 3.38Å; N280-N339 VanDerWaalsContact OD1-CB 3.23Å; N280-N339 WeakPolarHBondContact OD1-CB 3.35Å; N280-N339 PolarHBondContact OD1-O 3.3Å; N280-M341 HydrophobicContact CB-SD 3.73Å; N280-S365 CarbonylContact O-C 3.57Å; N280-S365 WeakPolarHBondContact O-CA 3.35Å; N280-S365 WeakPolarHBondContact O-CB 3.21Å; N280-D366 HydrophobicContact CB-CB 4.37Å; N280-D366 WeakPolarHBondContact CB-O 3.31Å; N280-D366 PolarHBondContact N-O 3.16Å; N280-D366 PolarHBondContact O-N 2.92Å
281	F	93.4	Very high	94.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	112.7	-169.4	-72.3	-85.2	0	0	0	113.6	F275 R279 L337 N339 H340 A342 I345 F363	F275-F281 AromaticContact CD1-CE1 3.99Å; F275-F281 HydrophobicContact CD1-CE1 3.99Å; F275-F281 AromaticContact CD1-CZ 3.7Å; F275-F281 HydrophobicContact CD1-CZ 3.7Å; F275-F281 HydrophobicContact CD2-CE1 4.45Å; F275-F281 HydrophobicContact CD2-CE2 4.46Å; F275-F281 AromaticContact CD2-CZ 3.69Å; F275-F281 HydrophobicContact CD2-CZ 3.69Å; F275-F281 AromaticContact CE1-CE1 3.56Å; F275-F281 HydrophobicContact CE1-CE1 3.56Å; F275-F281 AromaticContact CE1-CZ 3.7Å; F275-F281 HydrophobicContact CE1-CZ 3.7Å; F275-F281 HydrophobicContact CE2-CE1 4.07Å; F275-F281 AromaticContact CE2-CZ 3.69Å; F275-F281 HydrophobicContact CE2-CZ 3.69Å; F275-F281 HydrophobicContact CG-CE1 4.43Å; F275-F281 AromaticContact CG-CZ 3.72Å; F275-F281 HydrophobicContact CG-CZ 3.72Å; F275-F281 AromaticContact CZ-CE1 3.61Å; F275-F281 HydrophobicContact CZ-CE1 3.61Å; F275-F281 AromaticContact CZ-CZ 3.69Å; F275-F281 HydrophobicContact CZ-CZ 3.69Å; R279-F281 HydrophobicContact CB-CD2 4.26Å; R279-F281 HydrophobicContact CB-CE2 3.59Å; R279-F281 HydrophobicContact CB-CZ 3.75Å; R279-F281 WeakPolarHBondContact O-CD2 3.45Å; F281-L337 HydrophobicContact CB-CB 3.89Å; F281-L337 HydrophobicContact CB-CD1 3.77Å; F281-L337 HydrophobicContact CD1-CD1 4.23Å; F281-L337 HydrophobicContact CG-CD1 4.27Å; F281-L337 CarbonylContact O-C 3.55Å; F281-L337 WeakPolarHBondContact O-CB 3.43Å; F281-N339 WeakPolarHBondContact O-CA 3.15Å; F281-N339 PolarHBondContact O-N 3.08Å; F281-H340 PolarHBondContact N-O 3.15Å; F281-A342 HydrophobicContact CD2-CB 4.05Å; F281-A342 HydrophobicContact CE2-CB 3.9Å; F281-A342 WeakPolarHBondContact CE2-O 3.3Å; F281-I345 HydrophobicContact CB-CD1 4.48Å; F281-I345 HydrophobicContact CD1-CD1 3.75Å; F281-I345 HydrophobicContact CD2-CD1 3.86Å; F281-I345 HydrophobicContact CE1-CD1 3.86Å; F281-I345 HydrophobicContact CE2-CD1 3.95Å; F281-I345 HydrophobicContact CE2-CG1 4.41Å; F281-I345 HydrophobicContact CG-CD1 3.75Å; F281-I345 HydrophobicContact CZ-CD1 3.95Å; F281-F363 HydrophobicContact CD1-CB 4.08Å; F281-F363 HydrophobicContact CD1-CD1 4.12Å; F281-F363 HydrophobicContact CD1-CG 4.49Å; F281-F363 HydrophobicContact CE1-CB 3.89Å; F281-F363 HydrophobicContact CE1-CD1 4.14Å; F281-F363 HydrophobicContact CE1-CG 4.23Å
282	T	92	Very high	94.4	Very high	34 Å²	34	28.1 Å²	28.1	21%	0.209	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-44.8	178.3	70.6	0	0	0	0	111.7	L337 Q364	T282-L337 PolarHBondContact O-N 3.32Å; T282-Q364 PolarHBondContact N-O 2.85Å; T282-Q364 WeakPolarHBondContact OG1-CB 3.48Å; T282-Q364 WeakPolarHBondContact OG1-CG 3.46Å; T282-Q364 PolarHBondContact OG1-O 3.17Å
283	S	93.6	Very high	94.1	Very high	11 Å²	11	30.5 Å²	30.5	8%	0.077	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	158.2	179.9	61.1	0	0	0	0	113.2	V335 Q364	S283-V335 CarbonylContact C-O 3.48Å; S283-V335 WeakPolarHBondContact CA-O 3.45Å; S283-V335 VanDerWaalsContact CB-O 3.27Å; S283-V335 WeakPolarHBondContact CB-O 3.44Å; S283-Q364 PolarHBondContact N-O 3.11Å; S283-Q364 PolarHBondContact O-N 2.9Å
284	M	95.6	Very high	93.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	142.4	166.2	171.2	-177.6	69.3	0	0	108.1	V286 V302 T334 V335 L337 F349 I361 T362 F363	M284-V286 HydrophobicContact CE-CG2 4.05Å; M284-V286 HydrophobicContact CG-CG2 4.09Å; M284-V286 HydrophobicContact SD-CG2 4.16Å; M284-V302 HydrophobicContact CE-CG2 4.35Å; M284-T334 CarbonylContact O-C 3.57Å; M284-V335 HydrophobicContact CB-CB 4.39Å; M284-V335 HydrophobicContact CE-CB 4Å; M284-V335 HydrophobicContact CE-CG1 4.22Å; M284-V335 HydrophobicContact CE-CG2 3.82Å; M284-V335 PolarHBondContact N-O 3.14Å; M284-V335 PolarHBondContact O-N 2.93Å; M284-L337 HydrophobicContact CB-CD1 3.81Å; M284-L337 HydrophobicContact CB-CD2 4.46Å; M284-L337 HydrophobicContact CB-CG 4.18Å; M284-F349 HydrophobicContact CE-CE1 3.92Å; M284-F349 HydrophobicContact CE-CZ 3.78Å; M284-F349 HydrophobicContact SD-CZ 4.21Å; M284-I361 HydrophobicContact CG-CG2 4.14Å; M284-I361 HydrophobicContact SD-CG2 4.26Å; M284-T362 CarbonylContact C-O 3.37Å; M284-T362 WeakPolarHBondContact CA-O 3.44Å; M284-F363 HydrophobicContact CB-CD1 3.8Å; M284-F363 HydrophobicContact CB-CE1 3.77Å; M284-F363 HydrophobicContact CG-CD1 4.02Å; M284-F363 HydrophobicContact CG-CE1 3.6Å; M284-F363 HydrophobicContact CG-CZ 3.93Å; M284-F363 HydrophobicContact SD-CD1 4.5Å; M284-F363 HydrophobicContact SD-CE1 3.53Å; M284-F363 VanDerWaalsContact SD-CE1 3.53Å; M284-F363 HydrophobicContact SD-CZ 3.68Å
285	K	95.4	Very high	93.8	Very high	41 Å²	41	37.1 Å²	37.1	18%	0.178	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	125	176.3	-62.7	178.5	-177.3	170.2	0	109.1	F332 I333 T334 I361 T362	K285-F332 HydrophobicContact CB-CD1 3.8Å; K285-F332 HydrophobicContact CB-CE1 4.41Å; K285-I333 WeakPolarHBondContact CA-O 3.49Å; K285-T334 HydrophobicContact CG-CG2 4.17Å; K285-I361 WeakPolarHBondContact O-CA 3.36Å; K285-T362 PolarHBondContact N-O 2.83Å; K285-T362 PolarHBondContact O-N 2.91Å
286	V	96.9	Very high	93.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	120.2	-179.6	-177.7	0	0	0	0	108.8	M284 C288 F299 F332 I333 F349 F358 I361	M284-V286 HydrophobicContact CE-CG2 4.05Å; M284-V286 HydrophobicContact CG-CG2 4.09Å; M284-V286 HydrophobicContact SD-CG2 4.16Å; V286-C288 PolarHBondContact O-N 3.36Å; V286-F299 HydrophobicContact CB-CE1 4.11Å; V286-F299 HydrophobicContact CG1-CE1 4.25Å; V286-F299 HydrophobicContact CG2-CE1 4.4Å; V286-F332 WeakPolarHBondContact O-CA 3.18Å; V286-I333 PolarHBondContact N-O 3.11Å; V286-I333 PolarHBondContact O-N 2.88Å; V286-F349 HydrophobicContact CG2-CE1 3.96Å; V286-F349 HydrophobicContact CG2-CZ 4.11Å; V286-F358 HydrophobicContact CG1-CB 4.31Å; V286-F358 HydrophobicContact CG1-CD1 3.49Å; V286-F358 VanDerWaalsContact CG1-CD1 3.49Å; V286-F358 HydrophobicContact CG1-CD2 3.88Å; V286-F358 HydrophobicContact CG1-CE1 3.69Å; V286-F358 HydrophobicContact CG1-CE2 4.04Å; V286-F358 HydrophobicContact CG1-CG 3.62Å; V286-F358 HydrophobicContact CG1-CZ 3.96Å; V286-I361 HydrophobicContact CG1-CD1 4.47Å; V286-I361 HydrophobicContact CG1-CG1 4.19Å; V286-I361 HydrophobicContact CG2-CG1 4.4Å; V286-I361 HydrophobicContact CG2-CG2 4.27Å
287	H	97	Very high	94	Very high	15 Å²	15	35.5 Å²	35.5	7%	0.069	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	106.1	174.3	-165.4	-104.5	0	0	0	110.1	G238 R331 F332 F358 S359 E360	G238-H287 PolarHBondContact O-CE1 3.47Å; H287-R331 WeakPolarHBondContact CA-O 3.3Å; H287-R331 VanDerWaalsContact CD2-C 3.41Å; H287-F332 HydrophobicContact CB-CD1 3.91Å; H287-F332 HydrophobicContact CB-CE1 3.68Å; H287-F332 HydrophobicContact CB-CE2 4.48Å; H287-F332 HydrophobicContact CB-CG 4.44Å; H287-F332 HydrophobicContact CB-CZ 3.98Å; H287-F332 AromaticContact CD2-CD2 3.77Å; H287-F332 AromaticContact CD2-CE2 3.8Å; H287-F358 VanDerWaalsContact O-CA 3.3Å; H287-F358 WeakPolarHBondContact O-CA 3.27Å; H287-S359 PolarHBondContact ND1-OG 3.13Å; H287-S359 PolarHBondContact O-N 3.5Å; H287-S359 VanDerWaalsContact O-N 3.08Å; H287-E360 HydrophobicContact CB-CB 3.88Å; H287-E360 PolarHBondContact N-O 3.03Å
288	C	96.3	Very high	94.2	Very high	1 Å²	1	30 Å²	30	1%	0.007	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	139.1	-176.6	-53.6	0	0	0	0	110.4	V286 A298 A330 R331 L357 F358	V286-C288 PolarHBondContact O-N 3.36Å; C288-A298 HydrophobicContact CB-CB 3.54Å; C288-A330 CarbonylContact O-C 3.13Å; C288-A330 WeakPolarHBondContact O-CA 3.39Å; C288-A330 WeakPolarHBondContact O-CB 3.39Å; C288-R331 PolarHBondContact N-O 2.89Å; C288-R331 PolarHBondContact O-N 3.04Å; C288-L357 WeakPolarHBondContact CA-O 3.47Å; C288-F358 HydrophobicContact CB-CD1 4.41Å
289	N	96.8	Very high	94.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.143	C	C	.	.			trans	-75.9	150.9	162.2	-166.3	-87.3	0	0	0	110.4	E239 D240 Y256 M291 V296 K297 A298 L357	E239-N289 PolarHBondContact O-ND2 3.46Å; D240-N289 PolarHBondContact O-ND2 3.07Å; Y256-N289 HydrophobicContact CD1-CB 4.42Å; Y256-N289 HydrophobicContact CE1-CB 3.7Å; Y256-N289 HydrophobicContact CE2-CB 4.48Å; Y256-N289 PolarHBondContact OH-ND2 2.98Å; N289-M291 WeakPolarHBondContact OD1-CB 3.28Å; N289-M291 PolarHBondContact OD1-N 3.12Å; N289-V296 HydrophobicContact CB-CG1 3.91Å; N289-V296 WeakPolarHBondContact OD1-CG1 3.41Å; N289-K297 CarbonylContact O-C 3.55Å; N289-A298 PolarHBondContact O-N 3.5Å; N289-L357 HydrophobicContact CB-CB 4.08Å; N289-L357 HydrophobicContact CB-CD1 4.25Å; N289-L357 PolarHBondContact N-O 2.9Å; N289-L357 VanDerWaalsContact N-O 3.14Å
290	N	95.6	Very high	94.4	Very high	11 Å²	11	32 Å²	32	6%	0.059	16%	0.162	C	C	.	.			trans	-133.5	28.5	179.5	-158	57.7	0	0	0	113.1	F292 V296 A298 D324 N327 P328	N290-F292 WeakPolarHBondContact O-CD1 3.29Å; N290-F292 PolarHBondContact O-N 3.46Å; N290-V296 CarbonylContact C-O 3.55Å; N290-A298 PolarHBondContact OD1-N 2.79Å; N290-D324 PolarHBondContact ND2-O 3.01Å; N290-N327 PolarHBondContact ND2-O 2.81Å; N290-P328 CarbonylContact C-O 3.47Å; N290-P328 WeakPolarHBondContact O-CA 3.26Å
291	M	94.1	Very high	94.7	Very high	26 Å²	26	33.2 Å²	33.2	13%	0.128	17%	0.166	C	C	.	.			trans	-72.3	70.4	179.1	-169.9	-179.2	-108.9	0	0	111.9	D241 F242 N289 S293 R294 V296 P328	D241-M291 HydrophobicContact CB-CE 3.69Å; F242-M291 HydrophobicContact CD1-CB 4.18Å; F242-M291 HydrophobicContact CD1-SD 4.11Å; F242-M291 HydrophobicContact CE1-CB 4.12Å; F242-M291 HydrophobicContact CE1-CG 4.41Å; F242-M291 HydrophobicContact CE1-SD 3.86Å; N289-M291 WeakPolarHBondContact OD1-CB 3.28Å; N289-M291 PolarHBondContact OD1-N 3.12Å; M291-S293 WeakPolarHBondContact CG-OG 3.06Å; M291-S293 PolarHBondContact O-N 3.47Å; M291-S293 VanDerWaalsContact O-N 3.08Å; M291-R294 HydrophobicContact CG-CB 4.49Å; M291-R294 HydrophobicContact CG-CG 4.21Å; M291-R294 PolarHBondContact O-N 3.39Å; M291-R294 VanDerWaalsContact SD-CD 3.51Å; M291-R294 HydrophobicContact SD-CG 3.81Å; M291-R294 PolarHBondContact SD-NE 3.04Å; M291-R294 VanDerWaalsContact SD-NE 3.39Å; M291-V296 CarbonylContact C-O 3.54Å; M291-V296 PolarHBondContact N-O 3.27Å; M291-V296 PolarHBondContact O-N 2.94Å; M291-P328 PolarHBondContact N-O 2.84Å
292	F	91.4	Very high	94.9	Very high	64 Å²	64	33.2 Å²	33.2	28%	0.281	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-60.7	-21	-177.3	53	-103.4	0	0	0	113.4	N290 R294 H295 V296 K297 E325 P328	N290-F292 WeakPolarHBondContact O-CD1 3.29Å; N290-F292 PolarHBondContact O-N 3.46Å; F292-R294 PolarHBondContact O-N 3.47Å; F292-R294 VanDerWaalsContact O-N 3.14Å; F292-H295 PolarHBondContact O-N 2.57Å; F292-V296 VanDerWaalsContact CA-O 3.25Å; F292-V296 WeakPolarHBondContact CA-O 3.41Å; F292-V296 PolarHBondContact N-O 3.48Å; F292-K297 HydrophobicContact CB-CG 4.06Å; F292-E325 WeakPolarHBondContact CZ-O 3.47Å; F292-P328 HydrophobicContact CE1-CB 4.01Å; F292-P328 HydrophobicContact CZ-CB 4.37Å
293	S	90.7	Very high	95.1	Very high	89 Å²	89	32.5 Å²	32.5	62%	0.622	16%	0.162	S	C	*	.	G	3₁₀ helix	trans	-63	-11.7	170	57	0	0	0	0	114.3	M291	M291-S293 WeakPolarHBondContact CG-OG 3.06Å; M291-S293 PolarHBondContact O-N 3.47Å; M291-S293 VanDerWaalsContact O-N 3.08Å
294	R	91.6	Very high	95.3	Very high	81 Å²	81	32 Å²	32	31%	0.306	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-120.1	21.5	171.5	-60	-171.4	-173.1	-85.4	12.1	113	F242 M291 F292 V296	F242-R294 HydrophobicContact CE1-CB 4.06Å; F242-R294 HydrophobicContact CE1-CG 4.4Å; F242-R294 HydrophobicContact CZ-CB 4.07Å; F242-R294 VanDerWaalsContact CZ-CD 3.46Å; F242-R294 HydrophobicContact CZ-CG 4.43Å; M291-R294 HydrophobicContact CG-CB 4.49Å; M291-R294 HydrophobicContact CG-CG 4.21Å; M291-R294 PolarHBondContact O-N 3.39Å; M291-R294 VanDerWaalsContact SD-CD 3.51Å; M291-R294 HydrophobicContact SD-CG 3.81Å; M291-R294 PolarHBondContact SD-NE 3.04Å; M291-R294 VanDerWaalsContact SD-NE 3.39Å; F292-R294 PolarHBondContact O-N 3.47Å; F292-R294 VanDerWaalsContact O-N 3.14Å; R294-V296 VanDerWaalsContact C-N 3.25Å; R294-V296 PolarHBondContact O-N 2.93Å
295	H	94.5	Very high	95.4	Very high	117 Å²	117	33.8 Å²	33.8	54%	0.542	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	29.5	-175.3	-59.7	-74.9	0	0	0	114.7	F292 D353 A354 W355	F292-H295 PolarHBondContact O-N 2.57Å; H295-D353 WeakPolarHBondContact CB-OD1 3.4Å; H295-D353 IonicContact CG-OD1 2.9Å; H295-D353 IonicContact ND1-OD1 3.23Å; H295-D353 PolarHBondContact ND1-OD1 3.41Å; H295-A354 HydrophobicContact CB-CB 3.89Å; H295-W355 PolarHBondContact O-N 3.27Å
296	V	95.8	Very high	95.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-104.2	123	171.8	174.3	0	0	0	0	109.4	M203 F242 N289 N290 M291 F292 R294 W355 L357	M203-V296 HydrophobicContact CE-CG2 3.79Å; F242-V296 HydrophobicContact CD1-CG2 4.29Å; F242-V296 HydrophobicContact CE1-CB 4.3Å; F242-V296 HydrophobicContact CE1-CG2 3.6Å; F242-V296 HydrophobicContact CZ-CG2 3.93Å; N289-V296 HydrophobicContact CB-CG1 3.91Å; N289-V296 WeakPolarHBondContact OD1-CG1 3.41Å; N290-V296 CarbonylContact C-O 3.55Å; M291-V296 CarbonylContact C-O 3.54Å; M291-V296 PolarHBondContact N-O 3.27Å; M291-V296 PolarHBondContact O-N 2.94Å; F292-V296 VanDerWaalsContact CA-O 3.25Å; F292-V296 WeakPolarHBondContact CA-O 3.41Å; F292-V296 PolarHBondContact N-O 3.48Å; R294-V296 VanDerWaalsContact C-N 3.25Å; R294-V296 PolarHBondContact O-N 2.93Å; V296-W355 HydrophobicContact CG2-CB 3.85Å; V296-L357 HydrophobicContact CG1-CB 4.38Å; V296-L357 HydrophobicContact CG1-CD1 3.84Å; V296-L357 HydrophobicContact CG1-CG 3.74Å; V296-L357 HydrophobicContact CG2-CD1 3.9Å; V296-L357 HydrophobicContact CG2-CG 4.15Å
297	K	95.1	Very high	95.3	Very high	32 Å²	32	34.4 Å²	34.4	14%	0.139	17%	0.167	C	C	.	.			trans	-133.8	159.8	170.2	-71.9	-172.5	-176.1	177	0	110.7	N289 F292 E325 A352 D353 W355	N289-K297 CarbonylContact O-C 3.55Å; F292-K297 HydrophobicContact CB-CG 4.06Å; K297-E325 IonicContact NZ-OE1 2.69Å; K297-E325 PolarHBondContact NZ-OE1 2.81Å; K297-A352 HydrophobicContact CB-CB 4Å; K297-A352 HydrophobicContact CD-CB 4.23Å; K297-D353 HydrophobicContact CB-CB 3.93Å; K297-D353 HydrophobicContact CD-CB 3.96Å; K297-D353 WeakPolarHBondContact CE-OD2 3.49Å; K297-D353 HydrophobicContact CG-CB 3.8Å; K297-W355 PolarHBondContact N-O 3.17Å
298	A	94.1	Very high	94.8	Very high	14 Å²	14	35.4 Å²	35.4	12%	0.116	18%	0.176	C	C	.	.			trans	-66.3	163.4	164.8	0	0	0	0	0	111.8	C288 N289 N290 I333 A352	C288-A298 HydrophobicContact CB-CB 3.54Å; N289-A298 PolarHBondContact O-N 3.5Å; N290-A298 PolarHBondContact OD1-N 2.79Å; A298-I333 HydrophobicContact CB-CD1 3.49Å; A298-I333 VanDerWaalsContact CB-CD1 3.49Å; A298-A352 WeakPolarHBondContact O-CB 3.27Å
299	F	95.8	Very high	94	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.009	20%	0.204	C	C	.	.			trans	-61.6	141.8	-177.6	57.1	-92.2	0	0	0	113.3	V286 V302 F319 P321 I333 V335 F349 Y350 M356 F358	V286-F299 HydrophobicContact CB-CE1 4.11Å; V286-F299 HydrophobicContact CG1-CE1 4.25Å; V286-F299 HydrophobicContact CG2-CE1 4.4Å; F299-V302 HydrophobicContact CD2-CB 4.13Å; F299-V302 HydrophobicContact CD2-CG1 4.5Å; F299-V302 HydrophobicContact CE2-CB 3.9Å; F299-V302 HydrophobicContact CE2-CG1 3.82Å; F299-V302 HydrophobicContact CZ-CG1 4.4Å; F299-F319 HydrophobicContact CE2-CD1 4.35Å; F299-P321 HydrophobicContact CD2-CG 4.15Å; F299-P321 HydrophobicContact CE2-CG 4.09Å; F299-P321 WeakPolarHBondContact O-CG 3.27Å; F299-I333 HydrophobicContact CE1-CB 4.28Å; F299-I333 HydrophobicContact CE1-CD1 4.28Å; F299-I333 HydrophobicContact CE1-CG2 4.32Å; F299-I333 HydrophobicContact CE2-CG2 4.27Å; F299-I333 HydrophobicContact CZ-CB 4.1Å; F299-I333 HydrophobicContact CZ-CD1 4.4Å; F299-I333 HydrophobicContact CZ-CG2 3.65Å; F299-V335 HydrophobicContact CE2-CG2 4.39Å; F299-V335 HydrophobicContact CZ-CG2 3.91Å; F299-F349 HydrophobicContact CB-CB 4.3Å; F299-F349 HydrophobicContact CB-CD1 4.4Å; F299-F349 AromaticContact CD1-CD1 3.72Å; F299-F349 HydrophobicContact CD1-CD1 3.72Å; F299-F349 HydrophobicContact CD1-CE1 4.22Å; F299-F349 HydrophobicContact CD2-CD1 4.27Å; F299-F349 AromaticContact CE1-CD1 3.95Å; F299-F349 HydrophobicContact CE1-CD1 3.95Å; F299-F349 AromaticContact CE1-CE1 3.99Å; F299-F349 HydrophobicContact CE1-CE1 3.99Å; F299-F349 HydrophobicContact CE2-CD1 4.47Å; F299-F349 AromaticContact CG-CD1 3.89Å; F299-F349 HydrophobicContact CG-CD1 3.89Å; F299-F349 HydrophobicContact CZ-CD1 4.32Å; F299-F349 HydrophobicContact CZ-CE1 4.25Å; F299-Y350 CarbonylContact C-O 3.14Å; F299-Y350 VanDerWaalsContact CA-O 3.28Å; F299-Y350 WeakPolarHBondContact CA-O 3.33Å; F299-Y350 WeakPolarHBondContact CB-O 3.49Å; F299-M356 HydrophobicContact CB-SD 3.73Å; F299-F358 AromaticContact CD1-CE1 3.88Å; F299-F358 HydrophobicContact CD1-CE1 3.88Å; F299-F358 AromaticContact CD1-CZ 3.86Å; F299-F358 HydrophobicContact CD1-CZ 3.86Å; F299-F358 HydrophobicContact CE1-CE1 4.49Å
300	Q	95.4	Very high	93	Very high	94 Å²	94	45.2 Å²	45.2	44%	0.439	24%	0.236	S	C	.	.	S	Bend	trans	-76.8	-30.1	175.9	-174.2	174.7	63	0	0	112.1	S320 E323 Y350 A352	Q300-S320 VanDerWaalsContact O-CB 3.3Å; Q300-S320 WeakPolarHBondContact O-CB 3.34Å; Q300-S320 PolarHBondContact O-OG 3.23Å; Q300-E323 PolarHBondContact NE2-OE1 2.84Å; Q300-Y350 PolarHBondContact N-O 3.15Å; Q300-A352 HydrophobicContact CB-CB 3.93Å
301	Q	96.8	Very high	92.6	Very high	66 Å²	66	50.4 Å²	50.4	31%	0.308	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	148.8	179	-169.2	171.9	21.3	0	0	110	V303 F319 S320 Y350	Q301-V303 HydrophobicContact CG-CG2 4.27Å; Q301-F319 CarbonylContact C-O 3.56Å; Q301-F319 WeakPolarHBondContact CA-O 3.41Å; Q301-S320 WeakPolarHBondContact CG-OG 3.37Å; Q301-Y350 HydrophobicContact CB-CD2 4.23Å; Q301-Y350 PolarHBondContact O-N 3.26Å
302	V	97.9	Very high	92.4	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	139.6	161.7	65.8	0	0	0	0	109.8	M284 F299 A318 F319 V335 C347 Q348 F349	M284-V302 HydrophobicContact CE-CG2 4.35Å; F299-V302 HydrophobicContact CD2-CB 4.13Å; F299-V302 HydrophobicContact CD2-CG1 4.5Å; F299-V302 HydrophobicContact CE2-CB 3.9Å; F299-V302 HydrophobicContact CE2-CG1 3.82Å; F299-V302 HydrophobicContact CZ-CG1 4.4Å; V302-A318 WeakPolarHBondContact O-CA 3.45Å; V302-F319 HydrophobicContact CG1-CB 4Å; V302-F319 HydrophobicContact CG1-CD1 4.13Å; V302-F319 PolarHBondContact N-O 3.06Å; V302-F319 PolarHBondContact O-N 3.46Å; V302-V335 HydrophobicContact CG1-CB 4.5Å; V302-V335 HydrophobicContact CG1-CG1 3.79Å; V302-V335 HydrophobicContact CG1-CG2 3.85Å; V302-C347 HydrophobicContact CG2-CB 3.9Å; V302-Q348 CarbonylContact C-O 3.58Å; V302-Q348 VanDerWaalsContact CA-O 3.29Å; V302-Q348 WeakPolarHBondContact CA-O 3.39Å; V302-F349 HydrophobicContact CB-CD1 3.77Å; V302-F349 HydrophobicContact CB-CE1 3.98Å; V302-F349 HydrophobicContact CG2-CD1 3.51Å; V302-F349 HydrophobicContact CG2-CD2 4.47Å; V302-F349 HydrophobicContact CG2-CE1 3.47Å; V302-F349 VanDerWaalsContact CG2-CE1 3.47Å; V302-F349 HydrophobicContact CG2-CE2 4.44Å; V302-F349 HydrophobicContact CG2-CG 4.04Å; V302-F349 HydrophobicContact CG2-CZ 3.97Å
303	V	97.7	Very high	92.2	Very high	19 Å²	19	52.9 Å²	52.9	12%	0.115	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	108.4	175.7	-178.2	0	0	0	0	108.7	Q301 P316 A318 Q348 Y350	Q301-V303 HydrophobicContact CG-CG2 4.27Å; V303-P316 HydrophobicContact CG1-CB 3.65Å; V303-P316 HydrophobicContact CG1-CG 4.03Å; V303-A318 HydrophobicContact CG2-CB 4.35Å; V303-Q348 HydrophobicContact CB-CB 4.41Å; V303-Q348 PolarHBondContact N-O 3.12Å; V303-Q348 PolarHBondContact O-N 3.2Å; V303-Y350 HydrophobicContact CB-CE2 4.42Å; V303-Y350 HydrophobicContact CG2-CD2 4.47Å; V303-Y350 HydrophobicContact CG2-CE2 3.84Å
304	C	97.6	Very high	91.9	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	127.9	-176.7	-56.6	0	0	0	0	110.8	F306 P316 L317 L337 I345 K346 C347	C304-F306 HydrophobicContact CB-CE2 4.33Å; C304-F306 HydrophobicContact CB-CZ 4.06Å; C304-P316 CarbonylContact O-C 3.21Å; C304-P316 VanDerWaalsContact O-CA 3.28Å; C304-P316 WeakPolarHBondContact O-CA 3.42Å; C304-P316 WeakPolarHBondContact O-CB 3.42Å; C304-L317 HydrophobicContact CB-CB 4.45Å; C304-L317 PolarHBondContact N-O 3.39Å; C304-L317 PolarHBondContact O-N 3.38Å; C304-L337 HydrophobicContact CB-CD2 4.34Å; C304-I345 HydrophobicContact CB-CG2 4.37Å; C304-K346 CarbonylContact C-O 3.54Å; C304-K346 WeakPolarHBondContact CA-O 3.34Å; C304-C347 VanDerWaalsContact SG-SG 3.61Å
305	H	96.3	Very high	91.8	Very high	37 Å²	37	56 Å²	56	17%	0.171	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	146.5	167.1	-54.3	68.9	0	0	0	108.7	W312 I345 K346	H305-W312 HydrophobicContact CB-CE3 3.88Å; H305-W312 HydrophobicContact CB-CZ3 4.38Å; H305-I345 CarbonylContact O-C 3.53Å; H305-I345 WeakPolarHBondContact O-CA 3.39Å; H305-K346 HydrophobicContact CB-CB 4.38Å; H305-K346 PolarHBondContact N-O 3.03Å; H305-K346 PolarHBondContact O-N 2.88Å
306	F	95.9	Very high	91.7	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	147.5	-178.2	-55.8	-84.8	0	0	0	110.4	C304 W312 E313 L317 L337 H340 A342 I345	C304-F306 HydrophobicContact CB-CE2 4.33Å; C304-F306 HydrophobicContact CB-CZ 4.06Å; F306-W312 CarbonylContact O-C 3.54Å; F306-W312 WeakPolarHBondContact O-CA 3.37Å; F306-E313 HydrophobicContact CB-CG 4.15Å; F306-E313 PolarHBondContact O-N 2.78Å; F306-L317 HydrophobicContact CE2-CB 3.78Å; F306-L317 HydrophobicContact CZ-CB 4.25Å; F306-L337 HydrophobicContact CE1-CB 4.35Å; F306-L337 HydrophobicContact CE1-CD2 4.19Å; F306-L337 HydrophobicContact CZ-CB 4.32Å; F306-L337 HydrophobicContact CZ-CD2 4Å; F306-H340 HydrophobicContact CD1-CB 3.75Å; F306-H340 HydrophobicContact CD2-CB 3.94Å; F306-H340 AromaticContact CD2-CE1 3.98Å; F306-H340 AromaticContact CD2-CG 3.66Å; F306-H340 AromaticContact CD2-ND1 3.37Å; F306-H340 WeakPolarHBondContact CD2-ND1 3.43Å; F306-H340 HydrophobicContact CE1-CB 3.76Å; F306-H340 HydrophobicContact CE2-CB 3.93Å; F306-H340 AromaticContact CE2-CD2 3.93Å; F306-H340 AromaticContact CE2-CG 3.57Å; F306-H340 AromaticContact CE2-ND1 3.65Å; F306-H340 HydrophobicContact CG-CB 3.85Å; F306-H340 AromaticContact CG-ND1 3.96Å; F306-H340 HydrophobicContact CZ-CB 3.85Å; F306-H340 AromaticContact CZ-CG 3.92Å; F306-A342 HydrophobicContact CB-CB 4.13Å; F306-A342 HydrophobicContact CD1-CB 4.13Å; F306-I345 HydrophobicContact CD1-CD1 4.26Å; F306-I345 HydrophobicContact CD1-CG1 3.96Å; F306-I345 HydrophobicContact CD1-CG2 4.15Å; F306-I345 HydrophobicContact CE1-CD1 4.14Å; F306-I345 HydrophobicContact CE1-CG1 4.28Å; F306-I345 HydrophobicContact CE1-CG2 4.08Å
307	R	94.7	Very high	91.7	Very high	54 Å²	54	54.6 Å²	54.6	20%	0.204	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	117.5	172.5	177.5	-176.5	76	-161.5	-0.3	107.9	E274 D309 W312 A342 S343 A344	E274-R307 IonicContact OE1-CZ 2.77Å; E274-R307 IonicContact OE1-NH1 3.33Å; E274-R307 IonicContact OE1-NH2 3.28Å; E274-R307 PolarHBondContact OE1-NH2 2.79Å; R307-D309 WeakPolarHBondContact CD-O 3.1Å; R307-D309 WeakPolarHBondContact CG-O 3.47Å; R307-W312 HydrophobicContact CB-CD2 3.9Å; R307-W312 HydrophobicContact CB-CE3 3.67Å; R307-W312 HydrophobicContact CB-CH2 4.1Å; R307-W312 HydrophobicContact CB-CZ2 4.34Å; R307-W312 HydrophobicContact CB-CZ3 3.77Å; R307-A342 CarbonylContact O-C 3.59Å; R307-A342 WeakPolarHBondContact O-CA 3.48Å; R307-S343 PolarHBondContact O-N 3.31Å; R307-S343 PolarHBondContact O-OG 3.09Å; R307-A344 HydrophobicContact CB-CB 4.46Å; R307-A344 PolarHBondContact N-O 2.7Å; R307-A344 VanDerWaalsContact NH2-CB 3.27Å; R307-A344 PolarHBondContact O-N 3.32Å; R307-A344 VanDerWaalsContact O-N 3.1Å
308	S	86.9	Confident	91.7	Very high	37 Å²	37	56 Å²	56	26%	0.259	32%	0.315	S	S	.	.	S	Bend	trans	-83.6	-50.7	169.4	55.2	0	0	0	0	110.9	S343	S308-S343 PolarHBondContact O-OG 3.09Å
309	D	78.8	Confident	91.8	Very high	109 Å²	109	58 Å²	58	58%	0.583	32%	0.321	S	S	*	.	S	Bend	trans	-120.3	-125.8	-168.8	-56.9	-86	0	0	0	110.9	R307	R307-D309 WeakPolarHBondContact CD-O 3.1Å; R307-D309 WeakPolarHBondContact CG-O 3.47Å
310	S	77.3	Confident	91.8	Very high	97 Å²	97	61.1 Å²	61.1	68%	0.678	34%	0.343	S	S	*	.	S	Bend	trans	-72.7	-37.7	178.6	44.9	0	0	0	0	114.1
311	D	85.2	Confident	91.6	Very high	120 Å²	120	57.9 Å²	57.9	64%	0.642	33%	0.33	S	S	*	.	S	Bend	trans	-113.8	150.7	-164.7	-63.4	-85.2	0	0	0	112.3
312	W	89.9	Confident	91	Very high	86 Å²	86	61.5 Å²	61.5	33%	0.326	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-80.2	142.8	175.2	-66.2	92.9	0	0	0	111.1	M272 H305 F306 R307 T314 A344 K346	M272-W312 HydrophobicContact CG-CH2 4.16Å; M272-W312 HydrophobicContact SD-CH2 4.1Å; M272-W312 HydrophobicContact SD-CZ2 3.85Å; H305-W312 HydrophobicContact CB-CE3 3.88Å; H305-W312 HydrophobicContact CB-CZ3 4.38Å; F306-W312 CarbonylContact O-C 3.54Å; F306-W312 WeakPolarHBondContact O-CA 3.37Å; R307-W312 HydrophobicContact CB-CD2 3.9Å; R307-W312 HydrophobicContact CB-CE3 3.67Å; R307-W312 HydrophobicContact CB-CH2 4.1Å; R307-W312 HydrophobicContact CB-CZ2 4.34Å; R307-W312 HydrophobicContact CB-CZ3 3.77Å; W312-T314 PolarHBondContact O-N 2.54Å; W312-A344 HydrophobicContact CH2-CB 4.13Å; W312-K346 HydrophobicContact CE3-CB 4.36Å; W312-K346 HydrophobicContact CH2-CB 3.63Å; W312-K346 HydrophobicContact CZ2-CB 4.36Å; W312-K346 HydrophobicContact CZ3-CB 3.62Å
313	E	89.1	Confident	90.1	Very high	57 Å²	57	67.1 Å²	67.1	27%	0.266	38%	0.383	S	S	.	.			trans	-56.5	136.2	170.1	-72.8	-173.3	-157.5	0	0	111.3	F306 T315 H340	F306-E313 HydrophobicContact CB-CG 4.15Å; F306-E313 PolarHBondContact O-N 2.78Å; E313-T315 VanDerWaalsContact C-N 3.32Å; E313-T315 PolarHBondContact O-N 2.93Å; E313-H340 VanDerWaalsContact CD-ND1 3.32Å; E313-H340 IonicContact OE1-CE1 2.72Å; E313-H340 IonicContact OE1-CG 2.71Å; E313-H340 IonicContact OE1-ND1 3.65Å; E313-H340 PolarHBondContact OE1-ND1 3.41Å; E313-H340 IonicContact OE2-CE1 3.25Å; E313-H340 PolarHBondContact OE2-CE1 3.03Å; E313-H340 IonicContact OE2-ND1 2.91Å; E313-H340 PolarHBondContact OE2-ND1 3.27Å
314	T	83.6	Confident	89.1	Confident	137 Å²	137	68.6 Å²	68.6	84%	0.84	39%	0.39	S	S	*	.	S	Bend	trans	-78.7	-13.6	-176.5	54.3	0	0	0	0	114	W312	W312-T314 PolarHBondContact O-N 2.54Å
315	T	88.9	Confident	88.2	Confident	97 Å²	97	74.4 Å²	74.4	60%	0.595	42%	0.417	S	S	*	.	S	Bend	trans	-116.5	99.2	-179.3	50	0	0	0	0	110.2	E313	E313-T315 VanDerWaalsContact C-N 3.32Å; E313-T315 PolarHBondContact O-N 2.93Å
316	P	92.6	Very high	87.6	Confident	60 Å²	60	81.9 Å²	81.9	39%	0.39	45%	0.449	S	S	.	.			trans	-72.6	148.8	179.1	29.5	-34.6	0	0	0	112.1	V303 C304	V303-P316 HydrophobicContact CG1-CB 3.65Å; V303-P316 HydrophobicContact CG1-CG 4.03Å; C304-P316 CarbonylContact O-C 3.21Å; C304-P316 VanDerWaalsContact O-CA 3.28Å; C304-P316 WeakPolarHBondContact O-CA 3.42Å; C304-P316 WeakPolarHBondContact O-CB 3.42Å
317	L	95.3	Very high	87.2	Confident	28 Å²	28	85.1 Å²	85.1	15%	0.147	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	118.4	171	-179.7	146.4	0	0	0	109.3	C304 F306 K336 L337 A338	C304-L317 HydrophobicContact CB-CB 4.45Å; C304-L317 PolarHBondContact N-O 3.39Å; C304-L317 PolarHBondContact O-N 3.38Å; F306-L317 HydrophobicContact CE2-CB 3.78Å; F306-L317 HydrophobicContact CZ-CB 4.25Å; L317-K336 WeakPolarHBondContact CD2-O 3.47Å; L317-L337 HydrophobicContact CD2-CD2 4.49Å; L317-A338 HydrophobicContact CD1-CB 3.7Å
318	A	95.8	Very high	87	Confident	63 Å²	63	85.3 Å²	85.3	52%	0.521	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	135.3	177.2	0	0	0	0	0	111.2	V302 V303	V302-A318 WeakPolarHBondContact O-CA 3.45Å; V303-A318 HydrophobicContact CG2-CB 4.35Å
319	F	96.1	Very high	87.3	Confident	55 Å²	55	85 Å²	85	24%	0.241	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	131.2	177.5	172.5	-90	0	0	0	110.6	F299 Q301 V302 P321 I333 V335	F299-F319 HydrophobicContact CE2-CD1 4.35Å; Q301-F319 CarbonylContact C-O 3.56Å; Q301-F319 WeakPolarHBondContact CA-O 3.41Å; V302-F319 HydrophobicContact CG1-CB 4Å; V302-F319 HydrophobicContact CG1-CD1 4.13Å; V302-F319 PolarHBondContact N-O 3.06Å; V302-F319 PolarHBondContact O-N 3.46Å; F319-P321 HydrophobicContact CE1-CB 4.05Å; F319-I333 HydrophobicContact CE1-CG2 3.88Å; F319-I333 HydrophobicContact CZ-CG2 4.49Å; F319-V335 HydrophobicContact CB-CG1 3.96Å; F319-V335 HydrophobicContact CD1-CB 4.35Å; F319-V335 HydrophobicContact CD1-CG1 4.16Å; F319-V335 HydrophobicContact CD1-CG2 3.88Å; F319-V335 HydrophobicContact CE1-CG2 4.11Å; F319-V335 HydrophobicContact CG-CG1 4.05Å
320	S	95	Very high	88	Confident	68 Å²	68	80.5 Å²	80.5	48%	0.476	45%	0.45	S	S	.	.			trans	-115.7	124.1	169.9	-72.7	0	0	0	0	109.5	Q300 Q301	Q300-S320 VanDerWaalsContact O-CB 3.3Å; Q300-S320 WeakPolarHBondContact O-CB 3.34Å; Q300-S320 PolarHBondContact O-OG 3.23Å; Q301-S320 WeakPolarHBondContact CG-OG 3.37Å
321	P	91.4	Very high	88.7	Confident	26 Å²	26	79.2 Å²	79.2	17%	0.169	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-67.6	166.8	169.2	29.5	-33.7	0	0	0	111.3	F299 F319 I333	F299-P321 HydrophobicContact CD2-CG 4.15Å; F299-P321 HydrophobicContact CE2-CG 4.09Å; F299-P321 WeakPolarHBondContact O-CG 3.27Å; F319-P321 HydrophobicContact CE1-CB 4.05Å; P321-I333 HydrophobicContact CB-CD1 3.99Å; P321-I333 HydrophobicContact CB-CG2 3.96Å; P321-I333 HydrophobicContact CG-CD1 4.03Å; P321-I333 HydrophobicContact CG-CG2 4.46Å
322	V	85.9	Confident	89.1	Confident	141 Å²	141	76.4 Å²	76.4	86%	0.855	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-76.4	125	169.3	-179.8	0	0	0	0	108.4	D324	V322-D324 PolarHBondContact O-N 2.85Å
323	E	78.2	Confident	89.4	Confident	119 Å²	119	73.4 Å²	73.4	56%	0.556	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-63.6	127.5	175.5	-64.3	179.3	168.6	0	0	110.7	Q300	Q300-E323 PolarHBondContact NE2-OE1 2.84Å
324	D	75.8	Confident	89.6	Confident	49 Å²	49	73.8 Å²	73.8	26%	0.262	41%	0.409	S	S	.	.			trans	-121.2	102.8	176.6	-176.4	-1.2	0	0	0	110.5	N290 V322 K326 N327 R331	N290-D324 PolarHBondContact ND2-O 3.01Å; V322-D324 PolarHBondContact O-N 2.85Å; D324-K326 WeakPolarHBondContact OD1-CA 3.21Å; D324-K326 WeakPolarHBondContact OD1-CB 3.09Å; D324-K326 PolarHBondContact OD1-N 2.93Å; D324-N327 PolarHBondContact OD1-N 3.15Å; D324-N327 WeakPolarHBondContact OD2-CB 3.25Å; D324-R331 IonicContact OD2-CZ 3.51Å; D324-R331 IonicContact OD2-NH1 2.76Å; D324-R331 PolarHBondContact OD2-NH1 3.26Å; D324-R331 IonicContact OD2-NH2 3.33Å; D324-R331 PolarHBondContact OD2-NH2 3.31Å
325	E	79.1	Confident	90.2	Very high	123 Å²	123	67.3 Å²	67.3	58%	0.575	37%	0.369	S	S	*	.	S	Bend	trans	-97.2	13.2	175.7	-51.6	-160.6	116.4	0	0	112.9	F292 K297	F292-E325 WeakPolarHBondContact CZ-O 3.47Å; K297-E325 IonicContact NZ-OE1 2.69Å; K297-E325 PolarHBondContact NZ-OE1 2.81Å
326	K	83.8	Confident	90.4	Very high	193 Å²	193	70.1 Å²	70.1	84%	0.839	37%	0.373	S	S	*	.	S	Bend	trans	-113.4	-41.5	-174.6	-65.9	-179.9	-178.7	174.2	0	112.7	D324	D324-K326 WeakPolarHBondContact OD1-CA 3.21Å; D324-K326 WeakPolarHBondContact OD1-CB 3.09Å; D324-K326 PolarHBondContact OD1-N 2.93Å
327	N	87.7	Confident	90.4	Very high	69 Å²	69	67.3 Å²	67.3	37%	0.369	36%	0.355	S	S	.	.			trans	-101.7	115.1	177.1	-175.6	6.7	0	0	0	110.4	N290 D324 S329 R331	N290-N327 PolarHBondContact ND2-O 2.81Å; D324-N327 PolarHBondContact OD1-N 3.15Å; D324-N327 WeakPolarHBondContact OD2-CB 3.25Å; N327-S329 VanDerWaalsContact C-N 3.26Å; N327-S329 PolarHBondContact O-N 3.07Å; N327-S329 WeakPolarHBondContact OD1-CB 3.5Å; N327-S329 PolarHBondContact OD1-N 2.87Å; N327-S329 PolarHBondContact OD1-OG 3.1Å; N327-R331 PolarHBondContact O-NH2 2.97Å
328	P	90.6	Very high	90.2	Very high	57 Å²	57	69 Å²	69	37%	0.37	37%	0.373	S	S	.	.			trans	-75.4	-11.7	177.9	32.4	-36.3	0	0	0	113.7	N290 M291 F292	N290-P328 CarbonylContact C-O 3.47Å; N290-P328 WeakPolarHBondContact O-CA 3.26Å; M291-P328 PolarHBondContact N-O 2.84Å; F292-P328 HydrophobicContact CE1-CB 4.01Å; F292-P328 HydrophobicContact CZ-CB 4.37Å
329	S	92.4	Very high	89.9	Confident	31 Å²	31	70.8 Å²	70.8	22%	0.217	37%	0.373	C	S	.	.			trans	-61.2	141	-173.9	-63.3	0	0	0	0	113.7	D240 N327 R331	D240-S329 VanDerWaalsContact CG-CA 3.47Å; D240-S329 WeakPolarHBondContact OD1-CA 3.45Å; D240-S329 VanDerWaalsContact OD1-CB 3.25Å; D240-S329 WeakPolarHBondContact OD1-CB 3.38Å; D240-S329 WeakPolarHBondContact OD2-CA 3.29Å; D240-S329 WeakPolarHBondContact OD2-CB 3.05Å; D240-S329 PolarHBondContact OD2-OG 3.19Å; N327-S329 VanDerWaalsContact C-N 3.26Å; N327-S329 PolarHBondContact O-N 3.07Å; N327-S329 WeakPolarHBondContact OD1-CB 3.5Å; N327-S329 PolarHBondContact OD1-N 2.87Å; N327-S329 PolarHBondContact OD1-OG 3.1Å; S329-R331 PolarHBondContact O-NE 2.94Å; S329-R331 VanDerWaalsContact O-NE 3.07Å; S329-R331 PolarHBondContact O-NH2 2.76Å
330	A	93.6	Very high	89.6	Confident	14 Å²	14	70.4 Å²	70.4	12%	0.116	37%	0.373	C	S	.	.			trans	-64.8	150.5	171.3	0	0	0	0	0	110.7	D240 Y256 C288	D240-A330 PolarHBondContact OD1-N 3.02Å; Y256-A330 VanDerWaalsContact OH-CB 3.31Å; Y256-A330 WeakPolarHBondContact OH-CB 3.36Å; C288-A330 CarbonylContact O-C 3.13Å; C288-A330 WeakPolarHBondContact O-CA 3.39Å; C288-A330 WeakPolarHBondContact O-CB 3.39Å
331	R	93.1	Very high	89.4	Confident	71 Å²	71	70 Å²	70	27%	0.268	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.5	159.6	-174.9	68.2	-162.9	73.2	170.7	8.8	113.6	H287 C288 D324 N327 S329	H287-R331 WeakPolarHBondContact CA-O 3.3Å; H287-R331 VanDerWaalsContact CD2-C 3.41Å; C288-R331 PolarHBondContact N-O 2.89Å; C288-R331 PolarHBondContact O-N 3.04Å; D324-R331 IonicContact OD2-CZ 3.51Å; D324-R331 IonicContact OD2-NH1 2.76Å; D324-R331 PolarHBondContact OD2-NH1 3.26Å; D324-R331 IonicContact OD2-NH2 3.33Å; D324-R331 PolarHBondContact OD2-NH2 3.31Å; N327-R331 PolarHBondContact O-NH2 2.97Å; S329-R331 PolarHBondContact O-NE 2.94Å; S329-R331 VanDerWaalsContact O-NE 3.07Å; S329-R331 PolarHBondContact O-NH2 2.76Å
332	F	93.9	Very high	89.5	Confident	61 Å²	61	68.7 Å²	68.7	27%	0.268	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	122.3	164.1	-75.5	-76.6	0	0	0	112.1	C237 K285 V286 H287 E360	C237-F332 VanDerWaalsContact SG-CZ 3.56Å; K285-F332 HydrophobicContact CB-CD1 3.8Å; K285-F332 HydrophobicContact CB-CE1 4.41Å; V286-F332 WeakPolarHBondContact O-CA 3.18Å; H287-F332 HydrophobicContact CB-CD1 3.91Å; H287-F332 HydrophobicContact CB-CE1 3.68Å; H287-F332 HydrophobicContact CB-CE2 4.48Å; H287-F332 HydrophobicContact CB-CG 4.44Å; H287-F332 HydrophobicContact CB-CZ 3.98Å; H287-F332 AromaticContact CD2-CD2 3.77Å; H287-F332 AromaticContact CD2-CE2 3.8Å; F332-E360 HydrophobicContact CE1-CB 4.28Å; F332-E360 HydrophobicContact CE1-CG 4.01Å; F332-E360 HydrophobicContact CZ-CB 4.33Å; F332-E360 HydrophobicContact CZ-CG 3.98Å
333	I	94.6	Very high	89.9	Confident	22 Å²	22	63.2 Å²	63.2	11%	0.113	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	121.8	162.4	-62.2	-173.8	0	0	0	108.2	K285 V286 A298 F299 F319 P321	K285-I333 WeakPolarHBondContact CA-O 3.49Å; V286-I333 PolarHBondContact N-O 3.11Å; V286-I333 PolarHBondContact O-N 2.88Å; A298-I333 HydrophobicContact CB-CD1 3.49Å; A298-I333 VanDerWaalsContact CB-CD1 3.49Å; F299-I333 HydrophobicContact CE1-CB 4.28Å; F299-I333 HydrophobicContact CE1-CD1 4.28Å; F299-I333 HydrophobicContact CE1-CG2 4.32Å; F299-I333 HydrophobicContact CE2-CG2 4.27Å; F299-I333 HydrophobicContact CZ-CB 4.1Å; F299-I333 HydrophobicContact CZ-CD1 4.4Å; F299-I333 HydrophobicContact CZ-CG2 3.65Å; F319-I333 HydrophobicContact CE1-CG2 3.88Å; F319-I333 HydrophobicContact CZ-CG2 4.49Å; P321-I333 HydrophobicContact CB-CD1 3.99Å; P321-I333 HydrophobicContact CB-CG2 3.96Å; P321-I333 HydrophobicContact CG-CD1 4.03Å; P321-I333 HydrophobicContact CG-CG2 4.46Å
334	T	94.8	Very high	90.8	Very high	66 Å²	66	57.5 Å²	57.5	41%	0.405	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	108	178.8	-57.2	0	0	0	0	110.6	M284 K285	M284-T334 CarbonylContact O-C 3.57Å; K285-T334 HydrophobicContact CG-CG2 4.17Å
335	V	94.9	Very high	91.8	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	120.6	174.9	-176.9	0	0	0	0	108.2	S283 M284 F299 V302 F319 L337	S283-V335 CarbonylContact C-O 3.48Å; S283-V335 WeakPolarHBondContact CA-O 3.45Å; S283-V335 VanDerWaalsContact CB-O 3.27Å; S283-V335 WeakPolarHBondContact CB-O 3.44Å; M284-V335 HydrophobicContact CB-CB 4.39Å; M284-V335 HydrophobicContact CE-CB 4Å; M284-V335 HydrophobicContact CE-CG1 4.22Å; M284-V335 HydrophobicContact CE-CG2 3.82Å; M284-V335 PolarHBondContact N-O 3.14Å; M284-V335 PolarHBondContact O-N 2.93Å; F299-V335 HydrophobicContact CE2-CG2 4.39Å; F299-V335 HydrophobicContact CZ-CG2 3.91Å; V302-V335 HydrophobicContact CG1-CB 4.5Å; V302-V335 HydrophobicContact CG1-CG1 3.79Å; V302-V335 HydrophobicContact CG1-CG2 3.85Å; F319-V335 HydrophobicContact CB-CG1 3.96Å; F319-V335 HydrophobicContact CD1-CB 4.35Å; F319-V335 HydrophobicContact CD1-CG1 4.16Å; F319-V335 HydrophobicContact CD1-CG2 3.88Å; F319-V335 HydrophobicContact CE1-CG2 4.11Å; F319-V335 HydrophobicContact CG-CG1 4.05Å; V335-L337 HydrophobicContact CG1-CD2 4.14Å; V335-L337 PolarHBondContact O-N 3.39Å
336	K	93.4	Very high	92.7	Very high	157 Å²	157	51.2 Å²	51.2	68%	0.683	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	122.3	175.9	-66.8	-174.9	178.8	-177.5	0	109.6	L317 A338	L317-K336 WeakPolarHBondContact CD2-O 3.47Å; K336-A338 VanDerWaalsContact C-N 3.35Å
337	L	93.4	Very high	93.3	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	10.1	-180	-62.6	-178.6	0	0	0	113.1	F281 T282 M284 C304 F306 L317 V335 N339 H340 I345 F363	F281-L337 HydrophobicContact CB-CB 3.89Å; F281-L337 HydrophobicContact CB-CD1 3.77Å; F281-L337 HydrophobicContact CD1-CD1 4.23Å; F281-L337 HydrophobicContact CG-CD1 4.27Å; F281-L337 CarbonylContact O-C 3.55Å; F281-L337 WeakPolarHBondContact O-CB 3.43Å; T282-L337 PolarHBondContact O-N 3.32Å; M284-L337 HydrophobicContact CB-CD1 3.81Å; M284-L337 HydrophobicContact CB-CD2 4.46Å; M284-L337 HydrophobicContact CB-CG 4.18Å; C304-L337 HydrophobicContact CB-CD2 4.34Å; F306-L337 HydrophobicContact CE1-CB 4.35Å; F306-L337 HydrophobicContact CE1-CD2 4.19Å; F306-L337 HydrophobicContact CZ-CB 4.32Å; F306-L337 HydrophobicContact CZ-CD2 4Å; L317-L337 HydrophobicContact CD2-CD2 4.49Å; V335-L337 HydrophobicContact CG1-CD2 4.14Å; V335-L337 PolarHBondContact O-N 3.39Å; L337-N339 PolarHBondContact O-N 3.45Å; L337-H340 PolarHBondContact O-CD2 3.28Å; L337-H340 VanDerWaalsContact O-CD2 3.29Å; L337-H340 PolarHBondContact O-N 2.98Å; L337-I345 HydrophobicContact CD1-CD1 3.94Å; L337-F363 HydrophobicContact CD1-CD1 4.01Å; L337-F363 HydrophobicContact CD1-CE1 4.36Å
338	A	90.1	Very high	93.8	Very high	64 Å²	64	40.7 Å²	40.7	53%	0.529	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	54.8	23.7	166.5	0	0	0	0	0	116.6	L317 K336	L317-A338 HydrophobicContact CD1-CB 3.7Å; K336-A338 VanDerWaalsContact C-N 3.35Å
339	N	89.6	Confident	94.2	Very high	100 Å²	100	38 Å²	38	54%	0.535	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	65.7	36.8	-179.8	-55.3	-7	0	0	0	113.1	N280 F281 L337	N280-N339 VanDerWaalsContact OD1-C 3.27Å; N280-N339 WeakPolarHBondContact OD1-CA 3.38Å; N280-N339 VanDerWaalsContact OD1-CB 3.23Å; N280-N339 WeakPolarHBondContact OD1-CB 3.35Å; N280-N339 PolarHBondContact OD1-O 3.3Å; F281-N339 WeakPolarHBondContact O-CA 3.15Å; F281-N339 PolarHBondContact O-N 3.08Å; L337-N339 PolarHBondContact O-N 3.45Å
340	H	89.6	Confident	94.4	Very high	48 Å²	48	39.9 Å²	39.9	22%	0.222	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	147.2	171.9	-84.3	-107.7	0	0	0	112.1	F281 F306 E313 L337	F281-H340 PolarHBondContact N-O 3.15Å; F306-H340 HydrophobicContact CD1-CB 3.75Å; F306-H340 HydrophobicContact CD2-CB 3.94Å; F306-H340 AromaticContact CD2-CE1 3.98Å; F306-H340 AromaticContact CD2-CG 3.66Å; F306-H340 AromaticContact CD2-ND1 3.37Å; F306-H340 WeakPolarHBondContact CD2-ND1 3.43Å; F306-H340 HydrophobicContact CE1-CB 3.76Å; F306-H340 HydrophobicContact CE2-CB 3.93Å; F306-H340 AromaticContact CE2-CD2 3.93Å; F306-H340 AromaticContact CE2-CG 3.57Å; F306-H340 AromaticContact CE2-ND1 3.65Å; F306-H340 HydrophobicContact CG-CB 3.85Å; F306-H340 AromaticContact CG-ND1 3.96Å; F306-H340 HydrophobicContact CZ-CB 3.85Å; F306-H340 AromaticContact CZ-CG 3.92Å; E313-H340 VanDerWaalsContact CD-ND1 3.32Å; E313-H340 IonicContact OE1-CE1 2.72Å; E313-H340 IonicContact OE1-CG 2.71Å; E313-H340 IonicContact OE1-ND1 3.65Å; E313-H340 PolarHBondContact OE1-ND1 3.41Å; E313-H340 IonicContact OE2-CE1 3.25Å; E313-H340 PolarHBondContact OE2-CE1 3.03Å; E313-H340 IonicContact OE2-ND1 2.91Å; E313-H340 PolarHBondContact OE2-ND1 3.27Å; L337-H340 PolarHBondContact O-CD2 3.28Å; L337-H340 VanDerWaalsContact O-CD2 3.29Å; L337-H340 PolarHBondContact O-N 2.98Å
341	M	91.9	Very high	94.6	Very high	58 Å²	58	40 Å²	40	29%	0.286	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	111.8	-177.4	-81.2	-66.6	-68.1	0	0	110.5	I278 R279 N280 A368 Y370	I278-M341 HydrophobicContact CG2-CE 3.56Å; R279-M341 WeakPolarHBondContact O-CA 3.37Å; N280-M341 HydrophobicContact CB-SD 3.73Å; M341-A368 HydrophobicContact CE-CB 3.28Å; M341-A368 HydrophobicContact SD-CB 3.84Å; M341-Y370 HydrophobicContact CE-CE2 4.46Å
342	A	93.9	Very high	94.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	149.6	-173.4	0	0	0	0	0	113.9	I278 R279 F281 F306 R307 I345	I278-A342 CarbonylContact C-O 3.58Å; I278-A342 WeakPolarHBondContact CA-O 3.43Å; R279-A342 PolarHBondContact N-O 2.7Å; R279-A342 PolarHBondContact O-N 2.67Å; F281-A342 HydrophobicContact CD2-CB 4.05Å; F281-A342 HydrophobicContact CE2-CB 3.9Å; F281-A342 WeakPolarHBondContact CE2-O 3.3Å; F306-A342 HydrophobicContact CB-CB 4.13Å; F306-A342 HydrophobicContact CD1-CB 4.13Å; R307-A342 CarbonylContact O-C 3.59Å; R307-A342 WeakPolarHBondContact O-CA 3.48Å; A342-I345 HydrophobicContact CB-CG1 4.19Å
343	S	94.2	Very high	94.8	Very high	25 Å²	25	37 Å²	37	18%	0.175	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	-19.7	159.5	55.9	0	0	0	0	112.1	F275 R307 S308	F275-S343 PolarHBondContact N-O 3.03Å; R307-S343 PolarHBondContact O-N 3.31Å; R307-S343 PolarHBondContact O-OG 3.09Å; S308-S343 PolarHBondContact O-OG 3.09Å
344	A	96.3	Very high	94.8	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	150.5	170.9	0	0	0	0	0	112.9	F273 E274 R307 W312	F273-A344 CarbonylContact O-C 3.57Å; F273-A344 WeakPolarHBondContact O-CA 3.4Å; F273-A344 WeakPolarHBondContact O-CB 3.32Å; E274-A344 HydrophobicContact CG-CB 4.08Å; R307-A344 HydrophobicContact CB-CB 4.46Å; R307-A344 PolarHBondContact N-O 2.7Å; R307-A344 VanDerWaalsContact NH2-CB 3.27Å; R307-A344 PolarHBondContact O-N 3.32Å; R307-A344 VanDerWaalsContact O-N 3.1Å; W312-A344 HydrophobicContact CH2-CB 4.13Å
345	I	96.9	Very high	95	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.9	179.2	-50.8	178.4	0	0	0	108.8	M272 F273 F275 F281 C304 H305 F306 L337 A342 F363	M272-I345 CarbonylContact C-O 3.19Å; M272-I345 WeakPolarHBondContact CA-O 3.36Å; F273-I345 PolarHBondContact N-O 2.96Å; F273-I345 PolarHBondContact O-N 2.85Å; F275-I345 HydrophobicContact CE2-CB 4.38Å; F275-I345 HydrophobicContact CE2-CD1 3.95Å; F275-I345 HydrophobicContact CE2-CG1 3.86Å; F275-I345 HydrophobicContact CZ-CD1 4.18Å; F281-I345 HydrophobicContact CB-CD1 4.48Å; F281-I345 HydrophobicContact CD1-CD1 3.75Å; F281-I345 HydrophobicContact CD2-CD1 3.86Å; F281-I345 HydrophobicContact CE1-CD1 3.86Å; F281-I345 HydrophobicContact CE2-CD1 3.95Å; F281-I345 HydrophobicContact CE2-CG1 4.41Å; F281-I345 HydrophobicContact CG-CD1 3.75Å; F281-I345 HydrophobicContact CZ-CD1 3.95Å; C304-I345 HydrophobicContact CB-CG2 4.37Å; H305-I345 CarbonylContact O-C 3.53Å; H305-I345 WeakPolarHBondContact O-CA 3.39Å; F306-I345 HydrophobicContact CD1-CD1 4.26Å; F306-I345 HydrophobicContact CD1-CG1 3.96Å; F306-I345 HydrophobicContact CD1-CG2 4.15Å; F306-I345 HydrophobicContact CE1-CD1 4.14Å; F306-I345 HydrophobicContact CE1-CG1 4.28Å; F306-I345 HydrophobicContact CE1-CG2 4.08Å; L337-I345 HydrophobicContact CD1-CD1 3.94Å; A342-I345 HydrophobicContact CB-CG1 4.19Å; I345-F363 HydrophobicContact CD1-CD1 4.06Å; I345-F363 HydrophobicContact CD1-CE1 3.97Å
346	K	97.4	Very high	95.1	Very high	40 Å²	40	35.8 Å²	35.8	17%	0.174	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	108	177.1	-169.7	-178.2	78.6	116.9	0	110.4	E270 M272 C304 H305 W312	E270-K346 VanDerWaalsContact CD-NZ 3.34Å; E270-K346 HydrophobicContact CG-CD 4.25Å; E270-K346 HydrophobicContact CG-CG 3.84Å; E270-K346 WeakPolarHBondContact OE1-CD 3.37Å; E270-K346 IonicContact OE1-NZ 3.65Å; E270-K346 PolarHBondContact OE1-NZ 3.04Å; E270-K346 IonicContact OE2-NZ 3.81Å; E270-K346 PolarHBondContact OE2-NZ 3.26Å; M272-K346 HydrophobicContact CB-CG 4.33Å; M272-K346 HydrophobicContact CG-CB 4.37Å; M272-K346 HydrophobicContact CG-CG 4.48Å; C304-K346 CarbonylContact C-O 3.54Å; C304-K346 WeakPolarHBondContact CA-O 3.34Å; H305-K346 HydrophobicContact CB-CB 4.38Å; H305-K346 PolarHBondContact N-O 3.03Å; H305-K346 PolarHBondContact O-N 2.88Å; W312-K346 HydrophobicContact CE3-CB 4.36Å; W312-K346 HydrophobicContact CH2-CB 3.63Å; W312-K346 HydrophobicContact CZ2-CB 4.36Å; W312-K346 HydrophobicContact CZ3-CB 3.62Å
347	C	97.9	Very high	95.3	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	124	-175.1	-60.5	0	0	0	0	110.4	E270 I271 F273 V302 C304 F349	E270-C347 WeakPolarHBondContact CA-O 3.44Å; I271-C347 PolarHBondContact N-O 3.07Å; I271-C347 PolarHBondContact O-N 3.04Å; F273-C347 HydrophobicContact CE2-CB 4.06Å; V302-C347 HydrophobicContact CG2-CB 3.9Å; C304-C347 VanDerWaalsContact SG-SG 3.61Å; C347-F349 HydrophobicContact CB-CD2 4.11Å; C347-F349 HydrophobicContact CB-CE2 3.42Å; C347-F349 VanDerWaalsContact CB-CE2 3.42Å; C347-F349 HydrophobicContact CB-CZ 3.71Å
348	Q	97.8	Very high	95.5	Very high	41 Å²	41	28.3 Å²	28.3	19%	0.192	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	108.4	171.6	-65.8	175.5	-24.6	0	0	108.9	E270 V302 V303 Y350	E270-Q348 HydrophobicContact CB-CG 4.27Å; E270-Q348 HydrophobicContact CG-CG 4.15Å; E270-Q348 WeakPolarHBondContact OE2-CG 3.35Å; E270-Q348 PolarHBondContact OE2-NE2 3.36Å; V302-Q348 CarbonylContact C-O 3.58Å; V302-Q348 VanDerWaalsContact CA-O 3.29Å; V302-Q348 WeakPolarHBondContact CA-O 3.39Å; V303-Q348 HydrophobicContact CB-CB 4.41Å; V303-Q348 PolarHBondContact N-O 3.12Å; V303-Q348 PolarHBondContact O-N 3.2Å; Q348-Y350 HydrophobicContact CB-CE2 4.11Å
349	F	98.2	Very high	95.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	119	-178.1	-62.4	-87.2	0	0	0	110.4	S268 V269 I271 M284 V286 F299 V302 C347 M356 F358	S268-F349 CarbonylContact C-O 3.53Å; S268-F349 WeakPolarHBondContact CA-O 3.5Å; S268-F349 WeakPolarHBondContact CB-O 3.49Å; V269-F349 PolarHBondContact N-O 3.25Å; V269-F349 PolarHBondContact O-N 2.93Å; I271-F349 HydrophobicContact CB-CE2 4.26Å; I271-F349 HydrophobicContact CD1-CD2 4.2Å; I271-F349 HydrophobicContact CD1-CE2 3.97Å; I271-F349 HydrophobicContact CG1-CD2 4.29Å; I271-F349 HydrophobicContact CG1-CE2 4.2Å; M284-F349 HydrophobicContact CE-CE1 3.92Å; M284-F349 HydrophobicContact CE-CZ 3.78Å; M284-F349 HydrophobicContact SD-CZ 4.21Å; V286-F349 HydrophobicContact CG2-CE1 3.96Å; V286-F349 HydrophobicContact CG2-CZ 4.11Å; F299-F349 HydrophobicContact CB-CB 4.3Å; F299-F349 HydrophobicContact CB-CD1 4.4Å; F299-F349 AromaticContact CD1-CD1 3.72Å; F299-F349 HydrophobicContact CD1-CD1 3.72Å; F299-F349 HydrophobicContact CD1-CE1 4.22Å; F299-F349 HydrophobicContact CD2-CD1 4.27Å; F299-F349 AromaticContact CE1-CD1 3.95Å; F299-F349 HydrophobicContact CE1-CD1 3.95Å; F299-F349 AromaticContact CE1-CE1 3.99Å; F299-F349 HydrophobicContact CE1-CE1 3.99Å; F299-F349 HydrophobicContact CE2-CD1 4.47Å; F299-F349 AromaticContact CG-CD1 3.89Å; F299-F349 HydrophobicContact CG-CD1 3.89Å; F299-F349 HydrophobicContact CZ-CD1 4.32Å; F299-F349 HydrophobicContact CZ-CE1 4.25Å; V302-F349 HydrophobicContact CB-CD1 3.77Å; V302-F349 HydrophobicContact CB-CE1 3.98Å; V302-F349 HydrophobicContact CG2-CD1 3.51Å; V302-F349 HydrophobicContact CG2-CD2 4.47Å; V302-F349 HydrophobicContact CG2-CE1 3.47Å; V302-F349 VanDerWaalsContact CG2-CE1 3.47Å; V302-F349 HydrophobicContact CG2-CE2 4.44Å; V302-F349 HydrophobicContact CG2-CG 4.04Å; V302-F349 HydrophobicContact CG2-CZ 3.97Å; C347-F349 HydrophobicContact CB-CD2 4.11Å; C347-F349 HydrophobicContact CB-CE2 3.42Å; C347-F349 VanDerWaalsContact CB-CE2 3.42Å; C347-F349 HydrophobicContact CB-CZ 3.71Å; F349-M356 HydrophobicContact CB-CE 3.86Å; F349-M356 HydrophobicContact CB-SD 3.96Å; F349-F358 HydrophobicContact CB-CE2 4.49Å; F349-F358 HydrophobicContact CB-CZ 4.19Å; F349-F358 HydrophobicContact CD1-CE2 4.13Å; F349-F358 AromaticContact CD1-CZ 3.83Å; F349-F358 HydrophobicContact CD1-CZ 3.83Å; F349-F358 HydrophobicContact CD2-CE2 4Å; F349-F358 HydrophobicContact CD2-CZ 4.42Å; F349-F358 HydrophobicContact CE1-CE2 4.31Å; F349-F358 HydrophobicContact CE1-CZ 4.26Å; F349-F358 HydrophobicContact CE2-CE2 4.19Å; F349-F358 AromaticContact CG-CE2 3.96Å; F349-F358 HydrophobicContact CG-CE2 3.96Å; F349-F358 AromaticContact CG-CZ 3.91Å; F349-F358 HydrophobicContact CG-CZ 3.91Å; F349-F358 HydrophobicContact CZ-CE2 4.34Å
350	Y	97.9	Very high	96.1	Very high	71 Å²	71	20.7 Å²	20.7	28%	0.278	11%	0.107	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	135	-177.3	-70.6	-98.1	0	0	0	111.8	G267 F299 Q300 Q301 V303 Q348	G267-Y350 WeakPolarHBondContact O-CA 3.45Å; G267-Y350 WeakPolarHBondContact O-CD1 3.36Å; F299-Y350 CarbonylContact C-O 3.14Å; F299-Y350 VanDerWaalsContact CA-O 3.28Å; F299-Y350 WeakPolarHBondContact CA-O 3.33Å; F299-Y350 WeakPolarHBondContact CB-O 3.49Å; Q300-Y350 PolarHBondContact N-O 3.15Å; Q301-Y350 HydrophobicContact CB-CD2 4.23Å; Q301-Y350 PolarHBondContact O-N 3.26Å; V303-Y350 HydrophobicContact CB-CE2 4.42Å; V303-Y350 HydrophobicContact CG2-CD2 4.47Å; V303-Y350 HydrophobicContact CG2-CE2 3.84Å; Q348-Y350 HydrophobicContact CB-CE2 4.11Å
351	F	97.5	Very high	96.4	Very high	16 Å²	16	18.4 Å²	18.4	7%	0.07	10%	0.097	C	C	.	.	P	Polyproline II helix	trans	-67.1	140.8	-178.2	-69.2	-87.4	0	0	0	112.4	W259 N261 F264 G267 V269 M356	W259-F351 HydrophobicContact CB-CE1 4.25Å; W259-F351 HydrophobicContact CB-CZ 3.98Å; W259-F351 WeakPolarHBondContact O-CE1 3.44Å; N261-F351 HydrophobicContact CB-CB 4.08Å; N261-F351 HydrophobicContact CB-CD1 3.92Å; N261-F351 HydrophobicContact CB-CD2 3.96Å; N261-F351 HydrophobicContact CB-CE1 4.31Å; N261-F351 HydrophobicContact CB-CE2 4.36Å; N261-F351 HydrophobicContact CB-CG 3.73Å; N261-F351 WeakPolarHBondContact OD1-CD2 3.29Å; F264-F351 HydrophobicContact CB-CE2 3.98Å; F264-F351 AromaticContact CD2-CE2 3.93Å; F264-F351 HydrophobicContact CD2-CE2 3.93Å; F264-F351 AromaticContact CD2-CZ 3.83Å; F264-F351 HydrophobicContact CD2-CZ 3.83Å; F264-F351 HydrophobicContact CE2-CZ 4.38Å; F264-F351 HydrophobicContact CG-CE2 4.09Å; F264-F351 HydrophobicContact CG-CZ 4.43Å; G267-F351 WeakPolarHBondContact O-CD2 3.42Å; G267-F351 PolarHBondContact O-N 3.13Å; G267-F351 VanDerWaalsContact O-N 3.16Å; V269-F351 HydrophobicContact CG2-CE1 4.4Å; V269-F351 HydrophobicContact CG2-CE2 3.83Å; V269-F351 HydrophobicContact CG2-CZ 3.51Å; F351-M356 HydrophobicContact CD1-CB 3.63Å; F351-M356 HydrophobicContact CD1-CE 4.24Å; F351-M356 HydrophobicContact CE1-CB 3.63Å; F351-M356 HydrophobicContact CE1-CE 3.99Å; F351-M356 HydrophobicContact CE2-CE 4.49Å; F351-M356 HydrophobicContact CZ-CE 4.13Å
352	A	95	Very high	96.6	Very high	31 Å²	31	15.8 Å²	15.8	26%	0.256	8%	0.084	S	C	.	.	S	Bend	trans	-105.4	-10.1	171.2	0	0	0	0	0	113.8	K297 A298 Q300	K297-A352 HydrophobicContact CB-CB 4Å; K297-A352 HydrophobicContact CD-CB 4.23Å; A298-A352 WeakPolarHBondContact O-CB 3.27Å; Q300-A352 HydrophobicContact CB-CB 3.93Å
353	D	94.9	Very high	96.6	Very high	38 Å²	38	15.8 Å²	15.8	20%	0.203	8%	0.084	C	C	.	.	S	Bend	trans	-156.8	-172.4	180	-147.1	-45.5	0	0	0	108.5	H295 K297 W355	H295-D353 WeakPolarHBondContact CB-OD1 3.4Å; H295-D353 IonicContact CG-OD1 2.9Å; H295-D353 IonicContact ND1-OD1 3.23Å; H295-D353 PolarHBondContact ND1-OD1 3.41Å; K297-D353 HydrophobicContact CB-CB 3.93Å; K297-D353 HydrophobicContact CD-CB 3.96Å; K297-D353 WeakPolarHBondContact CE-OD2 3.49Å; K297-D353 HydrophobicContact CG-CB 3.8Å; D353-W355 VanDerWaalsContact C-N 3.26Å; D353-W355 PolarHBondContact O-N 3.04Å
354	A	96	Very high	96.4	Very high	31 Å²	31	16.5 Å²	16.5	26%	0.256	9%	0.085	S	C	.	.	S	Bend	trans	-63.3	-27.4	-177.4	0	0	0	0	0	114.3	N260 N261 H295	N260-A354 CarbonylContact C-O 3.47Å; N260-A354 WeakPolarHBondContact CA-O 3.07Å; N261-A354 PolarHBondContact N-O 3.01Å; H295-A354 HydrophobicContact CB-CB 3.89Å
355	W	97.4	Very high	96	Very high	30 Å²	30	17.3 Å²	17.3	11%	0.114	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	147.1	-179.5	-71.2	86	0	0	0	113.2	Q201 M203 L212 W259 N260 H295 V296 K297 D353 L357	Q201-W355 HydrophobicContact CB-CH2 4.26Å; Q201-W355 HydrophobicContact CB-CZ3 4.15Å; M203-W355 HydrophobicContact CB-CD2 4.49Å; M203-W355 HydrophobicContact CB-CE3 4.48Å; M203-W355 HydrophobicContact CB-CH2 3.61Å; M203-W355 HydrophobicContact CB-CZ2 3.58Å; M203-W355 HydrophobicContact CB-CZ3 4.07Å; M203-W355 HydrophobicContact CE-CB 4.04Å; M203-W355 HydrophobicContact CE-CD2 3.5Å; M203-W355 VanDerWaalsContact CE-CD2 3.5Å; M203-W355 HydrophobicContact CE-CE3 3.95Å; M203-W355 HydrophobicContact CE-CG 3.54Å; M203-W355 HydrophobicContact CG-CD2 4.45Å; M203-W355 HydrophobicContact CG-CH2 4.34Å; M203-W355 HydrophobicContact CG-CZ2 3.8Å; L212-W355 HydrophobicContact CD1-CE3 3.98Å; L212-W355 HydrophobicContact CD1-CZ3 3.77Å; W259-W355 VanDerWaalsContact C-CE3 3.48Å; W259-W355 WeakPolarHBondContact O-CA 3.49Å; W259-W355 VanDerWaalsContact O-CE3 3.27Å; N260-W355 HydrophobicContact CB-CD2 3.92Å; N260-W355 HydrophobicContact CB-CE3 3.98Å; N260-W355 HydrophobicContact CB-CH2 3.76Å; N260-W355 HydrophobicContact CB-CZ2 3.71Å; N260-W355 HydrophobicContact CB-CZ3 3.91Å; N260-W355 VanDerWaalsContact ND2-CE2 3.28Å; N260-W355 PolarHBondContact ND2-NE1 3.08Å; N260-W355 VanDerWaalsContact ND2-NE1 3.18Å; H295-W355 PolarHBondContact O-N 3.27Å; V296-W355 HydrophobicContact CG2-CB 3.85Å; K297-W355 PolarHBondContact N-O 3.17Å; D353-W355 VanDerWaalsContact C-N 3.26Å; D353-W355 PolarHBondContact O-N 3.04Å; W355-L357 HydrophobicContact CE3-CD2 4.3Å
356	M	97.6	Very high	95.2	Very high	1 Å²	1	22 Å²	22	1%	0.005	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	123.2	174.5	177.7	170.8	61.3	0	0	108.8	G258 W259 V269 F299 F349 F351 F358	G258-M356 WeakPolarHBondContact CA-O 3.28Å; W259-M356 HydrophobicContact CE3-CE 4.4Å; W259-M356 PolarHBondContact N-O 3.41Å; W259-M356 PolarHBondContact O-N 3.18Å; V269-M356 HydrophobicContact CB-CE 3.72Å; V269-M356 HydrophobicContact CG2-CE 3.43Å; V269-M356 VanDerWaalsContact CG2-CE 3.43Å; F299-M356 HydrophobicContact CB-SD 3.73Å; F349-M356 HydrophobicContact CB-CE 3.86Å; F349-M356 HydrophobicContact CB-SD 3.96Å; F351-M356 HydrophobicContact CD1-CB 3.63Å; F351-M356 HydrophobicContact CD1-CE 4.24Å; F351-M356 HydrophobicContact CE1-CB 3.63Å; F351-M356 HydrophobicContact CE1-CE 3.99Å; F351-M356 HydrophobicContact CE2-CE 4.49Å; F351-M356 HydrophobicContact CZ-CE 4.13Å; M356-F358 HydrophobicContact CE-CZ 4.29Å; M356-F358 HydrophobicContact CG-CD1 4.37Å; M356-F358 HydrophobicContact CG-CE1 3.61Å; M356-F358 HydrophobicContact CG-CZ 3.81Å; M356-F358 HydrophobicContact SD-CE1 3.92Å; M356-F358 HydrophobicContact SD-CE2 4.48Å; M356-F358 HydrophobicContact SD-CZ 3.56Å; M356-F358 VanDerWaalsContact SD-CZ 3.56Å
357	L	98.1	Very high	93.4	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	127.3	-175.9	-47.1	-176.1	0	0	0	110.7	L212 F242 Y256 C288 N289 V296 W355	L212-L357 HydrophobicContact CD1-CD2 3.61Å; L212-L357 HydrophobicContact CD2-CD1 4.18Å; L212-L357 HydrophobicContact CD2-CD2 4.06Å; L212-L357 HydrophobicContact CG-CD2 4.3Å; F242-L357 HydrophobicContact CB-CD1 3.83Å; F242-L357 HydrophobicContact CD1-CD1 3.76Å; F242-L357 HydrophobicContact CD2-CD1 3.8Å; F242-L357 HydrophobicContact CE1-CD1 4.24Å; F242-L357 HydrophobicContact CE2-CD1 4.29Å; F242-L357 HydrophobicContact CG-CD1 3.51Å; F242-L357 HydrophobicContact CZ-CD1 4.48Å; Y256-L357 HydrophobicContact CD1-CB 3.74Å; Y256-L357 HydrophobicContact CE1-CB 4.38Å; Y256-L357 HydrophobicContact CG-CB 4.2Å; C288-L357 WeakPolarHBondContact CA-O 3.47Å; N289-L357 HydrophobicContact CB-CB 4.08Å; N289-L357 HydrophobicContact CB-CD1 4.25Å; N289-L357 PolarHBondContact N-O 2.9Å; N289-L357 VanDerWaalsContact N-O 3.14Å; V296-L357 HydrophobicContact CG1-CB 4.38Å; V296-L357 HydrophobicContact CG1-CD1 3.84Å; V296-L357 HydrophobicContact CG1-CG 3.74Å; V296-L357 HydrophobicContact CG2-CD1 3.9Å; V296-L357 HydrophobicContact CG2-CG 4.15Å; W355-L357 HydrophobicContact CE3-CD2 4.3Å
358	F	98.2	Very high	91.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	142.9	173.1	-57.3	-25.2	0	0	0	110.6	L232 V257 W259 I271 V286 H287 C288 F299 F349 M356 I361	L232-F358 HydrophobicContact CD2-CB 3.68Å; L232-F358 WeakPolarHBondContact CD2-O 3.44Å; V257-F358 PolarHBondContact N-O 3.11Å; V257-F358 PolarHBondContact O-N 3.49Å; W259-F358 AromaticContact CH2-CD2 3.92Å; W259-F358 HydrophobicContact CH2-CD2 3.92Å; W259-F358 HydrophobicContact CH2-CE2 4.49Å; W259-F358 HydrophobicContact CZ3-CB 4.45Å; W259-F358 AromaticContact CZ3-CD2 3.56Å; W259-F358 HydrophobicContact CZ3-CD2 3.56Å; W259-F358 AromaticContact CZ3-CE2 3.94Å; W259-F358 HydrophobicContact CZ3-CE2 3.94Å; W259-F358 HydrophobicContact CZ3-CG 4.07Å; I271-F358 HydrophobicContact CD1-CD2 4.3Å; I271-F358 HydrophobicContact CD1-CE2 4.25Å; V286-F358 HydrophobicContact CG1-CB 4.31Å; V286-F358 HydrophobicContact CG1-CD1 3.49Å; V286-F358 VanDerWaalsContact CG1-CD1 3.49Å; V286-F358 HydrophobicContact CG1-CD2 3.88Å; V286-F358 HydrophobicContact CG1-CE1 3.69Å; V286-F358 HydrophobicContact CG1-CE2 4.04Å; V286-F358 HydrophobicContact CG1-CG 3.62Å; V286-F358 HydrophobicContact CG1-CZ 3.96Å; H287-F358 VanDerWaalsContact O-CA 3.3Å; H287-F358 WeakPolarHBondContact O-CA 3.27Å; C288-F358 HydrophobicContact CB-CD1 4.41Å; F299-F358 AromaticContact CD1-CE1 3.88Å; F299-F358 HydrophobicContact CD1-CE1 3.88Å; F299-F358 AromaticContact CD1-CZ 3.86Å; F299-F358 HydrophobicContact CD1-CZ 3.86Å; F299-F358 HydrophobicContact CE1-CE1 4.49Å; F349-F358 HydrophobicContact CB-CE2 4.49Å; F349-F358 HydrophobicContact CB-CZ 4.19Å; F349-F358 HydrophobicContact CD1-CE2 4.13Å; F349-F358 AromaticContact CD1-CZ 3.83Å; F349-F358 HydrophobicContact CD1-CZ 3.83Å; F349-F358 HydrophobicContact CD2-CE2 4Å; F349-F358 HydrophobicContact CD2-CZ 4.42Å; F349-F358 HydrophobicContact CE1-CE2 4.31Å; F349-F358 HydrophobicContact CE1-CZ 4.26Å; F349-F358 HydrophobicContact CE2-CE2 4.19Å; F349-F358 AromaticContact CG-CE2 3.96Å; F349-F358 HydrophobicContact CG-CE2 3.96Å; F349-F358 AromaticContact CG-CZ 3.91Å; F349-F358 HydrophobicContact CG-CZ 3.91Å; F349-F358 HydrophobicContact CZ-CE2 4.34Å; M356-F358 HydrophobicContact CE-CZ 4.29Å; M356-F358 HydrophobicContact CG-CD1 4.37Å; M356-F358 HydrophobicContact CG-CE1 3.61Å; M356-F358 HydrophobicContact CG-CZ 3.81Å; M356-F358 HydrophobicContact SD-CE1 3.92Å; M356-F358 HydrophobicContact SD-CE2 4.48Å; M356-F358 HydrophobicContact SD-CZ 3.56Å; M356-F358 VanDerWaalsContact SD-CZ 3.56Å; F358-I361 HydrophobicContact CD2-CD1 4.03Å
359	S	95.9	Very high	88.2	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	-28.2	171.8	71.9	0	0	0	0	113.8	Q231 L232 G238 D255 H287	Q231-S359 CarbonylContact C-O 3.58Å; L232-S359 WeakPolarHBondContact CA-O 3.47Å; G238-S359 PolarHBondContact N-OG 2.99Å; G238-S359 VanDerWaalsContact N-OG 3.11Å; D255-S359 WeakPolarHBondContact O-CB 3.04Å; H287-S359 PolarHBondContact ND1-OG 3.13Å; H287-S359 PolarHBondContact O-N 3.5Å; H287-S359 VanDerWaalsContact O-N 3.08Å
360	E	95.8	Very high	85.1	Confident	3 Å²	3	40 Å²	40	1%	0.014	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	137.6	-170.6	-179.8	64.9	-107.8	0	0	110.2	L232 T233 G235 V236 H287 F332 T362	L232-E360 CarbonylContact O-C 3.59Å; T233-E360 WeakPolarHBondContact CA-OE1 3.26Å; G235-E360 WeakPolarHBondContact CA-OE2 3.34Å; G235-E360 PolarHBondContact N-OE2 2.98Å; V236-E360 PolarHBondContact N-OE2 3.03Å; H287-E360 HydrophobicContact CB-CB 3.88Å; H287-E360 PolarHBondContact N-O 3.03Å; F332-E360 HydrophobicContact CE1-CB 4.28Å; F332-E360 HydrophobicContact CE1-CG 4.01Å; F332-E360 HydrophobicContact CZ-CB 4.33Å; F332-E360 HydrophobicContact CZ-CG 3.98Å; E360-T362 HydrophobicContact CG-CG2 4.34Å
361	I	96.6	Very high	81.8	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	116.7	178.7	-54.9	-175.6	0	0	0	109.4	L232 I271 F273 M284 K285 V286 F358 F363	L232-I361 HydrophobicContact CB-CG1 4.37Å; L232-I361 HydrophobicContact CD1-CD1 4.13Å; L232-I361 PolarHBondContact O-N 3.31Å; I271-I361 HydrophobicContact CD1-CD1 4.3Å; F273-I361 HydrophobicContact CE1-CB 4.44Å; F273-I361 HydrophobicContact CE1-CD1 4.19Å; F273-I361 HydrophobicContact CE1-CG2 3.85Å; F273-I361 HydrophobicContact CZ-CD1 3.89Å; F273-I361 HydrophobicContact CZ-CG2 3.92Å; M284-I361 HydrophobicContact CG-CG2 4.14Å; M284-I361 HydrophobicContact SD-CG2 4.26Å; K285-I361 WeakPolarHBondContact O-CA 3.36Å; V286-I361 HydrophobicContact CG1-CD1 4.47Å; V286-I361 HydrophobicContact CG1-CG1 4.19Å; V286-I361 HydrophobicContact CG2-CG1 4.4Å; V286-I361 HydrophobicContact CG2-CG2 4.27Å; F358-I361 HydrophobicContact CD2-CD1 4.03Å; I361-F363 HydrophobicContact CG2-CE2 3.82Å; I361-F363 HydrophobicContact CG2-CZ 4.02Å
362	T	94.3	Very high	78.6	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.018	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	148.2	-179.1	52.1	0	0	0	0	112.3	D190 M284 K285 E360	D190-T362 WeakPolarHBondContact OD2-CA 3.45Å; M284-T362 CarbonylContact C-O 3.37Å; M284-T362 WeakPolarHBondContact CA-O 3.44Å; K285-T362 PolarHBondContact N-O 2.83Å; K285-T362 PolarHBondContact O-N 2.91Å; E360-T362 HydrophobicContact CG-CG2 4.34Å
363	F	94.3	Very high	75.4	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	132.7	-179.5	-60.1	-96.3	0	0	0	110.8	S24 D190 L192 F273 F275 F281 M284 L337 I345 I361	S24-F363 WeakPolarHBondContact CB-O 3.26Å; S24-F363 PolarHBondContact OG-O 3.43Å; D190-F363 PolarHBondContact OD2-N 2.92Å; L192-F363 HydrophobicContact CD2-CE2 4.28Å; F273-F363 HydrophobicContact CB-CE2 4.44Å; F273-F363 HydrophobicContact CB-CZ 4.12Å; F273-F363 AromaticContact CD1-CE2 3.57Å; F273-F363 HydrophobicContact CD1-CE2 3.57Å; F273-F363 AromaticContact CD1-CZ 3.57Å; F273-F363 HydrophobicContact CD1-CZ 3.57Å; F273-F363 AromaticContact CD2-CZ 3.73Å; F273-F363 HydrophobicContact CD2-CZ 3.73Å; F273-F363 AromaticContact CE1-CE2 3.87Å; F273-F363 HydrophobicContact CE1-CE2 3.87Å; F273-F363 AromaticContact CE1-CZ 3.81Å; F273-F363 HydrophobicContact CE1-CZ 3.81Å; F273-F363 AromaticContact CE2-CZ 3.96Å; F273-F363 HydrophobicContact CE2-CZ 3.96Å; F273-F363 AromaticContact CG-CE2 3.96Å; F273-F363 HydrophobicContact CG-CE2 3.96Å; F273-F363 AromaticContact CG-CZ 3.53Å; F273-F363 HydrophobicContact CG-CZ 3.53Å; F273-F363 HydrophobicContact CZ-CE2 4.47Å; F273-F363 AromaticContact CZ-CZ 3.99Å; F273-F363 HydrophobicContact CZ-CZ 3.99Å; F275-F363 HydrophobicContact CE1-CB 4.13Å; F275-F363 HydrophobicContact CE1-CD1 4.44Å; F275-F363 AromaticContact CE1-CD2 3.81Å; F275-F363 HydrophobicContact CE1-CD2 3.81Å; F275-F363 HydrophobicContact CE1-CE2 4.37Å; F275-F363 AromaticContact CE1-CG 3.87Å; F275-F363 HydrophobicContact CE1-CG 3.87Å; F275-F363 HydrophobicContact CZ-CB 4.41Å; F275-F363 AromaticContact CZ-CD1 3.88Å; F275-F363 HydrophobicContact CZ-CD1 3.88Å; F275-F363 AromaticContact CZ-CD2 3.72Å; F275-F363 HydrophobicContact CZ-CD2 3.72Å; F275-F363 HydrophobicContact CZ-CE1 4.03Å; F275-F363 AromaticContact CZ-CE2 3.9Å; F275-F363 HydrophobicContact CZ-CE2 3.9Å; F275-F363 AromaticContact CZ-CG 3.73Å; F275-F363 HydrophobicContact CZ-CG 3.73Å; F275-F363 HydrophobicContact CZ-CZ 4.06Å; F281-F363 HydrophobicContact CD1-CB 4.08Å; F281-F363 HydrophobicContact CD1-CD1 4.12Å; F281-F363 HydrophobicContact CD1-CG 4.49Å; F281-F363 HydrophobicContact CE1-CB 3.89Å; F281-F363 HydrophobicContact CE1-CD1 4.14Å; F281-F363 HydrophobicContact CE1-CG 4.23Å; M284-F363 HydrophobicContact CB-CD1 3.8Å; M284-F363 HydrophobicContact CB-CE1 3.77Å; M284-F363 HydrophobicContact CG-CD1 4.02Å; M284-F363 HydrophobicContact CG-CE1 3.6Å; M284-F363 HydrophobicContact CG-CZ 3.93Å; M284-F363 HydrophobicContact SD-CD1 4.5Å; M284-F363 HydrophobicContact SD-CE1 3.53Å; M284-F363 VanDerWaalsContact SD-CE1 3.53Å; M284-F363 HydrophobicContact SD-CZ 3.68Å; L337-F363 HydrophobicContact CD1-CD1 4.01Å; L337-F363 HydrophobicContact CD1-CE1 4.36Å; I345-F363 HydrophobicContact CD1-CD1 4.06Å; I345-F363 HydrophobicContact CD1-CE1 3.97Å; I361-F363 HydrophobicContact CG2-CE2 3.82Å; I361-F363 HydrophobicContact CG2-CZ 4.02Å
364	Q	90.2	Very high	72.6	Confident	40 Å²	40	58.4 Å²	58.4	19%	0.187	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	108.7	173.4	-172.8	-173.8	-20.9	0	0	108.9	V22 T282 S283	V22-Q364 VanDerWaalsContact O-CD 3.28Å; V22-Q364 PolarHBondContact O-OE1 2.69Å; T282-Q364 PolarHBondContact N-O 2.85Å; T282-Q364 WeakPolarHBondContact OG1-CB 3.48Å; T282-Q364 WeakPolarHBondContact OG1-CG 3.46Å; T282-Q364 PolarHBondContact OG1-O 3.17Å; S283-Q364 PolarHBondContact N-O 3.11Å; S283-Q364 PolarHBondContact O-N 2.9Å
365	S	88.3	Confident	69.6	Low	17 Å²	17	63.2 Å²	63.2	12%	0.119	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	151	-175.3	67.9	0	0	0	0	113.7	R279 N280	R279-S365 PolarHBondContact NH1-OG 2.63Å; R279-S365 VanDerWaalsContact NH1-OG 3.13Å; N280-S365 CarbonylContact O-C 3.57Å; N280-S365 WeakPolarHBondContact O-CA 3.35Å; N280-S365 WeakPolarHBondContact O-CB 3.21Å
366	D	79.3	Confident	66.5	Low	99 Å²	99	67 Å²	67	53%	0.529	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	149.7	171	-65.8	-48.1	0	0	0	110.8	N280	N280-D366 HydrophobicContact CB-CB 4.37Å; N280-D366 WeakPolarHBondContact CB-O 3.31Å; N280-D366 PolarHBondContact N-O 3.16Å; N280-D366 PolarHBondContact O-N 2.92Å
367	T	61.3	Low	63.1	Low	91 Å²	91	73.6 Å²	73.6	56%	0.558	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	125.7	174	55	0	0	0	0	111.5
368	A	50.3	Low	60.3	Low	39 Å²	39	79 Å²	79	32%	0.322	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-82.9	121.4	-177.7	0	0	0	0	0	113.1	M341	M341-A368 HydrophobicContact CE-CB 3.28Å; M341-A368 HydrophobicContact SD-CB 3.84Å
369	M	35.1	Very low	56.9	Low	180 Å²	180	89 Å²	89	89%	0.887	50%	0.504	S	S	*	.			trans	-86.7	109.2	165.2	-69.1	-170.9	176.8	0	0	110	N371	M369-N371 PolarHBondContact O-N 2.79Å; M369-N371 VanDerWaalsContact O-N 3.11Å
370	Y	34.1	Very low	53.9	Low	149 Å²	149	95.1 Å²	95.1	58%	0.584	55%	0.545	S	S	*	.			trans	-73	99	178.3	-75.3	-91.5	0	0	0	112.1	I278 M341	I278-Y370 WeakPolarHBondContact CD1-OH 3.22Å; M341-Y370 HydrophobicContact CE-CE2 4.46Å
371	N	27	Very low	50.6	Low	164 Å²	164	98.4 Å²	98.4	88%	0.877	58%	0.579	S	S	*	*			trans	-97	112.8	158.9	-94.4	-24.7	0	0	0	109.4	M369 T373	M369-N371 PolarHBondContact O-N 2.79Å; M369-N371 VanDerWaalsContact O-N 3.11Å; N371-T373 PolarHBondContact O-N 2.86Å
372	T	31.6	Very low	47.4	Very low	123 Å²	123	105.5 Å²	105.5	76%	0.755	62%	0.623	S	S	*	*			trans	-85.2	98.9	-170.6	51.5	0	0	0	0	113.5
373	T	27.7	Very low	44.1	Very low	132 Å²	132	110.2 Å²	110.2	81%	0.81	66%	0.656	S	S	*	*			trans	-174.7	125.6	137.8	12.9	0	0	0	0	112.2	N371	N371-T373 PolarHBondContact O-N 2.86Å
374	P	36.2	Very low	41.9	Very low	122 Å²	122	115.7 Å²	115.7	79%	0.792	69%	0.691	S	S	*	*			trans	-92.7	133.5	174.1	34	-31.5	0	0	0	112.6
375	P	33.5	Very low	39.8	Very low	132 Å²	132	119 Å²	119	86%	0.857	72%	0.716	S	S	*	*			trans	-86.7	119.6	170.5	31.9	-30.8	0	0	0	111.7
376	S	30.9	Very low	37.4	Very low	111 Å²	111	124 Å²	124	78%	0.776	75%	0.748	S	S	*	*			trans	-109.2	121.2	-175.4	61	0	0	0	0	114
377	T	27.4	Very low	35.3	Very low	138 Å²	138	124 Å²	124	85%	0.847	76%	0.756	S	S	*	*			trans	-154.8	167.8	165.9	56.5	0	0	0	0	110.3
378	P	38.7	Very low	34.2	Very low	114 Å²	114	124.9 Å²	124.9	74%	0.74	76%	0.764	S	S	*	*				-136.4	167.1	-52.1	38.9	-24.6	0	0	0	113.2
379	K	27	Very low	33.2	Very low	210 Å²	210	131 Å²	131	91%	0.913	79%	0.785	S	S	*	*			trans	-142.1	157	156.7	-80.5	-165.8	177.8	174.9	0	112.1
380	P	33.4	Very low	33	Very low	130 Å²	130	130.1 Å²	130.1	84%	0.844	78%	0.784	S	S	*	*			trans	-121.8	166.1	-157.9	40.6	-27.3	0	0	0	117
381	G	26.5	Very low	32.7	Very low	72 Å²	72	130 Å²	130	74%	0.742	79%	0.794	S	S	*	*			trans	103.8	139.5	176.9	0	0	0	0	0	112.7
382	T	28.3	Very low	33.6	Very low	149 Å²	149	127.1 Å²	127.1	91%	0.914	78%	0.784	S	S	*	*			cis	-151.2	171.6	6.1	-51.6	0	0	0	0	109.3
383	S	25.2	Very low	33.8	Very low	103 Å²	103	127.8 Å²	127.8	72%	0.72	79%	0.788	S	S	*	*			trans	-134.3	-169.1	-168.5	62.3	0	0	0	0	113.1
384	P	48	Very low	34.5	Very low	114 Å²	114	129.1 Å²	129.1	74%	0.74	79%	0.785	S	S	*	*			cis	-111.5	-133.5	-43.6	38.7	-22.2	0	0	0	108.3
385	P	45.3	Very low	34.6	Very low	110 Å²	110	133.3 Å²	133.3	71%	0.714	79%	0.791	S	S	*	*			cis	-118.4	-150.6	-38.8	44.1	-27.7	0	0	0	110.1
386	P	38.9	Very low	35.3	Very low	122 Å²	122	132.7 Å²	132.7	79%	0.792	78%	0.784	S	S	*	*			cis	-123.8	178.5	-20.1	41.4	-25.8	0	0	0	115
387	S	34.4	Very low	36.2	Very low	98 Å²	98	132.6 Å²	132.6	69%	0.685	78%	0.775	S	S	*	*			trans	-90.6	162.5	176.3	52.2	0	0	0	0	113.7
388	P	38.7	Very low	37.6	Very low	111 Å²	111	130.5 Å²	130.5	72%	0.721	76%	0.758	S	S	*	*				-146	177.1	94.2	35.4	-17.3	0	0	0	114.4
389	E	29.3	Very low	38.6	Very low	167 Å²	167	128.6 Å²	128.6	78%	0.78	75%	0.748	S	S	*	*			cis	-167.7	-177.6	-30.7	-101.3	154.4	166.1	0	0	109.2
390	D	30.9	Very low	40	Very low	161 Å²	161	123.1 Å²	123.1	86%	0.861	73%	0.728	S	S	*	*			trans	77.8	129.7	158.7	-78.8	-4	0	0	0	126.4
391	D	28.8	Very low	41.3	Very low	148 Å²	148	120.7 Å²	120.7	79%	0.791	71%	0.711	S	S	*	*			trans	76.5	126.1	144	-142.9	49.8	0	0	0	123.4
392	P	44.8	Very low	43.1	Very low	103 Å²	103	125 Å²	125	67%	0.669	71%	0.705	S	S	*	*			trans	-109	134.5	178.7	37.7	-27.9	0	0	0	114.5
393	T	36.3	Very low	45	Very low	136 Å²	136	122.8 Å²	122.8	83%	0.834	69%	0.687	S	S	*	*			trans	-165.5	140.9	137.3	9.3	0	0	0	0	115
394	H	41.9	Very low	47.1	Very low	161 Å²	161	123.6 Å²	123.6	75%	0.745	68%	0.682	S	S	*	*			trans	60.1	77.9	141	-153.2	-74.3	0	0	0	120.2
395	K	37.6	Very low	48.4	Very low	210 Å²	210	122.8 Å²	122.8	91%	0.913	67%	0.671	S	S	*	*			trans	-128.3	124.6	140.6	-72.9	-168.9	178.5	179.7	0	110.5
396	V	49.3	Very low	50.1	Low	119 Å²	119	119.6 Å²	119.6	72%	0.721	66%	0.657	S	S	*	*			trans	-80.3	153	172.8	176.2	0	0	0	0	109.1	D398	V396-D398 PolarHBondContact O-N 3.26Å
397	D	49.3	Very low	52	Low	108 Å²	108	117 Å²	117	58%	0.578	64%	0.642	S	S	*	*			trans	-61.4	88.9	-173.8	-77.6	-47.6	0	0	0	114.9	S399 N400 T401	D397-S399 PolarHBondContact O-N 2.86Å; D397-N400 HydrophobicContact CB-CB 4.28Å; D397-N400 WeakPolarHBondContact CB-ND2 3.4Å; D397-N400 PolarHBondContact OD2-ND2 3.19Å; D397-T401 PolarHBondContact O-OG1 3.29Å
398	D	57.1	Low	54.3	Low	95 Å²	95	117 Å²	117	51%	0.508	63%	0.633	S	S	.	*	H	α-helix	trans	-70.3	-9.2	171.7	-161.9	23	0	0	0	112.5	V396 R402	V396-D398 PolarHBondContact O-N 3.26Å; D398-R402 WeakPolarHBondContact O-CD 3.42Å; D398-R402 WeakPolarHBondContact O-CG 3.22Å; D398-R402 PolarHBondContact O-NE 2.84Å; D398-R402 IonicContact OD1-NE 3.82Å; D398-R402 IonicContact OD2-CZ 3.9Å; D398-R402 IonicContact OD2-NE 2.67Å; D398-R402 PolarHBondContact OD2-NE 3.35Å; D398-R402 IonicContact OD2-NH2 3.61Å; D398-R402 PolarHBondContact OD2-NH2 3.29Å
399	S	59	Low	56.7	Low	73 Å²	73	115 Å²	115	51%	0.51	62%	0.619	S	S	.	*	H	α-helix	trans	-79	-51.6	175.3	-168.3	0	0	0	0	112.4	D397 T401 R402 I403	D397-S399 PolarHBondContact O-N 2.86Å; S399-T401 VanDerWaalsContact C-N 3.28Å; S399-T401 PolarHBondContact O-N 2.85Å; S399-R402 PolarHBondContact O-N 3.24Å; S399-R402 VanDerWaalsContact O-N 3.13Å; S399-I403 PolarHBondContact O-N 3.18Å; S399-I403 VanDerWaalsContact O-N 3.07Å
400	N	56.3	Low	59.3	Low	95 Å²	95	109.3 Å²	109.3	51%	0.508	60%	0.601	S	S	.	*	H	α-helix	trans	-60.5	-39	-176.6	-69.6	-35.2	0	0	0	111.8	D397 I403 L404	D397-N400 HydrophobicContact CB-CB 4.28Å; D397-N400 WeakPolarHBondContact CB-ND2 3.4Å; D397-N400 PolarHBondContact OD2-ND2 3.19Å; N400-I403 PolarHBondContact O-N 2.8Å; N400-L404 WeakPolarHBondContact O-CB 3.49Å; N400-L404 PolarHBondContact O-N 2.77Å
401	T	62	Low	62.1	Low	80 Å²	80	106.2 Å²	106.2	49%	0.491	58%	0.583	S	S	.	*	H	α-helix	trans	-63.3	-42.3	177.4	-48.1	0	0	0	0	112.1	D397 S399 L404 I405	D397-T401 PolarHBondContact O-OG1 3.29Å; S399-T401 VanDerWaalsContact C-N 3.28Å; S399-T401 PolarHBondContact O-N 2.85Å; T401-L404 PolarHBondContact O-N 3.31Å; T401-I405 HydrophobicContact CG2-CD1 4.14Å; T401-I405 WeakPolarHBondContact O-CD1 3.31Å; T401-I405 VanDerWaalsContact O-CG1 3.28Å; T401-I405 WeakPolarHBondContact O-CG1 3.28Å; T401-I405 PolarHBondContact O-N 2.71Å
402	R	63.2	Low	65.1	Low	163 Å²	163	103.7 Å²	103.7	62%	0.615	57%	0.569	S	S	*	*	H	α-helix	trans	-67.4	-40.6	178	-66.5	168.9	-168.2	-154.8	5.1	112.1	D398 S399 I405 G406	D398-R402 WeakPolarHBondContact O-CD 3.42Å; D398-R402 WeakPolarHBondContact O-CG 3.22Å; D398-R402 PolarHBondContact O-NE 2.84Å; D398-R402 IonicContact OD1-NE 3.82Å; D398-R402 IonicContact OD2-CZ 3.9Å; D398-R402 IonicContact OD2-NE 2.67Å; D398-R402 PolarHBondContact OD2-NE 3.35Å; D398-R402 IonicContact OD2-NH2 3.61Å; D398-R402 PolarHBondContact OD2-NH2 3.29Å; S399-R402 PolarHBondContact O-N 3.24Å; S399-R402 VanDerWaalsContact O-N 3.13Å; R402-I405 PolarHBondContact O-N 2.7Å; R402-G406 PolarHBondContact O-N 2.91Å
403	I	69.9	Low	67.2	Low	101 Å²	101	105.8 Å²	105.8	52%	0.518	57%	0.568	S	S	.	*	H	α-helix	trans	-62.4	-45.1	175.4	-67.6	160.1	0	0	0	110.3	S399 N400 I405 G406 C407	S399-I403 PolarHBondContact O-N 3.18Å; S399-I403 VanDerWaalsContact O-N 3.07Å; N400-I403 PolarHBondContact O-N 2.8Å; I403-I405 VanDerWaalsContact C-N 3.35Å; I403-I405 PolarHBondContact O-N 2.81Å; I403-G406 PolarHBondContact O-N 2.82Å; I403-C407 PolarHBondContact O-N 2.88Å; I403-C407 PolarHBondContact O-SG 2.92Å
404	L	67.9	Low	69.9	Low	121 Å²	121	104.3 Å²	104.3	63%	0.634	55%	0.554	S	S	*	*	H	α-helix	trans	-62.1	-41.3	178.6	-156.4	80.2	0	0	0	112.2	N400 T401 C407 L408	N400-L404 WeakPolarHBondContact O-CB 3.49Å; N400-L404 PolarHBondContact O-N 2.77Å; T401-L404 PolarHBondContact O-N 3.31Å; L404-C407 PolarHBondContact O-N 3.02Å; L404-L408 WeakPolarHBondContact O-CB 3.38Å; L404-L408 PolarHBondContact O-N 2.81Å
405	I	76.6	Confident	72.2	Confident	97 Å²	97	101.3 Å²	101.3	50%	0.497	54%	0.542	S	S	.	.	H	α-helix	trans	-62.7	-44.2	174.3	-69.8	164.5	0	0	0	110.9	T401 R402 I403 C407 L408 V409	T401-I405 HydrophobicContact CG2-CD1 4.14Å; T401-I405 WeakPolarHBondContact O-CD1 3.31Å; T401-I405 VanDerWaalsContact O-CG1 3.28Å; T401-I405 WeakPolarHBondContact O-CG1 3.28Å; T401-I405 PolarHBondContact O-N 2.71Å; R402-I405 PolarHBondContact O-N 2.7Å; I403-I405 VanDerWaalsContact C-N 3.35Å; I403-I405 PolarHBondContact O-N 2.81Å; I405-C407 PolarHBondContact O-N 2.96Å; I405-L408 PolarHBondContact O-N 3.32Å; I405-V409 HydrophobicContact CG2-CG2 4.38Å; I405-V409 WeakPolarHBondContact O-CG2 3.41Å; I405-V409 PolarHBondContact O-N 3.11Å
406	G	79.4	Confident	74.8	Confident	42 Å²	42	95 Å²	95	43%	0.433	52%	0.521	S	S	.	.	H	α-helix	trans	-58.2	-46.8	176.7	0	0	0	0	0	112.8	R402 I403 V409 A410	R402-G406 PolarHBondContact O-N 2.91Å; I403-G406 PolarHBondContact O-N 2.82Å; G406-V409 PolarHBondContact O-N 2.92Å; G406-A410 PolarHBondContact O-N 3.14Å
407	C	80.4	Confident	76.8	Confident	69 Å²	69	91.7 Å²	91.7	47%	0.466	51%	0.506	S	S	.	.	H	α-helix	trans	-62.9	-42.4	175.6	-67.6	0	0	0	0	112.5	I403 L404 I405 A410 I411	I403-C407 PolarHBondContact O-N 2.88Å; I403-C407 PolarHBondContact O-SG 2.92Å; L404-C407 PolarHBondContact O-N 3.02Å; I405-C407 PolarHBondContact O-N 2.96Å; C407-A410 PolarHBondContact O-N 3.13Å; C407-I411 WeakPolarHBondContact O-CD1 3.43Å; C407-I411 VanDerWaalsContact O-CG1 3.28Å; C407-I411 WeakPolarHBondContact O-CG1 3.33Å; C407-I411 PolarHBondContact O-N 2.97Å
408	L	81.6	Confident	78.9	Confident	96 Å²	96	90.4 Å²	90.4	50%	0.503	50%	0.499	S	S	.	.	H	α-helix	trans	-61.1	-45.2	175.8	-95	159.8	0	0	0	112.2	L404 I405 I411 I412	L404-L408 WeakPolarHBondContact O-CB 3.38Å; L404-L408 PolarHBondContact O-N 2.81Å; I405-L408 PolarHBondContact O-N 3.32Å; L408-I411 PolarHBondContact O-N 2.87Å; L408-I412 WeakPolarHBondContact O-CD1 3.19Å; L408-I412 VanDerWaalsContact O-CG1 3.25Å; L408-I412 WeakPolarHBondContact O-CG1 3.33Å; L408-I412 PolarHBondContact O-N 2.89Å
409	V	88.9	Confident	80.6	Confident	69 Å²	69	90.5 Å²	90.5	42%	0.418	50%	0.498	S	S	.	.	H	α-helix	trans	-62.6	-44.2	177.1	170.5	0	0	0	0	111	I405 G406 I411 I412 F413	I405-V409 HydrophobicContact CG2-CG2 4.38Å; I405-V409 WeakPolarHBondContact O-CG2 3.41Å; I405-V409 PolarHBondContact O-N 3.11Å; G406-V409 PolarHBondContact O-N 2.92Å; V409-I411 PolarHBondContact O-N 2.78Å; V409-I412 PolarHBondContact O-N 3.25Å; V409-F413 HydrophobicContact CG1-CD2 3.77Å; V409-F413 HydrophobicContact CG1-CE2 3.79Å; V409-F413 WeakPolarHBondContact O-CD2 3.44Å; V409-F413 PolarHBondContact O-N 3.38Å
410	A	85	Confident	82.2	Confident	49 Å²	49	90.8 Å²	90.8	41%	0.405	50%	0.497	S	S	.	.	H	α-helix	trans	-60.7	-44	176.8	0	0	0	0	0	112.6	G406 C407 I412 F413 I414	G406-A410 PolarHBondContact O-N 3.14Å; C407-A410 PolarHBondContact O-N 3.13Å; A410-I412 VanDerWaalsContact C-N 3.34Å; A410-I412 PolarHBondContact O-N 3.19Å; A410-F413 PolarHBondContact O-N 2.89Å; A410-I414 WeakPolarHBondContact O-CG1 3.35Å; A410-I414 PolarHBondContact O-N 3.09Å
411	I	89.3	Confident	83.9	Confident	96 Å²	96	91.6 Å²	91.6	49%	0.492	50%	0.5	S	S	.	.	H	α-helix	trans	-63.2	-40.5	176.5	-69	164.9	0	0	0	111.1	C407 L408 V409 I414 L415	C407-I411 WeakPolarHBondContact O-CD1 3.43Å; C407-I411 VanDerWaalsContact O-CG1 3.28Å; C407-I411 WeakPolarHBondContact O-CG1 3.33Å; C407-I411 PolarHBondContact O-N 2.97Å; L408-I411 PolarHBondContact O-N 2.87Å; V409-I411 PolarHBondContact O-N 2.78Å; I411-I414 PolarHBondContact O-N 2.78Å; I411-L415 HydrophobicContact CG2-CD1 3.99Å; I411-L415 WeakPolarHBondContact O-CG 3.49Å; I411-L415 PolarHBondContact O-N 3.31Å
412	I	90.4	Very high	85.3	Confident	94 Å²	94	91.8 Å²	91.8	48%	0.482	50%	0.497	S	S	.	.	H	α-helix	trans	-63	-44.3	175.9	-70	163.5	0	0	0	111	L408 V409 A410 I414 L415 V416	L408-I412 WeakPolarHBondContact O-CD1 3.19Å; L408-I412 VanDerWaalsContact O-CG1 3.25Å; L408-I412 WeakPolarHBondContact O-CG1 3.33Å; L408-I412 PolarHBondContact O-N 2.89Å; V409-I412 PolarHBondContact O-N 3.25Å; A410-I412 VanDerWaalsContact C-N 3.34Å; A410-I412 PolarHBondContact O-N 3.19Å; I412-I414 PolarHBondContact O-N 2.93Å; I412-L415 PolarHBondContact O-N 3.01Å; I412-V416 HydrophobicContact CG2-CG2 4.47Å; I412-V416 WeakPolarHBondContact O-CG2 3.37Å; I412-V416 PolarHBondContact O-N 2.93Å
413	F	90.7	Very high	86.4	Confident	148 Å²	148	88.5 Å²	88.5	65%	0.649	49%	0.491	S	S	*	.	H	α-helix	trans	-61.9	-41.2	175.9	-90.6	-74.6	0	0	0	112.7	V409 A410 V416 A417	V409-F413 HydrophobicContact CG1-CD2 3.77Å; V409-F413 HydrophobicContact CG1-CE2 3.79Å; V409-F413 WeakPolarHBondContact O-CD2 3.44Å; V409-F413 PolarHBondContact O-N 3.38Å; A410-F413 PolarHBondContact O-N 2.89Å; F413-V416 PolarHBondContact O-N 3.36Å; F413-A417 WeakPolarHBondContact O-CB 3.4Å; F413-A417 PolarHBondContact O-N 3.06Å
414	I	91.3	Very high	87.3	Confident	105 Å²	105	91.8 Å²	91.8	54%	0.538	50%	0.497	S	S	.	.	H	α-helix	trans	-63.3	-44.2	175.8	-68.5	164.9	0	0	0	110.8	A410 I411 I412 A417 I418	A410-I414 WeakPolarHBondContact O-CG1 3.35Å; A410-I414 PolarHBondContact O-N 3.09Å; I411-I414 PolarHBondContact O-N 2.78Å; I412-I414 PolarHBondContact O-N 2.93Å; I414-A417 PolarHBondContact O-N 2.79Å; I414-I418 HydrophobicContact CG2-CD1 3.87Å; I414-I418 VanDerWaalsContact O-CG1 3.32Å; I414-I418 WeakPolarHBondContact O-CG1 3.46Å; I414-I418 PolarHBondContact O-N 2.74Å
415	L	90.5	Very high	88	Confident	97 Å²	97	94.3 Å²	94.3	51%	0.508	50%	0.498	S	S	.	.	H	α-helix	trans	-63.5	-41.1	176.5	-73.9	168.5	0	0	0	112.3	I411 I412 I418 I419	I411-L415 HydrophobicContact CG2-CD1 3.99Å; I411-L415 WeakPolarHBondContact O-CG 3.49Å; I411-L415 PolarHBondContact O-N 3.31Å; I412-L415 PolarHBondContact O-N 3.01Å; L415-I418 PolarHBondContact O-N 3.39Å; L415-I419 WeakPolarHBondContact O-CD1 3.47Å; L415-I419 VanDerWaalsContact O-CG1 3.26Å; L415-I419 WeakPolarHBondContact O-CG1 3.39Å; L415-I419 PolarHBondContact O-N 2.8Å
416	V	93.3	Very high	88	Confident	78 Å²	78	94.4 Å²	94.4	47%	0.473	50%	0.497	S	S	.	.	H	α-helix	trans	-63.3	-43.6	174.5	170.7	0	0	0	0	111	I412 F413 I418 I419 V420	I412-V416 HydrophobicContact CG2-CG2 4.47Å; I412-V416 WeakPolarHBondContact O-CG2 3.37Å; I412-V416 PolarHBondContact O-N 2.93Å; F413-V416 PolarHBondContact O-N 3.36Å; V416-I418 PolarHBondContact O-N 2.92Å; V416-I419 PolarHBondContact O-N 3.25Å; V416-V420 HydrophobicContact CG1-CG2 4.42Å; V416-V420 WeakPolarHBondContact O-CG2 3.4Å; V416-V420 PolarHBondContact O-N 3.38Å
417	A	90.9	Very high	88	Confident	49 Å²	49	96.6 Å²	96.6	41%	0.405	50%	0.501	S	S	.	.	H	α-helix	trans	-60.9	-43.4	176.2	0	0	0	0	0	112.1	F413 I414 V420 I421	F413-A417 WeakPolarHBondContact O-CB 3.4Å; F413-A417 PolarHBondContact O-N 3.06Å; I414-A417 PolarHBondContact O-N 2.79Å; A417-V420 PolarHBondContact O-N 2.74Å; A417-I421 VanDerWaalsContact O-CG1 3.29Å; A417-I421 WeakPolarHBondContact O-CG1 3.39Å; A417-I421 PolarHBondContact O-N 3.07Å
418	I	92.8	Very high	87.6	Confident	82 Å²	82	100.7 Å²	100.7	42%	0.421	51%	0.507	S	S	.	.	H	α-helix	trans	-62.2	-43.3	175.1	-69.3	165.7	0	0	0	111.1	I414 L415 V416 I421 I422	I414-I418 HydrophobicContact CG2-CD1 3.87Å; I414-I418 VanDerWaalsContact O-CG1 3.32Å; I414-I418 WeakPolarHBondContact O-CG1 3.46Å; I414-I418 PolarHBondContact O-N 2.74Å; L415-I418 PolarHBondContact O-N 3.39Å; V416-I418 PolarHBondContact O-N 2.92Å; I418-I421 PolarHBondContact O-N 3.42Å; I418-I422 HydrophobicContact CG2-CD1 3.78Å; I418-I422 HydrophobicContact CG2-CG1 4.49Å; I418-I422 VanDerWaalsContact O-CG1 3.29Å; I418-I422 WeakPolarHBondContact O-CG1 3.3Å; I418-I422 PolarHBondContact O-N 2.95Å
419	I	93	Very high	87.2	Confident	96 Å²	96	101 Å²	101	49%	0.492	51%	0.506	S	S	.	.	H	α-helix	trans	-62.6	-43	176.1	-70.7	163.9	0	0	0	111	L415 V416 I422 L423	L415-I419 WeakPolarHBondContact O-CD1 3.47Å; L415-I419 VanDerWaalsContact O-CG1 3.26Å; L415-I419 WeakPolarHBondContact O-CG1 3.39Å; L415-I419 PolarHBondContact O-N 2.8Å; V416-I419 PolarHBondContact O-N 3.25Å; I419-I422 PolarHBondContact O-N 3.42Å; I419-L423 HydrophobicContact CG2-CD1 3.82Å; I419-L423 HydrophobicContact CG2-CG 4.32Å; I419-L423 WeakPolarHBondContact O-CB 3.38Å; I419-L423 VanDerWaalsContact O-CG 3.29Å; I419-L423 WeakPolarHBondContact O-CG 3.38Å; I419-L423 PolarHBondContact O-N 3.12Å
420	V	93.5	Very high	86.3	Confident	79 Å²	79	104 Å²	104	48%	0.479	51%	0.513	S	S	.	.	H	α-helix	trans	-62	-42.7	175.6	169.5	0	0	0	0	111.2	V416 A417 L423 W424	V416-V420 HydrophobicContact CG1-CG2 4.42Å; V416-V420 WeakPolarHBondContact O-CG2 3.4Å; V416-V420 PolarHBondContact O-N 3.38Å; A417-V420 PolarHBondContact O-N 2.74Å; V420-L423 PolarHBondContact O-N 3.3Å; V420-W424 VanDerWaalsContact O-CB 3.26Å; V420-W424 WeakPolarHBondContact O-CB 3.48Å; V420-W424 PolarHBondContact O-N 3.15Å
421	I	90.6	Very high	85.6	Confident	113 Å²	113	107.3 Å²	107.3	58%	0.579	52%	0.522	S	S	*	.	H	α-helix	trans	-64.2	-41.2	176.3	-69.4	163.6	0	0	0	111.3	A417 I418 R425	A417-I421 VanDerWaalsContact O-CG1 3.29Å; A417-I421 WeakPolarHBondContact O-CG1 3.39Å; A417-I421 PolarHBondContact O-N 3.07Å; I418-I421 PolarHBondContact O-N 3.42Å; I421-R425 WeakPolarHBondContact O-CB 3.19Å; I421-R425 PolarHBondContact O-N 3.41Å
422	I	91.3	Very high	84.3	Confident	84 Å²	84	107.8 Å²	107.8	43%	0.431	53%	0.525	S	S	.	.	H	α-helix	trans	-65.2	-45.1	176.4	-69.6	166.8	0	0	0	110.8	I418 I419 R425 Q426	I418-I422 HydrophobicContact CG2-CD1 3.78Å; I418-I422 HydrophobicContact CG2-CG1 4.49Å; I418-I422 VanDerWaalsContact O-CG1 3.29Å; I418-I422 WeakPolarHBondContact O-CG1 3.3Å; I418-I422 PolarHBondContact O-N 2.95Å; I419-I422 PolarHBondContact O-N 3.42Å; I422-R425 PolarHBondContact O-N 2.92Å; I422-Q426 WeakPolarHBondContact O-CG 3.34Å; I422-Q426 PolarHBondContact O-N 3.23Å
423	L	87.8	Confident	83	Confident	94 Å²	94	108.3 Å²	108.3	49%	0.492	53%	0.525	S	S	.	.	H	α-helix	trans	-65.4	-42.4	177.2	-71.2	172.6	0	0	0	111.7	I419 V420 R425 Q426 V427	I419-L423 HydrophobicContact CG2-CD1 3.82Å; I419-L423 HydrophobicContact CG2-CG 4.32Å; I419-L423 WeakPolarHBondContact O-CB 3.38Å; I419-L423 VanDerWaalsContact O-CG 3.29Å; I419-L423 WeakPolarHBondContact O-CG 3.38Å; I419-L423 PolarHBondContact O-N 3.12Å; V420-L423 PolarHBondContact O-N 3.3Å; L423-R425 PolarHBondContact O-N 3.47Å; L423-Q426 PolarHBondContact O-N 3.08Å; L423-V427 WeakPolarHBondContact O-CB 3.48Å; L423-V427 WeakPolarHBondContact O-CG2 3.31Å; L423-V427 PolarHBondContact O-N 2.82Å
424	W	88.3	Confident	81.5	Confident	170 Å²	170	107.9 Å²	107.9	64%	0.644	52%	0.523	S	S	*	.	H	α-helix	trans	-57.1	-48.9	173	-174	-70.8	0	0	0	110.7	V420 Q426 V427 W428	V420-W424 VanDerWaalsContact O-CB 3.26Å; V420-W424 WeakPolarHBondContact O-CB 3.48Å; V420-W424 PolarHBondContact O-N 3.15Å; W424-Q426 PolarHBondContact O-N 2.83Å; W424-V427 PolarHBondContact O-N 3.01Å; W424-W428 HydrophobicContact CZ2-CE3 4.41Å; W424-W428 HydrophobicContact CZ2-CZ3 4.03Å; W424-W428 AromaticContact NE1-CE3 3.43Å; W424-W428 AromaticContact NE1-CZ3 3.84Å; W424-W428 WeakPolarHBondContact O-CB 3.47Å; W424-W428 PolarHBondContact O-N 2.6Å
425	R	82	Confident	79.6	Confident	174 Å²	174	105 Å²	105	66%	0.657	52%	0.515	S	S	*	.	H	α-helix	trans	-62.5	-40.1	178.7	-166.7	174.5	-174.6	-132.4	1.7	112.2	I421 I422 L423 W428 Q429	I421-R425 WeakPolarHBondContact O-CB 3.19Å; I421-R425 PolarHBondContact O-N 3.41Å; I422-R425 PolarHBondContact O-N 2.92Å; L423-R425 PolarHBondContact O-N 3.47Å; R425-W428 PolarHBondContact O-N 2.82Å; R425-Q429 WeakPolarHBondContact O-CB 3.38Å; R425-Q429 VanDerWaalsContact O-CG 3.31Å; R425-Q429 WeakPolarHBondContact O-CG 3.09Å; R425-Q429 PolarHBondContact O-N 3.05Å
426	Q	77.8	Confident	77.8	Confident	99 Å²	99	103.9 Å²	103.9	46%	0.463	52%	0.515	S	S	.	.	H	α-helix	trans	-67.1	-37.9	174.5	-73.8	-178.8	8.1	0	0	113	I422 L423 W424 K430	I422-Q426 WeakPolarHBondContact O-CG 3.34Å; I422-Q426 PolarHBondContact O-N 3.23Å; L423-Q426 PolarHBondContact O-N 3.08Å; W424-Q426 PolarHBondContact O-N 2.83Å; Q426-K430 WeakPolarHBondContact O-CB 3.35Å; Q426-K430 WeakPolarHBondContact O-CG 3.38Å; Q426-K430 PolarHBondContact O-N 3.42Å
427	V	79.3	Confident	75.7	Confident	87 Å²	87	107.7 Å²	107.7	53%	0.527	52%	0.521	S	S	.	.	H	α-helix	trans	-66.8	-42.3	173.7	169.2	0	0	0	0	110.4	L423 W424 K430 M431	L423-V427 WeakPolarHBondContact O-CB 3.48Å; L423-V427 WeakPolarHBondContact O-CG2 3.31Å; L423-V427 PolarHBondContact O-N 2.82Å; W424-V427 PolarHBondContact O-N 3.01Å; V427-K430 CarbonylContact O-C 3.05Å; V427-K430 PolarHBondContact O-N 3.26Å; V427-M431 WeakPolarHBondContact O-CG 3.18Å; V427-M431 PolarHBondContact O-N 3.44Å
428	W	71.1	Confident	73.8	Confident	155 Å²	155	114 Å²	114	59%	0.587	53%	0.534	S	S	*	.	H	α-helix	trans	-64.6	-41.9	177.5	-152.2	-85.2	0	0	0	112	W424 R425 M431 L432	W424-W428 HydrophobicContact CZ2-CE3 4.41Å; W424-W428 HydrophobicContact CZ2-CZ3 4.03Å; W424-W428 AromaticContact NE1-CE3 3.43Å; W424-W428 AromaticContact NE1-CZ3 3.84Å; W424-W428 WeakPolarHBondContact O-CB 3.47Å; W424-W428 PolarHBondContact O-N 2.6Å; R425-W428 PolarHBondContact O-N 2.82Å; W428-M431 PolarHBondContact O-N 2.93Å; W428-L432 WeakPolarHBondContact O-CG 3.27Å; W428-L432 PolarHBondContact O-N 3.08Å
429	Q	73	Confident	72	Confident	102 Å²	102	115.3 Å²	115.3	48%	0.477	54%	0.541	S	S	.	.	H	α-helix	trans	-62.9	-42.4	172.8	-73.7	179.2	-66.5	0	0	111.9	R425 M431 L432 E433	R425-Q429 WeakPolarHBondContact O-CB 3.38Å; R425-Q429 VanDerWaalsContact O-CG 3.31Å; R425-Q429 WeakPolarHBondContact O-CG 3.09Å; R425-Q429 PolarHBondContact O-N 3.05Å; Q429-M431 VanDerWaalsContact C-N 3.31Å; Q429-M431 PolarHBondContact O-N 3.12Å; Q429-L432 PolarHBondContact O-N 3.19Å; Q429-E433 PolarHBondContact O-N 3.37Å
430	K	70.8	Confident	70	Confident	133 Å²	133	115.7 Å²	115.7	58%	0.578	54%	0.544	S	S	*	.	H	α-helix	trans	-69	-25.6	174.6	-76.1	179.5	176.7	177.3	0	113.8	Q426 V427 K434	Q426-K430 WeakPolarHBondContact O-CB 3.35Å; Q426-K430 WeakPolarHBondContact O-CG 3.38Å; Q426-K430 PolarHBondContact O-N 3.42Å; V427-K430 CarbonylContact O-C 3.05Å; V427-K430 PolarHBondContact O-N 3.26Å; K430-K434 WeakPolarHBondContact O-CB 3.28Å; K430-K434 WeakPolarHBondContact O-CG 3.42Å; K430-K434 PolarHBondContact O-N 2.82Å; K430-K434 VanDerWaalsContact O-N 3.16Å
431	M	69.3	Low	67.8	Low	119 Å²	119	116.6 Å²	116.6	59%	0.586	55%	0.546	S	S	*	.	H	α-helix	trans	-73.4	-41.3	169.9	-77.5	-61.6	-171.4	0	0	111.3	V427 W428 Q429 K434 A435	V427-M431 WeakPolarHBondContact O-CG 3.18Å; V427-M431 PolarHBondContact O-N 3.44Å; W428-M431 PolarHBondContact O-N 2.93Å; Q429-M431 VanDerWaalsContact C-N 3.31Å; Q429-M431 PolarHBondContact O-N 3.12Å; M431-K434 CarbonylContact O-C 3.58Å; M431-K434 PolarHBondContact O-N 3.49Å; M431-A435 WeakPolarHBondContact O-CB 3.34Å; M431-A435 PolarHBondContact O-N 3.19Å
432	L	63.6	Low	65.9	Low	106 Å²	106	116.4 Å²	116.4	56%	0.555	55%	0.546	S	S	*	.	H	α-helix	trans	-63.2	-42.2	173.4	-73.7	166.7	0	0	0	112.1	W428 Q429 K434 A435 S436	W428-L432 WeakPolarHBondContact O-CG 3.27Å; W428-L432 PolarHBondContact O-N 3.08Å; Q429-L432 PolarHBondContact O-N 3.19Å; L432-K434 VanDerWaalsContact C-N 3.32Å; L432-K434 PolarHBondContact O-N 3.18Å; L432-A435 PolarHBondContact O-N 3.48Å; L432-S436 VanDerWaalsContact O-CB 3.28Å; L432-S436 WeakPolarHBondContact O-CB 3.43Å; L432-S436 PolarHBondContact O-N 3.47Å
433	E	63.4	Low	63.9	Low	104 Å²	104	118.3 Å²	118.3	49%	0.486	55%	0.553	S	S	.	*	H	α-helix	trans	-60.8	-38.9	171.8	-75.3	-170.3	108.9	0	0	112.3	Q429 R437	Q429-E433 PolarHBondContact O-N 3.37Å; E433-R437 WeakPolarHBondContact O-CB 3.38Å; E433-R437 WeakPolarHBondContact O-CG 3.36Å; E433-R437 PolarHBondContact O-N 3.45Å
434	K	57.3	Low	61.6	Low	139 Å²	139	118.6 Å²	118.6	60%	0.604	55%	0.554	S	S	*	*	H	α-helix	trans	-72.8	-34.5	176.8	-82.1	-176.2	171.7	-174.1	0	113.3	K430 M431 L432 R438	K430-K434 WeakPolarHBondContact O-CB 3.28Å; K430-K434 WeakPolarHBondContact O-CG 3.42Å; K430-K434 PolarHBondContact O-N 2.82Å; K430-K434 VanDerWaalsContact O-N 3.16Å; M431-K434 CarbonylContact O-C 3.58Å; M431-K434 PolarHBondContact O-N 3.49Å; L432-K434 VanDerWaalsContact C-N 3.32Å; L432-K434 PolarHBondContact O-N 3.18Å; K434-R438 WeakPolarHBondContact O-CG 3.46Å; K434-R438 PolarHBondContact O-N 3.14Å
435	A	52.1	Low	59.5	Low	44 Å²	44	115 Å²	115	36%	0.364	55%	0.552	S	S	.	*	H	α-helix	trans	-68.1	-47.6	174.1	0	0	0	0	0	110.5	M431 L432 R437 R438 I439	M431-A435 WeakPolarHBondContact O-CB 3.34Å; M431-A435 PolarHBondContact O-N 3.19Å; L432-A435 PolarHBondContact O-N 3.48Å; A435-R437 PolarHBondContact O-N 2.89Å; A435-R438 PolarHBondContact O-N 2.96Å; A435-I439 WeakPolarHBondContact O-CG1 3.43Å; A435-I439 PolarHBondContact O-N 2.97Å
436	S	53	Low	57.6	Low	74 Å²	74	109 Å²	109	52%	0.517	54%	0.539	S	S	.	.	H	α-helix	trans	-58.3	-42.8	175.1	168.9	0	0	0	0	112.5	L432 L440	L432-S436 VanDerWaalsContact O-CB 3.28Å; L432-S436 WeakPolarHBondContact O-CB 3.43Å; L432-S436 PolarHBondContact O-N 3.47Å; S436-L440 WeakPolarHBondContact O-CB 3.44Å; S436-L440 PolarHBondContact O-N 2.86Å
437	R	49.4	Very low	56	Low	159 Å²	159	107 Å²	107	60%	0.6	54%	0.536	S	S	*	.	H	α-helix	trans	-68.8	-37.1	175.8	-72	-178.1	-165.7	-162.5	5.8	113.4	E433 A435 L440 D441	E433-R437 WeakPolarHBondContact O-CB 3.38Å; E433-R437 WeakPolarHBondContact O-CG 3.36Å; E433-R437 PolarHBondContact O-N 3.45Å; A435-R437 PolarHBondContact O-N 2.89Å; R437-L440 PolarHBondContact O-N 2.89Å; R437-D441 WeakPolarHBondContact O-CB 3.42Å; R437-D441 VanDerWaalsContact O-CG 3.27Å; R437-D441 PolarHBondContact O-N 3.18Å
438	R	51.4	Low	54	Low	181 Å²	181	108.2 Å²	108.2	68%	0.683	54%	0.539	S	S	*	.	H	α-helix	trans	-63.1	-47.5	173	-78.6	177.3	176.4	-179	-3.8	111.9	K434 A435 L440 D441 D442	K434-R438 WeakPolarHBondContact O-CG 3.46Å; K434-R438 PolarHBondContact O-N 3.14Å; A435-R438 PolarHBondContact O-N 2.96Å; R438-L440 VanDerWaalsContact C-N 3.26Å; R438-L440 PolarHBondContact O-N 2.81Å; R438-D441 PolarHBondContact O-N 2.84Å; R438-D442 WeakPolarHBondContact O-CB 3.48Å; R438-D442 VanDerWaalsContact O-CG 3.29Å; R438-D442 PolarHBondContact O-N 3.16Å
439	I	54.4	Low	52.4	Low	110 Å²	110	104 Å²	104	56%	0.564	53%	0.533	S	S	*	.	H	α-helix	trans	-56.4	-44.5	175.4	-70.7	160.2	0	0	0	110.1	A435 D442 E443	A435-I439 WeakPolarHBondContact O-CG1 3.43Å; A435-I439 PolarHBondContact O-N 2.97Å; I439-D442 PolarHBondContact O-N 3.24Å; I439-E443 WeakPolarHBondContact O-CB 3.33Å; I439-E443 PolarHBondContact O-N 2.85Å
440	L	49.7	Very low	51	Low	104 Å²	104	104.9 Å²	104.9	55%	0.545	54%	0.54	S	S	.	.	H	α-helix	trans	-68.1	-38	178	-165.9	70.4	0	0	0	113.5	S436 R437 R438 L444	S436-L440 WeakPolarHBondContact O-CB 3.44Å; S436-L440 PolarHBondContact O-N 2.86Å; R437-L440 PolarHBondContact O-N 2.89Å; R438-L440 VanDerWaalsContact C-N 3.26Å; R438-L440 PolarHBondContact O-N 2.81Å; L440-L444 WeakPolarHBondContact O-CB 3.19Å; L440-L444 PolarHBondContact O-N 3.45Å
441	D	47.8	Very low	49.3	Very low	97 Å²	97	106.3 Å²	106.3	52%	0.519	55%	0.549	S	S	.	.	H	α-helix	trans	-70.4	-38.5	176.5	-72.8	-32.4	0	0	0	111.4	R437 R438 T445	R437-D441 WeakPolarHBondContact O-CB 3.42Å; R437-D441 VanDerWaalsContact O-CG 3.27Å; R437-D441 PolarHBondContact O-N 3.18Å; R438-D441 PolarHBondContact O-N 2.84Å; D441-T445 WeakPolarHBondContact O-CB 3.19Å; D441-T445 PolarHBondContact O-N 2.96Å; D441-T445 PolarHBondContact O-OG1 2.72Å
442	D	51	Low	47.7	Very low	110 Å²	110	104.9 Å²	104.9	59%	0.588	55%	0.55	S	S	*	*	H	α-helix	trans	-68.9	-41.9	175.3	-70.3	-35.8	0	0	0	111	R438 I439 T445 A446	R438-D442 WeakPolarHBondContact O-CB 3.48Å; R438-D442 VanDerWaalsContact O-CG 3.29Å; R438-D442 PolarHBondContact O-N 3.16Å; I439-D442 PolarHBondContact O-N 3.24Å; D442-T445 PolarHBondContact O-N 2.87Å; D442-A446 WeakPolarHBondContact O-CB 3.28Å; D442-A446 PolarHBondContact O-N 2.79Å
443	E	49.9	Very low	46.3	Very low	124 Å²	124	108 Å²	108	58%	0.579	56%	0.562	S	S	*	*	H	α-helix	trans	-68.7	-36.3	175.8	-173.3	171.4	-136.5	0	0	112.3	I439 S447	I439-E443 WeakPolarHBondContact O-CB 3.33Å; I439-E443 PolarHBondContact O-N 2.85Å; E443-S447 WeakPolarHBondContact O-CB 3.49Å; E443-S447 PolarHBondContact O-N 2.84Å; E443-S447 PolarHBondContact O-OG 3.31Å
444	L	40	Very low	45	Very low	99 Å²	99	108.9 Å²	108.9	52%	0.518	58%	0.575	S	S	.	*	H	α-helix	trans	-67.7	-36.6	171.3	-171.9	66.4	0	0	0	111.7	L440 S447 L448	L440-L444 WeakPolarHBondContact O-CB 3.19Å; L440-L444 PolarHBondContact O-N 3.45Å; L444-S447 WeakPolarHBondContact CA-OG 3.23Å; L444-S447 PolarHBondContact O-OG 2.78Å; L444-L448 HydrophobicContact CG-CD1 4.27Å; L444-L448 WeakPolarHBondContact O-CB 3.12Å; L444-L448 WeakPolarHBondContact O-CG 3.33Å; L444-L448 PolarHBondContact O-N 3.05Å; L444-L448 VanDerWaalsContact O-N 3.08Å
445	T	43.3	Very low	43.9	Very low	96 Å²	96	111.4 Å²	111.4	59%	0.589	59%	0.586	S	S	*	*	H	α-helix	trans	-71	-39.4	176.5	-57.8	0	0	0	0	111.6	D441 D442 S449	D441-T445 WeakPolarHBondContact O-CB 3.19Å; D441-T445 PolarHBondContact O-N 2.96Å; D441-T445 PolarHBondContact O-OG1 2.72Å; D442-T445 PolarHBondContact O-N 2.87Å; T445-S449 PolarHBondContact O-N 2.78Å
446	A	42.9	Very low	42.7	Very low	47 Å²	47	114.1 Å²	114.1	39%	0.388	60%	0.602	S	S	.	*	H	α-helix	trans	-69	-38.7	175.4	0	0	0	0	0	112.9	D442 S449 I450	D442-A446 WeakPolarHBondContact O-CB 3.28Å; D442-A446 PolarHBondContact O-N 2.79Å; A446-S449 PolarHBondContact O-OG 3.4Å; A446-I450 WeakPolarHBondContact O-CB 3.29Å; A446-I450 WeakPolarHBondContact O-CD1 3.49Å; A446-I450 VanDerWaalsContact O-CG1 3.25Å; A446-I450 WeakPolarHBondContact O-CG1 3.32Å; A446-I450 PolarHBondContact O-N 2.74Å; A446-I450 VanDerWaalsContact O-N 3.16Å
447	S	44.2	Very low	41.5	Very low	56 Å²	56	121.2 Å²	121.2	39%	0.392	62%	0.619	S	S	.	*	H	α-helix	trans	-71.4	-32.9	176.4	50.7	0	0	0	0	112.9	E443 L444 Q451	E443-S447 WeakPolarHBondContact O-CB 3.49Å; E443-S447 PolarHBondContact O-N 2.84Å; E443-S447 PolarHBondContact O-OG 3.31Å; L444-S447 WeakPolarHBondContact CA-OG 3.23Å; L444-S447 PolarHBondContact O-OG 2.78Å; S447-Q451 PolarHBondContact O-N 3.05Å
448	L	36.6	Very low	40.3	Very low	114 Å²	114	121.1 Å²	121.1	60%	0.597	63%	0.631	S	S	*	*	H	α-helix	trans	-70.5	-31.6	174	-80.9	168.3	0	0	0	113.9	L444	L444-L448 HydrophobicContact CG-CD1 4.27Å; L444-L448 WeakPolarHBondContact O-CB 3.12Å; L444-L448 WeakPolarHBondContact O-CG 3.33Å; L444-L448 PolarHBondContact O-N 3.05Å; L444-L448 VanDerWaalsContact O-N 3.08Å
449	S	38.4	Very low	39.3	Very low	67 Å²	67	120.1 Å²	120.1	47%	0.469	63%	0.633	S	S	.	*	H	α-helix	trans	-72.3	-46.2	172.5	60.9	0	0	0	0	111.4	T445 A446 Q451 S452	T445-S449 PolarHBondContact O-N 2.78Å; A446-S449 PolarHBondContact O-OG 3.4Å; S449-Q451 VanDerWaalsContact C-N 3.29Å; S449-Q451 PolarHBondContact O-N 2.84Å; S449-S452 WeakPolarHBondContact O-CB 3.49Å; S449-S452 PolarHBondContact O-N 2.89Å; S449-S452 PolarHBondContact O-OG 2.79Å
450	I	41.7	Very low	38	Very low	120 Å²	120	120.4 Å²	120.4	62%	0.615	64%	0.64	S	S	*	*	H	α-helix	trans	-62.3	-32.3	-178.1	-69.2	168.3	0	0	0	112.6	A446 S452	A446-I450 WeakPolarHBondContact O-CB 3.29Å; A446-I450 WeakPolarHBondContact O-CD1 3.49Å; A446-I450 VanDerWaalsContact O-CG1 3.25Å; A446-I450 WeakPolarHBondContact O-CG1 3.32Å; A446-I450 PolarHBondContact O-N 2.74Å; A446-I450 VanDerWaalsContact O-N 3.16Å; I450-S452 PolarHBondContact O-N 3.37Å
451	Q	36	Very low	37	Very low	163 Å²	163	120.4 Å²	120.4	76%	0.762	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-7.3	175.5	-76.5	-165.7	-9.4	0	0	115	S447 S449	S447-Q451 PolarHBondContact O-N 3.05Å; S449-Q451 VanDerWaalsContact C-N 3.29Å; S449-Q451 PolarHBondContact O-N 2.84Å
452	S	35	Very low	36	Very low	89 Å²	89	123.3 Å²	123.3	62%	0.622	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-19.3	-176.4	70.3	0	0	0	0	115.4	S449 I450	S449-S452 WeakPolarHBondContact O-CB 3.49Å; S449-S452 PolarHBondContact O-N 2.89Å; S449-S452 PolarHBondContact O-OG 2.79Å; I450-S452 PolarHBondContact O-N 3.37Å
453	E	35.8	Very low	34.9	Very low	172 Å²	172	129.5 Å²	129.5	80%	0.804	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	-15.6	-173.3	-63	-157.7	136.5	0	0	115.2	F455	E453-F455 VanDerWaalsContact C-N 3.3Å; E453-F455 PolarHBondContact O-N 3.37Å
454	T	35.7	Very low	34.5	Very low	122 Å²	122	129.9 Å²	129.9	75%	0.748	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	9.3	-177.6	-25.3	0	0	0	0	114.6
455	F	33.1	Very low	33.9	Very low	192 Å²	192	128.6 Å²	128.6	84%	0.842	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126	36.6	-178.4	-117.7	-72.9	0	0	0	115.4	E453	E453-F455 VanDerWaalsContact C-N 3.3Å; E453-F455 PolarHBondContact O-N 3.37Å
456	S	27.1	Very low	33.1	Very low	101 Å²	101	130.8 Å²	130.8	71%	0.706	72%	0.717	S	S	*	*			trans	-161	105	155.5	-84.8	0	0	0	0	112.9
457	Y	27.9	Very low	32.3	Very low	222 Å²	222	133.6 Å²	133.6	87%	0.871	74%	0.74	S	S	*	*				-175.2	105.7	117.5	-109.8	-70.8	0	0	0	111.7
458	N	25.3	Very low	31.6	Very low	157 Å²	157	134 Å²	134	84%	0.84	75%	0.754	S	S	*	*			trans	-154.5	67.7	160.7	-140.2	-8.8	0	0	0	111.6
459	H	29.6	Very low	31.1	Very low	160 Å²	160	137.7 Å²	137.7	74%	0.741	77%	0.768	S	S	*	*			trans	-174.1	114.2	142	-105.1	-66	0	0	0	114.2
460	T	26.9	Very low	30.6	Very low	116 Å²	116	142.3 Å²	142.3	71%	0.712	78%	0.782	S	S	*	*			trans	11.5	120.4	140.7	53.3	0	0	0	0	120.3
461	S	28.2	Very low	29.9	Very low	104 Å²	104	144.3 Å²	144.3	73%	0.727	79%	0.788	S	S	*	*				161.2	157.4	95.6	57.8	0	0	0	0	116.1
462	N	28.5	Very low	29.5	Very low	158 Å²	158	140.9 Å²	140.9	85%	0.845	78%	0.783	S	S	*	*			trans	73.4	123.6	157.2	-63.1	-18.5	0	0	0	123
463	R	27	Very low	29	Very low	241 Å²	241	144 Å²	144	91%	0.909	79%	0.793	S	S	*	*			trans	-74.2	179.4	156.9	-81.8	179.1	167.6	-175	-3.7	111.2
464	P	40.8	Very low	28.5	Very low	131 Å²	131	140.8 Å²	140.8	85%	0.851	79%	0.789	S	S	*	*			cis	-132.3	177.8	4.4	40.8	-24.1	0	0	0	116.3
465	G	27.7	Very low	28.1	Very low	72 Å²	72	140 Å²	140	74%	0.742	78%	0.784	S	S	*	*			trans	172.5	73.9	168.6	0	0	0	0	0	119.7
466	T	27.2	Very low	27.7	Very low	143 Å²	143	139 Å²	139	88%	0.877	78%	0.776	S	S	*	*			trans	17.3	132.9	150.3	39.4	0	0	0	0	125.3
467	A	26.6	Very low	27.6	Very low	105 Å²	105	140.8 Å²	140.8	87%	0.868	77%	0.773	S	S	*	*			trans	92.3	148.7	130.1	0	0	0	0	0	122.5
468	G	28.4	Very low	27.6	Very low	66 Å²	66	137.9 Å²	137.9	68%	0.68	76%	0.76	S	S	*	*			trans	93.6	111.1	-171.6	0	0	0	0	0	111.5
469	E	27.4	Very low	27.4	Very low	191 Å²	191	137.4 Å²	137.4	89%	0.893	76%	0.757	S	S	*	*			cis	60.8	120.6	49.1	-52.9	-175.6	171.1	0	0	111.1
470	Q	27.3	Very low	27.2	Very low	163 Å²	163	139.1 Å²	139.1	76%	0.762	76%	0.762	S	S	*	*			cis	-140.9	157.1	27.4	-93	179.8	-80.6	0	0	115.2
471	E	26.1	Very low	28.1	Very low	162 Å²	162	138.3 Å²	138.3	76%	0.757	76%	0.759	S	S	*	*			trans	23.4	141.3	131.1	-64.8	172	132.4	0	0	120.9
472	S	28.4	Very low	27.9	Very low	91 Å²	91	141.7 Å²	141.7	64%	0.636	77%	0.768	S	S	*	*			cis	-168.7	157.8	6.1	48.9	0	0	0	0	114
473	N	25	Very low	27.7	Very low	156 Å²	156	137.5 Å²	137.5	83%	0.834	76%	0.762	S	S	*	*			trans	60.9	148.6	144.9	-63.1	-13.2	0	0	0	119.4
474	S	25.1	Very low	28.1	Very low	103 Å²	103	131.7 Å²	131.7	72%	0.72	76%	0.756	S	S	*	*			cis	-176.5	153.9	-0	151.6	0	0	0	0	108.6
475	T	26.2	Very low	27.5	Very low	106 Å²	106	132.7 Å²	132.7	65%	0.65	75%	0.754	S	S	*	*			cis	-173.6	153	-12	-74.6	0	0	0	0	108.4
476	Y	25.4	Very low	27.3	Very low	171 Å²	171	139.4 Å²	139.4	67%	0.671	76%	0.758	S	S	*	*			trans	73.3	140.3	169	-96.3	-135.3	0	0	0	117.3
477	E	25.8	Very low	27.1	Very low	138 Å²	138	140.9 Å²	140.9	65%	0.645	76%	0.755	S	S	*	*			cis	70.6	151	30.9	-54	-157.7	140.2	0	0	114.7
478	R	25.9	Very low	27.1	Very low	161 Å²	161	143.4 Å²	143.4	61%	0.608	75%	0.749	S	S	*	*			cis	-166.2	131.1	26.1	-162.7	172.2	-83.5	178.5	-6.7	114.9
479	I	23	Very low	27.5	Very low	148 Å²	148	145.8 Å²	145.8	76%	0.759	75%	0.752	S	S	*	*			trans	53.1	141.1	140.5	-52.5	170.7	0	0	0	123.6
480	F	25.3	Very low	27.5	Very low	196 Å²	196	142 Å²	142	86%	0.86	75%	0.747	S	S	*	*			trans	-49.7	-164.5	160.3	-73.8	-89.2	0	0	0	118.3
481	P	44.5	Very low	27.6	Very low	99 Å²	99	144.4 Å²	144.4	64%	0.643	75%	0.749	S	S	*	*			cis	-133.4	-167.4	-29.9	25.8	-1.5	0	0	0	114.8
482	L	23.7	Very low	27.5	Very low	174 Å²	174	144.6 Å²	144.6	91%	0.911	76%	0.755	S	S	*	*			trans	77.1	150.2	165.5	-51.1	167.1	0	0	0	115.7
483	G	25.1	Very low	27.5	Very low	70 Å²	70	146.3 Å²	146.3	72%	0.722	76%	0.755	S	S	*	*			cis	-156.6	-162.1	6	0	0	0	0	0	113.3
484	P	36.3	Very low	27.5	Very low	120 Å²	120	144.6 Å²	144.6	78%	0.779	75%	0.754	S	S	*	*			trans	-111.9	167.6	-153.5	41.5	-37	0	0	0	118.3
485	D	26.4	Very low	27.4	Very low	152 Å²	152	149.3 Å²	149.3	81%	0.813	76%	0.762	S	S	*	*			trans	-170.3	121.3	142.5	-91.4	-31.2	0	0	0	108.8
486	Y	24.9	Very low	27.3	Very low	212 Å²	212	152 Å²	152	83%	0.831	77%	0.771	S	S	*	*				58.7	137.9	95.6	-91.6	-95.1	0	0	0	116
487	Q	23.5	Very low	27.4	Very low	175 Å²	175	149.8 Å²	149.8	82%	0.818	78%	0.777	S	S	*	*			cis	-158.3	152.8	27.5	-176.4	161.5	41.6	0	0	114.4
488	E	25.6	Very low	27.3	Very low	158 Å²	158	151 Å²	151	74%	0.738	78%	0.783	S	S	*	*			trans	-111.3	156.7	170.4	-149.5	-156.2	-131.5	0	0	109.7
489	P	37.6	Very low	27.3	Very low	115 Å²	115	150.6 Å²	150.6	75%	0.747	79%	0.786	S	S	*	*				-151.2	-170	85.6	43.1	-22.6	0	0	0	113.1
490	S	26.9	Very low	27.7	Very low	113 Å²	113	149.5 Å²	149.5	79%	0.79	79%	0.789	S	S	*	*			cis	-158.1	176.1	21.3	63.4	0	0	0	0	114.1
491	R	29.2	Very low	27.6	Very low	213 Å²	213	147.8 Å²	147.8	80%	0.804	78%	0.783	S	S	*	*			trans	-119.3	162.5	-161.7	-55	168.5	171.1	169.7	-6	116.4	I493	R491-I493 HydrophobicContact CB-CG1 4.47Å
492	L	24.7	Very low	26.6	Very low	166 Å²	166	150.8 Å²	150.8	87%	0.869	79%	0.794	S	S	*	*			trans	-146.6	120.5	138.1	-80.7	171.9	0	0	0	106.7
493	I	26.6	Very low	26.6	Very low	127 Å²	127	146.7 Å²	146.7	65%	0.651	78%	0.78	S	S	*	*			cis	95	105.6	41.2	-65.7	175.9	0	0	0	114.2	R491	R491-I493 HydrophobicContact CB-CG1 4.47Å
494	C	25.3	Very low	26.6	Very low	119 Å²	119	152.5 Å²	152.5	80%	0.804	79%	0.788	S	S	*	*			trans	163.5	100.8	141	-93.2	0	0	0	0	109.6
495	K	23.5	Very low	26.1	Very low	203 Å²	203	155.6 Å²	155.6	88%	0.883	79%	0.792	S	S	*	*				73	121.1	78.8	-91.1	-157.4	168.7	-164	0	116.8
496	L	24.6	Very low	26.6	Very low	162 Å²	162	153.6 Å²	153.6	85%	0.848	79%	0.787	S	S	*	*			trans	-87.7	163.9	165	-71.2	84.6	0	0	0	111.9
497	P	28.2	Very low	26.6	Very low	124 Å²	124	147.8 Å²	147.8	81%	0.805	78%	0.783	S	S	*	*			trans	-90.4	171.4	154.6	37.4	-31.8	0	0	0	112.7
498	E	22.9	Very low	26.5	Very low	163 Å²	163	144.6 Å²	144.6	76%	0.762	78%	0.78	S	S	*	*			trans	-138	147.7	-167.7	-100.7	-175.8	164.1	0	0	113.5
499	F	25.3	Very low	26.4	Very low	154 Å²	154	141.7 Å²	141.7	68%	0.675	78%	0.783	S	S	*	*			trans	65.5	163.9	149.8	-77.9	-53.9	0	0	0	119	Q501	F499-Q501 HydrophobicContact CD1-CG 4.29Å; F499-Q501 HydrophobicContact CE1-CG 4.21Å
500	P	30.8	Very low	25.8	Very low	125 Å²	125	141 Å²	141	81%	0.812	79%	0.788	S	S	*	*			cis	-125.6	173.5	23.7	42.8	-27.6	0	0	0	118.5
501	Q	24	Very low	25.7	Very low	160 Å²	160	140.3 Å²	140.3	75%	0.748	79%	0.789	S	S	*	*			trans	-92.3	159.9	171.8	-57.8	173.3	-66.3	0	0	112	F499	F499-Q501 HydrophobicContact CD1-CG 4.29Å; F499-Q501 HydrophobicContact CE1-CG 4.21Å
502	N	22.8	Very low	25.5	Very low	161 Å²	161	134.7 Å²	134.7	86%	0.861	79%	0.788	S	S	*	*			trans	-175.7	153	148.3	-91.1	-18.6	0	0	0	107.6
503	S	23.9	Very low	25.4	Very low	88 Å²	88	131.8 Å²	131.8	62%	0.615	79%	0.788	S	S	*	*			cis	179.4	147.1	-31.2	49.1	0	0	0	0	108.1
504	E	25.6	Very low	25.4	Very low	193 Å²	193	130.7 Å²	130.7	90%	0.902	79%	0.791	S	S	*	*			trans	79.8	133	163.3	-56.6	-175.5	150.6	0	0	121.3
505	E	25.6	Very low	25.4	Very low	185 Å²	185	134.9 Å²	134.9	86%	0.864	80%	0.796	S	S	*	*			trans	-86.4	-174.2	161.2	-99.2	-169.3	171.2	0	0	109.8
506	P	37.4	Very low	25.4	Very low	109 Å²	109	131 Å²	131	71%	0.708	79%	0.794	S	S	*	*			cis	-148.9	-174.7	21.6	44.2	-23	0	0	0	119
507	A	23.9	Very low	25.3	Very low	90 Å²	90	129 Å²	129	74%	0.744	79%	0.789	S	S	*	*			trans	71.1	152.6	147.1	0	0	0	0	0	120.6
508	S	23.1	Very low	25.1	Very low	108 Å²	108	129.4 Å²	129.4	76%	0.755	79%	0.789	S	S	*	*			cis	-171.5	151.2	-20.3	55.8	0	0	0	0	113.9
509	A	23.4	Very low	25.1	Very low	97 Å²	97	130.1 Å²	130.1	80%	0.802	79%	0.792	S	S	*	*			trans	77.1	137.2	146.6	0	0	0	0	0	123.8
510	A	24.1	Very low	25.1	Very low	102 Å²	102	128.6 Å²	128.6	84%	0.843	80%	0.796	S	S	*	*			trans	64.9	150.9	158	0	0	0	0	0	118.8
511	A	24.5	Very low	24.7	Very low	98 Å²	98	128.8 Å²	128.8	81%	0.81	79%	0.794	S	S	*	*			cis	-178	161.3	-14.7	0	0	0	0	0	107.1
512	A	24.9	Very low	24.7	Very low	94 Å²	94	126.5 Å²	126.5	78%	0.777	79%	0.791	S	S	*	*			cis	-164.9	156.6	-16.1	0	0	0	0	0	110.1
513	A	23.9	Very low	24.9	Very low	106 Å²	106	127.5 Å²	127.5	88%	0.876	79%	0.791	S	S	*	*			trans	64.3	152.8	167.4	0	0	0	0	0	117.9
514	S	26.1	Very low	24.9	Very low	103 Å²	103	131 Å²	131	72%	0.72	80%	0.803	S	S	*	*			cis	-147.7	136	12.7	60.9	0	0	0	0	115.6
515	K	24.1	Very low	24.9	Very low	208 Å²	208	124.5 Å²	124.5	90%	0.904	79%	0.788	S	S	*	*			trans	45.1	107.6	146.3	-61.8	-177.4	177.5	-177.9	0	120.4
516	S	24	Very low	24.8	Very low	121 Å²	121	120.6 Å²	120.6	85%	0.846	79%	0.787	S	S	*	*				-156	134.3	108.8	-166.9	0	0	0	0	111.6
517	T	22.7	Very low	24.6	Very low	121 Å²	121	120.6 Å²	120.6	74%	0.742	79%	0.787	S	S	*	*			trans	-72.7	156.4	166.1	-29.6	0	0	0	0	107.6
518	T	25	Very low	24.9	Very low	131 Å²	131	124.9 Å²	124.9	80%	0.804	79%	0.791	S	S	*	*			cis	-157.9	158.2	44.8	-53.1	0	0	0	0	112.3
519	Q	22.7	Very low	24.9	Very low	178 Å²	178	129.1 Å²	129.1	83%	0.832	79%	0.792	S	S	*	*			trans	-94.6	144.3	176.8	-78.8	177	-61.9	0	0	113.9
520	T	24.6	Very low	24.9	Very low	122 Å²	122	126.3 Å²	126.3	75%	0.748	77%	0.769	S	S	*	*			trans	-5.5	142.1	151.7	54.3	0	0	0	0	120.4
521	V	23.4	Very low	25	Very low	129 Å²	129	131 Å²	131	78%	0.782	77%	0.773	S	S	*	*				175.9	124.9	112.1	148.4	0	0	0	0	113.2
522	V	23.8	Very low	24.9	Very low	112 Å²	112	127.3 Å²	127.3	68%	0.679	74%	0.743	S	S	*	*			trans	57.3	124.2	147.7	173.9	0	0	0	0	123.1
523	Q	26.6	Very low	25	Very low	182 Å²	182	127.8 Å²	127.8	85%	0.85	73%	0.733	S	S	*	*			trans	47.8	153.7	148.1	-64.3	170.7	-46.6	0	0	119.7
524	D	23.4	Very low	25.3	Very low	162 Å²	162	123.5 Å²	123.5	87%	0.866	70%	0.695	S	S	*	*			cis	-160	175.7	25.3	-165.2	7.7	0	0	0	111.5
525	G	25.4	Very low	25.4	Very low	57 Å²	57	121.3 Å²	121.3	59%	0.588	68%	0.677	S	S	*	*			trans	111.2	90.1	144.4	0	0	0	0	0	122
526	A	24.1	Very low	25.5	Very low	103 Å²	103	115.3 Å²	115.3	85%	0.851	66%	0.655	S	S	*	*			trans	66.3	164.5	144.2	0	0	0	0	0	120.9
527	P	33.2	Very low	26	Very low	108 Å²	108	110.3 Å²	110.3	70%	0.701	62%	0.618	S	S	*	*			cis	-118.1	155.5	-6.8	39.1	-26.5	0	0	0	115
528	H	29.8	Very low	26.2	Very low	181 Å²	181	110 Å²	110	84%	0.838	61%	0.608	S	S	*	*			trans	-72.4	139.2	167.6	-77.6	-110.8	0	0	0	111.8
529	Y	23	Very low	26.5	Very low	196 Å²	196	105.2 Å²	105.2	77%	0.769	59%	0.585	S	S	*	*			trans	-146.8	137.9	156.4	-92.9	-75.1	0	0	0	111.3
530	A	24.5	Very low	26.9	Very low	38 Å²	38	98.1 Å²	98.1	31%	0.314	55%	0.554	S	S	.	*			trans	62	65.3	166	0	0	0	0	0	118	A532 E809	A530-A532 PolarHBondContact O-N 2.95Å; A530-A532 VanDerWaalsContact O-N 3.13Å; A530-E809 HydrophobicContact CB-CG 4.17Å; A530-E809 WeakPolarHBondContact O-CG 3.37Å
531	E	24.8	Very low	26.9	Very low	200 Å²	200	98.1 Å²	98.1	94%	0.935	55%	0.554	S	S	*	*			trans	-54.9	119.7	142.4	-75.5	-174.3	124.9	0	0	108.5
532	A	23.4	Very low	27.2	Very low	22 Å²	22	94.9 Å²	94.9	18%	0.182	55%	0.547	C	S	.	.			trans	-112.9	118.8	172.3	0	0	0	0	0	107.8	A530 I534 L770 I808	A530-A532 PolarHBondContact O-N 2.95Å; A530-A532 VanDerWaalsContact O-N 3.13Å; A532-I534 PolarHBondContact O-N 2.86Å; A532-L770 HydrophobicContact CB-CD2 4.37Å; A532-I808 HydrophobicContact CB-CG2 4.31Å
533	D	27.1	Very low	27.7	Very low	104 Å²	104	90 Å²	90	56%	0.556	52%	0.519	S	S	*	.			trans	-55.5	104.5	-179	-85.8	-51.4	0	0	0	111.9	V535	D533-V535 PolarHBondContact O-N 3.32Å
534	I	30.6	Very low	28.2	Very low	15 Å²	15	82.3 Å²	82.3	8%	0.077	48%	0.484	C	S	.	.			trans	-71.8	98.5	170.6	-52.3	161.2	0	0	0	106.9	A532 N536 L537 Y751 I753 R756 L759 I769 I808	A532-I534 PolarHBondContact O-N 2.86Å; I534-N536 PolarHBondContact O-N 2.9Å; I534-L537 HydrophobicContact CG2-CD1 4.34Å; I534-Y751 HydrophobicContact CD1-CD1 4.17Å; I534-Y751 HydrophobicContact CD1-CE1 3.55Å; I534-I753 HydrophobicContact CB-CD1 4.31Å; I534-I753 HydrophobicContact CD1-CD1 3.88Å; I534-I753 HydrophobicContact CG2-CD1 4.32Å; I534-R756 PolarHBondContact O-NH1 2.89Å; I534-R756 VanDerWaalsContact O-NH1 3.1Å; I534-L759 HydrophobicContact CG2-CD1 4.33Å; I534-I769 HydrophobicContact CG2-CG2 4.27Å; I534-I808 HydrophobicContact CD1-CD1 3.38Å; I534-I808 HydrophobicContact CD1-CG1 3.86Å; I534-I808 HydrophobicContact CD1-CG2 4.05Å; I534-I808 HydrophobicContact CG1-CD1 4.25Å; I534-I808 HydrophobicContact CG1-CG1 4.22Å; I534-I808 HydrophobicContact CG1-CG2 3.66Å
535	V	27.8	Very low	28.9	Very low	58 Å²	58	75.5 Å²	75.5	35%	0.352	45%	0.448	S	S	.	.			trans	-52.7	136.6	-176.3	163.9	0	0	0	0	111	D533 L537 L770	D533-V535 PolarHBondContact O-N 3.32Å; V535-L537 VanDerWaalsContact O-CD1 3.28Å; V535-L537 WeakPolarHBondContact O-CD1 3.48Å; V535-L537 PolarHBondContact O-N 2.67Å; V535-L770 WeakPolarHBondContact CG2-O 3.5Å
536	N	26.5	Very low	29.9	Very low	82 Å²	82	73.8 Å²	73.8	44%	0.439	42%	0.424	S	S	.	.			trans	-54.4	110.5	-179.2	-82.3	-40.5	0	0	0	112.1	I534 Q538 R756	I534-N536 PolarHBondContact O-N 2.9Å; N536-Q538 PolarHBondContact O-N 2.81Å; N536-R756 WeakPolarHBondContact OD1-CD 3.25Å
537	L	33	Very low	30.8	Very low	16 Å²	16	69 Å²	69	8%	0.084	39%	0.385	C	S	.	.			trans	-72.6	84.7	-177.9	-89.7	96.4	0	0	0	112.7	I534 V535 G539 V540 A757 L759 M764 F774	I534-L537 HydrophobicContact CG2-CD1 4.34Å; V535-L537 VanDerWaalsContact O-CD1 3.28Å; V535-L537 WeakPolarHBondContact O-CD1 3.48Å; V535-L537 PolarHBondContact O-N 2.67Å; L537-G539 PolarHBondContact O-N 2.89Å; L537-V540 PolarHBondContact O-N 2.91Å; L537-A757 HydrophobicContact CB-CB 4.32Å; L537-L759 HydrophobicContact CB-CD2 4.41Å; L537-L759 HydrophobicContact CD1-CD1 3.78Å; L537-L759 HydrophobicContact CD1-CD2 4.18Å; L537-L759 HydrophobicContact CD2-CD2 3.7Å; L537-L759 HydrophobicContact CG-CD2 4.31Å; L537-M764 HydrophobicContact CD2-CE 3.65Å; L537-F774 HydrophobicContact CD2-CE2 3.38Å; L537-F774 HydrophobicContact CD2-CZ 3.32Å; L537-F774 HydrophobicContact CG-CE2 4.41Å
538	Q	28.1	Very low	31.1	Very low	113 Å²	113	67.3 Å²	67.3	53%	0.528	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	117.8	165.1	-81.6	-168.9	-99.1	0	0	110.5	G29 N536	G29-Q538 PolarHBondContact O-NE2 3.33Å; G29-Q538 VanDerWaalsContact O-NE2 3.13Å; N536-Q538 PolarHBondContact O-N 2.81Å
539	G	31.6	Very low	31.4	Very low	31 Å²	31	60.5 Å²	60.5	32%	0.32	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	140.3	-23.5	-174.2	0	0	0	0	0	112.5	L537	L537-G539 PolarHBondContact O-N 2.89Å
540	V	29.5	Very low	31.9	Very low	30 Å²	30	53 Å²	53	18%	0.182	32%	0.319	C	S	.	.			trans	-118.9	69.9	179.3	-163.3	0	0	0	0	111.2	L537 Y546 A757	L537-V540 PolarHBondContact O-N 2.91Å; V540-Y546 HydrophobicContact CG1-CD2 4.37Å; V540-Y546 HydrophobicContact CG1-CE1 4.41Å; V540-Y546 HydrophobicContact CG1-CE2 3.51Å; V540-Y546 WeakPolarHBondContact CG1-OH 3.41Å; V540-Y546 HydrophobicContact CG2-CE1 4.49Å; V540-Y546 HydrophobicContact CG2-CE2 4.49Å; V540-A757 HydrophobicContact CB-CB 3.71Å; V540-A757 HydrophobicContact CG1-CB 4.12Å; V540-A757 HydrophobicContact CG2-CB 4.19Å
541	T	25.3	Very low	32.4	Very low	121 Å²	121	57.7 Å²	57.7	74%	0.742	34%	0.344	S	S	*	.	S	Bend	trans	-56	145.6	142.8	45.7	0	0	0	0	108.2	G543	T541-G543 PolarHBondContact O-N 2.99Å
542	G	30.4	Very low	32.8	Very low	62 Å²	62	50 Å²	50	64%	0.639	31%	0.31	S	S	*	.	S	Bend	trans	-68.6	51.3	-173.2	0	0	0	0	0	116.7	F582	G542-F582 WeakPolarHBondContact O-CE2 3.47Å; G542-F582 WeakPolarHBondContact O-CZ 3.32Å
543	G	33.5	Very low	33.5	Very low	8 Å²	8	56.1 Å²	56.1	8%	0.082	34%	0.337	C	S	.	.	S	Bend	trans	-104.7	170.1	165.3	0	0	0	0	0	110.7	T541	T541-G543 PolarHBondContact O-N 2.99Å
544	N	37.1	Very low	34	Very low	22 Å²	22	57.2 Å²	57.2	12%	0.118	34%	0.343	C	S	.	.	S	Bend	trans	-80.8	-29.5	-167	-75.7	-7.8	0	0	0	115	Y546 F582 R743	N544-Y546 WeakPolarHBondContact O-CD2 3.34Å; N544-Y546 PolarHBondContact O-N 3.33Å; N544-F582 WeakPolarHBondContact OD1-CD2 3.43Å; N544-R743 PolarHBondContact O-NH1 3.01Å; N544-R743 PolarHBondContact O-NH2 2.93Å
545	T	38.4	Very low	34.5	Very low	19 Å²	19	58.6 Å²	58.6	12%	0.117	35%	0.35	C	S	.	.			trans	-76.6	107.2	-170.6	-39.7	0	0	0	0	111.4	I636	T545-I636 HydrophobicContact CG2-CD1 4.22Å
546	Y	46.9	Very low	35.2	Very low	20 Å²	20	61.7 Å²	61.7	8%	0.078	36%	0.364	C	S	.	.			trans	-93.5	-25.9	178.6	-82.6	-150.5	0	0	0	111	V540 N544 I548 R719 D720 D738 R743 V758	V540-Y546 HydrophobicContact CG1-CD2 4.37Å; V540-Y546 HydrophobicContact CG1-CE1 4.41Å; V540-Y546 HydrophobicContact CG1-CE2 3.51Å; V540-Y546 WeakPolarHBondContact CG1-OH 3.41Å; V540-Y546 HydrophobicContact CG2-CE1 4.49Å; V540-Y546 HydrophobicContact CG2-CE2 4.49Å; N544-Y546 WeakPolarHBondContact O-CD2 3.34Å; N544-Y546 PolarHBondContact O-N 3.33Å; Y546-I548 PolarHBondContact O-N 2.78Å; Y546-R719 WeakPolarHBondContact O-CD 3.32Å; Y546-R719 PolarHBondContact O-NE 2.87Å; Y546-D720 HydrophobicContact CD1-CB 4.38Å; Y546-D738 PolarHBondContact N-OD2 3.05Å; Y546-R743 VanDerWaalsContact CE2-NH1 3.28Å; Y546-R743 VanDerWaalsContact CG-NH2 3.28Å; Y546-R743 VanDerWaalsContact CZ-CZ 3.4Å; Y546-V758 WeakPolarHBondContact CE1-O 3.5Å; Y546-V758 PolarHBondContact OH-O 2.73Å; Y546-V758 VanDerWaalsContact OH-O 3.12Å
547	A	41.8	Very low	36	Very low	3 Å²	3	62.4 Å²	62.4	3%	0.025	38%	0.376	C	S	.	.			trans	-78.4	82.8	174	0	0	0	0	0	112.4	F716 D738	A547-F716 HydrophobicContact CB-CE1 3.54Å; A547-F716 HydrophobicContact CB-CE2 4.4Å; A547-F716 HydrophobicContact CB-CZ 3.39Å; A547-D738 HydrophobicContact CB-CB 4.44Å; A547-D738 PolarHBondContact N-OD2 2.79Å
548	I	41	Very low	36.4	Very low	73 Å²	73	63.3 Å²	63.3	37%	0.374	39%	0.388	S	S	.	.			trans	-95.8	128.4	170.5	-63.8	176.2	0	0	0	109.6	Y546 A550 R719	Y546-I548 PolarHBondContact O-N 2.78Å; I548-A550 PolarHBondContact O-N 3.49Å; I548-R719 PolarHBondContact O-NH2 3.12Å
549	P	34.3	Very low	37.1	Very low	38 Å²	38	67.1 Å²	67.1	25%	0.247	40%	0.403	C	S	.	.			trans	-52.2	135.1	178.5	-27.9	34.6	0	0	0	113.6	V551 L555 F716	P549-V551 VanDerWaalsContact C-N 3.32Å; P549-V551 PolarHBondContact O-N 2.87Å; P549-L555 HydrophobicContact CB-CD1 4.21Å; P549-L555 HydrophobicContact CG-CD1 4.36Å; P549-F716 HydrophobicContact CG-CD2 4.23Å; P549-F716 HydrophobicContact CG-CE2 4.3Å
550	A	34.6	Very low	37.6	Very low	37 Å²	37	72.3 Å²	72.3	31%	0.306	42%	0.423	S	S	.	.	S	Bend	trans	-82.2	79.4	179	0	0	0	0	0	110.5	I548 N715 V717	I548-A550 PolarHBondContact O-N 3.49Å; A550-N715 PolarHBondContact N-O 3.28Å; A550-V717 HydrophobicContact CB-CB 4.47Å; A550-V717 HydrophobicContact CB-CG2 3.59Å
551	V	34.2	Very low	38.6	Very low	138 Å²	138	73.9 Å²	73.9	84%	0.836	43%	0.433	S	S	*	.	S	Bend	trans	60.4	84.3	177.3	-169.7	0	0	0	0	113.1	P549	P549-V551 VanDerWaalsContact C-N 3.32Å; P549-V551 PolarHBondContact O-N 2.87Å
552	T	33.3	Very low	40.2	Very low	38 Å²	38	74.1 Å²	74.1	23%	0.233	43%	0.434	C	S	.	.			trans	-154.4	93.8	162.3	4	0	0	0	0	110	D554 L555	T552-D554 HydrophobicContact CG2-CB 4.28Å; T552-D554 PolarHBondContact O-N 2.88Å; T552-L555 PolarHBondContact O-N 3.06Å
553	M	37.8	Very low	41.9	Very low	151 Å²	151	73 Å²	73	74%	0.744	42%	0.415	S	S	*	.	H	α-helix	trans	-62.7	-25.6	167.1	-75.5	-61.9	-161.3	0	0	111.2	L555 L556 S557	M553-L555 PolarHBondContact O-N 3Å; M553-L556 CarbonylContact O-C 3.43Å; M553-L556 WeakPolarHBondContact O-CA 3.29Å; M553-L556 PolarHBondContact O-N 3Å; M553-L556 HydrophobicContact SD-CD1 4.42Å; M553-S557 WeakPolarHBondContact O-CB 3.5Å; M553-S557 PolarHBondContact O-N 3.49Å
554	D	38.1	Very low	44	Very low	126 Å²	126	77.7 Å²	77.7	67%	0.674	44%	0.435	S	S	*	.	H	α-helix	trans	-54.9	-33.6	175.8	-58.4	-26.2	0	0	0	113.4	T552 S557 G558	T552-D554 HydrophobicContact CG2-CB 4.28Å; T552-D554 PolarHBondContact O-N 2.88Å; D554-S557 PolarHBondContact O-N 3.44Å; D554-G558 PolarHBondContact O-N 3.37Å
555	L	40.8	Very low	46.4	Very low	44 Å²	44	79.1 Å²	79.1	23%	0.23	44%	0.44	C	S	.	.	H	α-helix	trans	-63.7	-44.4	172.7	-78.8	169.2	0	0	0	111	P549 T552 M553 R639	P549-L555 HydrophobicContact CB-CD1 4.21Å; P549-L555 HydrophobicContact CG-CD1 4.36Å; T552-L555 PolarHBondContact O-N 3.06Å; M553-L555 PolarHBondContact O-N 3Å; L555-R639 PolarHBondContact O-NH1 3.44Å; L555-R639 PolarHBondContact O-NH2 2.87Å; L555-R639 VanDerWaalsContact O-NH2 3.08Å
556	L	43.3	Very low	48.9	Very low	124 Å²	124	78.2 Å²	78.2	65%	0.649	44%	0.435	S	S	*	.	H	α-helix	trans	-77.5	-21.2	179.2	-63.6	175.9	0	0	0	113.2	M553	M553-L556 CarbonylContact O-C 3.43Å; M553-L556 WeakPolarHBondContact O-CA 3.29Å; M553-L556 PolarHBondContact O-N 3Å; M553-L556 HydrophobicContact SD-CD1 4.42Å
557	S	44.2	Very low	51	Low	97 Å²	97	79.7 Å²	79.7	68%	0.678	45%	0.447	S	S	*	.	H	α-helix	trans	-81.8	-31.6	178.3	-176.2	0	0	0	0	113.4	M553 D554 K559	M553-S557 WeakPolarHBondContact O-CB 3.5Å; M553-S557 PolarHBondContact O-N 3.49Å; D554-S557 PolarHBondContact O-N 3.44Å; S557-K559 PolarHBondContact O-N 3.44Å
558	G	40.9	Very low	53.2	Low	34 Å²	34	82.8 Å²	82.8	35%	0.351	46%	0.458	S	S	.	.	S	Bend	trans	-64.6	125.7	179.1	0	0	0	0	0	113	D554 R639	D554-G558 PolarHBondContact O-N 3.37Å; G558-R639 PolarHBondContact O-NH2 2.79Å
559	K	42.3	Very low	55.6	Low	194 Å²	194	87.9 Å²	87.9	84%	0.843	48%	0.478	S	S	*	.			trans	-8.5	131	175.2	-72.7	-176.6	177.4	-179.9	0	115.1	S557 V561	S557-K559 PolarHBondContact O-N 3.44Å; K559-V561 PolarHBondContact O-N 2.87Å
560	D	43.2	Very low	58.3	Low	139 Å²	139	88.2 Å²	88.2	74%	0.743	48%	0.477	S	S	*	.			trans	-46.1	109.2	173.2	-75.8	-58.4	0	0	0	111.8	V562	D560-V562 PolarHBondContact O-N 3.06Å
561	V	50.2	Low	61.1	Low	64 Å²	64	87.9 Å²	87.9	39%	0.388	47%	0.47	S	S	.	.			trans	-71.3	100.6	167.8	178.1	0	0	0	0	105.6	K559 V563 R639	K559-V561 PolarHBondContact O-N 2.87Å; V561-V563 PolarHBondContact O-N 3.03Å; V561-R639 HydrophobicContact CG2-CG 4.3Å
562	V	57.2	Low	63.9	Low	125 Å²	125	84.4 Å²	84.4	76%	0.758	45%	0.449	S	S	*	.			trans	-63.1	100.8	174.2	-178.2	0	0	0	0	107.4	D560	D560-V562 PolarHBondContact O-N 3.06Å
563	V	67.3	Low	66.8	Low	39 Å²	39	87.9 Å²	87.9	24%	0.236	46%	0.461	C	S	.	.			trans	-83	129.7	169	-164.7	0	0	0	0	106.8	V561 I634 S638 L648 V651	V561-V563 PolarHBondContact O-N 3.03Å; V563-I634 HydrophobicContact CG2-CG2 4.47Å; V563-S638 VanDerWaalsContact CG2-CB 3.4Å; V563-L648 HydrophobicContact CG1-CD2 4.09Å; V563-V651 HydrophobicContact CB-CG2 4.19Å; V563-V651 HydrophobicContact CG1-CB 4.47Å; V563-V651 HydrophobicContact CG1-CG1 3.87Å; V563-V651 HydrophobicContact CG1-CG2 3.92Å
564	E	77.5	Confident	69.5	Low	107 Å²	107	85.2 Å²	85.2	50%	0.5	45%	0.445	S	S	.	.			trans	-76.2	136.3	-174	-62.9	-176.4	155.8	0	0	111.1	F566 F596 V651	E564-F566 PolarHBondContact O-N 3.11Å; E564-F596 HydrophobicContact CB-CD1 3.77Å; E564-F596 HydrophobicContact CB-CE1 3.97Å; E564-F596 WeakPolarHBondContact OE2-CD1 3.36Å; E564-V651 PolarHBondContact O-N 3.16Å
565	E	87	Confident	72	Confident	51 Å²	51	84.7 Å²	84.7	24%	0.238	44%	0.439	C	S	.	.	B	Isolated β-bridge	trans	-79.1	113.7	176.6	-179.4	87.6	161.2	0	0	108.9	V651 C652 I653 Y654	E565-V651 CarbonylContact C-O 3.06Å; E565-V651 WeakPolarHBondContact CA-O 3.19Å; E565-C652 WeakPolarHBondContact OE2-CA 3.4Å; E565-I653 VanDerWaalsContact CD-N 3.31Å; E565-I653 PolarHBondContact OE1-N 2.04Å; E565-I653 VanDerWaalsContact OE1-N 3.08Å; E565-I653 VanDerWaalsContact OE2-CG1 3.31Å; E565-I653 WeakPolarHBondContact OE2-CG1 3.45Å; E565-I653 PolarHBondContact OE2-N 3.05Å; E565-Y654 HydrophobicContact CB-CD2 4Å; E565-Y654 HydrophobicContact CB-CE2 3.78Å; E565-Y654 HydrophobicContact CG-CD2 3.58Å; E565-Y654 HydrophobicContact CG-CE2 3.93Å; E565-Y654 WeakPolarHBondContact OE1-CD2 3.44Å; E565-Y654 PolarHBondContact OE1-N 3.24Å
566	F	90.9	Very high	74.2	Confident	1 Å²	1	86.7 Å²	86.7	0%	0.004	45%	0.446	C	S	.	.			trans	-75.4	132.8	173	-167.8	-101.9	0	0	0	110.7	E564 R568 L570 L571 A590 E591 M593 F596 A650 V651 C652 I661	E564-F566 PolarHBondContact O-N 3.11Å; F566-R568 PolarHBondContact O-N 2.98Å; F566-L570 HydrophobicContact CE1-CB 3.7Å; F566-L570 HydrophobicContact CZ-CB 3.75Å; F566-L570 HydrophobicContact CZ-CD1 4.41Å; F566-L571 HydrophobicContact CD1-CD1 4.33Å; F566-L571 HydrophobicContact CD1-CD2 3.78Å; F566-L571 HydrophobicContact CD1-CG 3.81Å; F566-L571 HydrophobicContact CE1-CD2 3.47Å; F566-L571 VanDerWaalsContact CE1-CD2 3.47Å; F566-L571 HydrophobicContact CE1-CG 3.68Å; F566-L571 HydrophobicContact CZ-CD2 4.4Å; F566-A590 HydrophobicContact CE1-CB 4.29Å; F566-A590 HydrophobicContact CZ-CB 3.9Å; F566-E591 WeakPolarHBondContact CZ-O 3.44Å; F566-M593 HydrophobicContact CD2-SD 3.71Å; F566-M593 HydrophobicContact CE2-CB 4.48Å; F566-M593 HydrophobicContact CE2-SD 3.5Å; F566-M593 VanDerWaalsContact CE2-SD 3.5Å; F566-M593 HydrophobicContact CZ-SD 4.16Å; F566-F596 HydrophobicContact CD2-CD1 4.46Å; F566-F596 AromaticContact CD2-CD2 3.8Å; F566-F596 HydrophobicContact CD2-CD2 3.8Å; F566-F596 HydrophobicContact CD2-CE1 4.29Å; F566-F596 AromaticContact CD2-CE2 3.63Å; F566-F596 HydrophobicContact CD2-CE2 3.63Å; F566-F596 HydrophobicContact CD2-CG 4.23Å; F566-F596 AromaticContact CD2-CZ 3.89Å; F566-F596 HydrophobicContact CD2-CZ 3.89Å; F566-F596 AromaticContact CE2-CD2 3.92Å; F566-F596 HydrophobicContact CE2-CD2 3.92Å; F566-F596 AromaticContact CE2-CE2 3.76Å; F566-F596 HydrophobicContact CE2-CE2 3.76Å; F566-F596 HydrophobicContact CE2-CZ 4.42Å; F566-A650 HydrophobicContact CB-CB 3.85Å; F566-V651 PolarHBondContact N-O 2.9Å; F566-C652 PolarHBondContact O-SG 3.41Å; F566-I661 HydrophobicContact CB-CD1 3.39Å; F566-I661 HydrophobicContact CD1-CD1 3.71Å; F566-I661 HydrophobicContact CG-CD1 3.64Å
567	P	90.4	Very high	76.1	Confident	51 Å²	51	84.2 Å²	84.2	33%	0.331	43%	0.433	S	S	.	.			trans	-67.5	94.1	176.5	-19.4	32.4	0	0	0	111.5	K569 L570	P567-K569 HydrophobicContact CB-CG 4.27Å; P567-K569 PolarHBondContact O-N 3.21Å; P567-L570 HydrophobicContact CB-CD1 4.04Å; P567-L570 HydrophobicContact CB-CG 4.23Å; P567-L570 HydrophobicContact CG-CD1 4.16Å; P567-L570 WeakPolarHBondContact O-CB 3.42Å; P567-L570 PolarHBondContact O-N 2.77Å
568	R	89.9	Confident	77.6	Confident	67 Å²	67	80.6 Å²	80.6	25%	0.253	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-35.6	-37.4	-179.4	-175.5	-169.4	-60.1	-75.7	-3.3	116	F566 L570 L571 S655 P657 C659	F566-R568 PolarHBondContact O-N 2.98Å; R568-L570 PolarHBondContact O-N 3.48Å; R568-L570 VanDerWaalsContact O-N 3.13Å; R568-L571 WeakPolarHBondContact O-CB 3.41Å; R568-L571 PolarHBondContact O-N 2.94Å; R568-S655 PolarHBondContact NH2-O 2.87Å; R568-P657 VanDerWaalsContact CZ-O 3.23Å; R568-P657 PolarHBondContact NH1-O 3.14Å; R568-P657 PolarHBondContact NH2-O 2.9Å; R568-C659 PolarHBondContact NH1-SG 2.73Å
569	K	89.8	Confident	79.1	Confident	181 Å²	181	82.6 Å²	82.6	79%	0.787	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-59.2	-14.7	176.1	63.1	169	-175.9	168.7	0	115.3	P567	P567-K569 HydrophobicContact CB-CG 4.27Å; P567-K569 PolarHBondContact O-N 3.21Å
570	L	91.6	Very high	80.2	Confident	44 Å²	44	73.5 Å²	73.5	23%	0.23	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-97.3	1.9	178.1	-58	179.9	0	0	0	112.4	F566 P567 R568 A590 E591	F566-L570 HydrophobicContact CE1-CB 3.7Å; F566-L570 HydrophobicContact CZ-CB 3.75Å; F566-L570 HydrophobicContact CZ-CD1 4.41Å; P567-L570 HydrophobicContact CB-CD1 4.04Å; P567-L570 HydrophobicContact CB-CG 4.23Å; P567-L570 HydrophobicContact CG-CD1 4.16Å; P567-L570 WeakPolarHBondContact O-CB 3.42Å; P567-L570 PolarHBondContact O-N 2.77Å; R568-L570 PolarHBondContact O-N 3.48Å; R568-L570 VanDerWaalsContact O-N 3.13Å; L570-A590 WeakPolarHBondContact O-CA 3.19Å; L570-E591 HydrophobicContact CB-CB 4.23Å; L570-E591 HydrophobicContact CD2-CB 4.37Å; L570-E591 PolarHBondContact O-N 3.2Å
571	L	92.9	Very high	81.1	Confident	31 Å²	31	72 Å²	72	16%	0.162	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	112.4	171.5	-62.3	175.8	0	0	0	110.1	F566 R568 C588 E589 A590 V613 V615 I661	F566-L571 HydrophobicContact CD1-CD1 4.33Å; F566-L571 HydrophobicContact CD1-CD2 3.78Å; F566-L571 HydrophobicContact CD1-CG 3.81Å; F566-L571 HydrophobicContact CE1-CD2 3.47Å; F566-L571 VanDerWaalsContact CE1-CD2 3.47Å; F566-L571 HydrophobicContact CE1-CG 3.68Å; F566-L571 HydrophobicContact CZ-CD2 4.4Å; R568-L571 WeakPolarHBondContact O-CB 3.41Å; R568-L571 PolarHBondContact O-N 2.94Å; L571-C588 HydrophobicContact CB-CB 4.49Å; L571-C588 HydrophobicContact CD2-CB 4.44Å; L571-E589 CarbonylContact C-O 3.59Å; L571-E589 WeakPolarHBondContact CA-O 3.27Å; L571-A590 HydrophobicContact CD2-CB 3.88Å; L571-V613 HydrophobicContact CD2-CG2 4.22Å; L571-V615 HydrophobicContact CD1-CG1 4.2Å; L571-V615 HydrophobicContact CD1-CG2 4.28Å; L571-V615 HydrophobicContact CD2-CG2 4.26Å; L571-I661 HydrophobicContact CD1-CD1 4.13Å; L571-I661 HydrophobicContact CD1-CG1 4.47Å; L571-I661 HydrophobicContact CD2-CD1 4.19Å
572	T	94.4	Very high	81.7	Confident	64 Å²	64	70.2 Å²	70.2	39%	0.393	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	109.5	172.4	-64.9	0	0	0	0	109.9	C588 E589	T572-C588 CarbonylContact O-C 3.57Å; T572-C588 VanDerWaalsContact O-CA 3.26Å; T572-C588 WeakPolarHBondContact O-CA 3.19Å; T572-E589 PolarHBondContact N-O 3.2Å; T572-E589 PolarHBondContact O-N 3.47Å
573	F	94.4	Very high	82.6	Confident	111 Å²	111	64.8 Å²	64.8	49%	0.487	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	142.8	175.7	172	-94.5	0	0	0	112.7	E575 H586	F573-E575 VanDerWaalsContact CE2-C 3.41Å; F573-E575 WeakPolarHBondContact CE2-O 3.23Å; F573-E575 VanDerWaalsContact CZ-C 3.48Å; F573-H586 HydrophobicContact CD2-CB 3.77Å; F573-H586 AromaticContact CD2-CG 3.67Å; F573-H586 AromaticContact CD2-ND1 3.22Å; F573-H586 WeakPolarHBondContact CD2-ND1 3.49Å; F573-H586 HydrophobicContact CE2-CB 3.83Å; F573-H586 AromaticContact CE2-CE1 3.81Å; F573-H586 AromaticContact CE2-CG 3.49Å; F573-H586 VanDerWaalsContact CE2-CG 3.49Å; F573-H586 AromaticContact CE2-ND1 3.3Å; F573-H586 VanDerWaalsContact CE2-ND1 3.3Å; F573-H586 WeakPolarHBondContact CE2-ND1 3.44Å
574	K	93.3	Very high	83.4	Confident	95 Å²	95	65.1 Å²	65.1	41%	0.413	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	-56.1	173.3	-59	-70.2	165.5	155.9	0	112.2	L587 E589	K574-L587 HydrophobicContact CB-CB 4.38Å; K574-L587 HydrophobicContact CB-CD2 4.38Å; K574-L587 HydrophobicContact CB-CG 4.15Å; K574-L587 WeakPolarHBondContact CB-O 3.41Å; K574-L587 PolarHBondContact N-O 3.01Å; K574-E589 WeakPolarHBondContact CE-OE1 3.44Å; K574-E589 WeakPolarHBondContact CE-OE2 3.45Å; K574-E589 IonicContact NZ-OE1 2.69Å; K574-E589 PolarHBondContact NZ-OE1 3.09Å; K574-E589 IonicContact NZ-OE2 2.68Å; K574-E589 PolarHBondContact NZ-OE2 2.61Å
575	E	90.7	Very high	83.9	Confident	116 Å²	116	60.4 Å²	60.4	54%	0.542	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	151	-168.7	-174.9	170.7	166.7	0	0	111.3	F573 H586 L587	F573-E575 VanDerWaalsContact CE2-C 3.41Å; F573-E575 WeakPolarHBondContact CE2-O 3.23Å; F573-E575 VanDerWaalsContact CZ-C 3.48Å; E575-H586 CarbonylContact O-C 3.52Å; E575-H586 VanDerWaalsContact O-CA 3.25Å; E575-H586 WeakPolarHBondContact O-CA 3.29Å; E575-L587 HydrophobicContact CB-CB 4.27Å; E575-L587 PolarHBondContact N-O 2.71Å; E575-L587 PolarHBondContact O-N 3.42Å
576	K	87.4	Confident	84	Confident	86 Å²	86	59 Å²	59	37%	0.374	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	105.2	171.8	176.7	173.1	169.2	177.7	0	109	E579 E584	K576-E579 IonicContact NZ-OE2 3.22Å; K576-E579 PolarHBondContact NZ-OE2 3.02Å; K576-E584 WeakPolarHBondContact CE-OE1 3.3Å; K576-E584 IonicContact NZ-OE1 2.71Å; K576-E584 PolarHBondContact NZ-OE1 3.23Å; K576-E584 IonicContact NZ-OE2 3.21Å
577	L	82.2	Confident	84.1	Confident	72 Å²	72	59.7 Å²	59.7	38%	0.377	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	-25.3	-179.3	-61	173.8	0	0	0	112.8	V585 L587 A614 Y664	L577-V585 HydrophobicContact CB-CG1 4.18Å; L577-V585 HydrophobicContact CD1-CG1 4.14Å; L577-V585 PolarHBondContact N-O 2.8Å; L577-L587 HydrophobicContact CD1-CB 3.96Å; L577-L587 HydrophobicContact CD2-CB 4.14Å; L577-L587 HydrophobicContact CG-CB 3.97Å; L577-A614 HydrophobicContact CD1-CB 4.39Å; L577-Y664 HydrophobicContact CD1-CD2 4.03Å; L577-Y664 HydrophobicContact CD1-CE2 3.8Å; L577-Y664 HydrophobicContact CD2-CE2 4.17Å
578	G	75.4	Confident	84.3	Confident	20 Å²	20	57.6 Å²	57.6	21%	0.206	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.6	171.2	178.7	0	0	0	0	0	115.5	E584 V585	G578-E584 WeakPolarHBondContact O-CA 3.22Å; G578-V585 PolarHBondContact N-O 2.95Å; G578-V585 VanDerWaalsContact N-O 3.14Å; G578-V585 PolarHBondContact O-N 3.49Å
579	E	73.4	Confident	84.5	Confident	77 Å²	77	57.2 Å²	57.2	36%	0.36	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	128.9	174	-178.1	168.6	178.2	0	0	110.6	K576 E584 R619 N744	K576-E579 IonicContact NZ-OE2 3.22Å; K576-E579 PolarHBondContact NZ-OE2 3.02Å; E579-E584 HydrophobicContact CG-CG 4.29Å; E579-R619 IonicContact OE1-NH1 2.92Å; E579-R619 PolarHBondContact OE1-NH1 2.89Å; E579-N744 PolarHBondContact O-ND2 3.49Å
580	G	65.9	Low	84.6	Confident	3 Å²	3	48.6 Å²	48.6	3%	0.031	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	178	169.6	0	0	0	0	0	111.7	F582 G583	G580-F582 PolarHBondContact O-N 2.8Å; G580-G583 PolarHBondContact N-O 3.32Å; G580-G583 PolarHBondContact O-N 3.16Å; G580-G583 VanDerWaalsContact O-O 3.13Å
581	Q	61.2	Low	84.5	Confident	108 Å²	108	51.4 Å²	51.4	51%	0.505	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-28.4	-168.8	-167.5	176	-5.8	0	0	115.7
582	F	64.1	Low	84.1	Confident	26 Å²	26	51.5 Å²	51.5	11%	0.114	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.4	8.3	-174.7	-50.2	-61.8	0	0	0	114.1	G542 N544 G580 L618 R619 A626	G542-F582 WeakPolarHBondContact O-CE2 3.47Å; G542-F582 WeakPolarHBondContact O-CZ 3.32Å; N544-F582 WeakPolarHBondContact OD1-CD2 3.43Å; G580-F582 PolarHBondContact O-N 2.8Å; F582-L618 HydrophobicContact CB-CD1 4.42Å; F582-R619 PolarHBondContact O-N 3.15Å; F582-A626 HydrophobicContact CB-CB 3.98Å; F582-A626 HydrophobicContact CD1-CB 4.09Å; F582-A626 HydrophobicContact CD2-CB 3.88Å; F582-A626 HydrophobicContact CE2-CB 4.42Å; F582-A626 HydrophobicContact CG-CB 3.71Å
583	G	75.1	Confident	83.7	Confident	10 Å²	10	48.4 Å²	48.4	10%	0.103	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.6	162.8	-169.3	0	0	0	0	0	114	G580 M617	G580-G583 PolarHBondContact N-O 3.32Å; G580-G583 PolarHBondContact O-N 3.16Å; G580-G583 VanDerWaalsContact O-O 3.13Å; G583-M617 CarbonylContact C-O 3.6Å; G583-M617 WeakPolarHBondContact CA-O 3.36Å
584	E	84.1	Confident	83	Confident	46 Å²	46	46.2 Å²	46.2	22%	0.215	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	157.6	-179.6	-55.7	-170.9	153.7	0	0	110.5	K576 G578 E579 H586 K616 M617	K576-E584 WeakPolarHBondContact CE-OE1 3.3Å; K576-E584 IonicContact NZ-OE1 2.71Å; K576-E584 PolarHBondContact NZ-OE1 3.23Å; K576-E584 IonicContact NZ-OE2 3.21Å; G578-E584 WeakPolarHBondContact O-CA 3.22Å; E579-E584 HydrophobicContact CG-CG 4.29Å; E584-H586 IonicContact OE2-CD2 2.77Å; E584-H586 IonicContact OE2-CE1 3.56Å; E584-H586 PolarHBondContact OE2-CE1 3.32Å; E584-H586 IonicContact OE2-NE2 3.64Å; E584-H586 PolarHBondContact OE2-NE2 3.49Å; E584-K616 CarbonylContact O-C 3.58Å; E584-K616 WeakPolarHBondContact O-CA 3.42Å; E584-M617 PolarHBondContact N-O 2.97Å; E584-M617 PolarHBondContact O-N 2.97Å
585	V	87	Confident	82.2	Confident	8 Å²	8	49.9 Å²	49.9	5%	0.048	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	127.2	165.4	168.9	0	0	0	0	109.6	L577 G578 A614 V615 K616 M741	L577-V585 HydrophobicContact CB-CG1 4.18Å; L577-V585 HydrophobicContact CD1-CG1 4.14Å; L577-V585 PolarHBondContact N-O 2.8Å; G578-V585 PolarHBondContact N-O 2.95Å; G578-V585 VanDerWaalsContact N-O 3.14Å; G578-V585 PolarHBondContact O-N 3.49Å; V585-A614 HydrophobicContact CG1-CB 4.21Å; V585-V615 WeakPolarHBondContact CA-O 3.5Å; V585-K616 HydrophobicContact CG2-CB 3.56Å; V585-K616 HydrophobicContact CG2-CD 4.11Å; V585-K616 HydrophobicContact CG2-CG 3.71Å; V585-M741 HydrophobicContact CB-CE 3.85Å; V585-M741 HydrophobicContact CB-SD 3.61Å; V585-M741 HydrophobicContact CG1-CE 4.47Å; V585-M741 HydrophobicContact CG2-CE 3.54Å; V585-M741 HydrophobicContact CG2-SD 3.26Å; V585-M741 WeakPolarHBondContact CG2-SD 3.47Å
586	H	90.1	Very high	81.5	Confident	22 Å²	22	46.1 Å²	46.1	10%	0.102	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	145.3	-179.4	-64.9	-175.7	0	0	0	110.6	F573 E575 E584 V615 M617	F573-H586 HydrophobicContact CD2-CB 3.77Å; F573-H586 AromaticContact CD2-CG 3.67Å; F573-H586 AromaticContact CD2-ND1 3.22Å; F573-H586 WeakPolarHBondContact CD2-ND1 3.49Å; F573-H586 HydrophobicContact CE2-CB 3.83Å; F573-H586 AromaticContact CE2-CE1 3.81Å; F573-H586 AromaticContact CE2-CG 3.49Å; F573-H586 VanDerWaalsContact CE2-CG 3.49Å; F573-H586 AromaticContact CE2-ND1 3.3Å; F573-H586 VanDerWaalsContact CE2-ND1 3.3Å; F573-H586 WeakPolarHBondContact CE2-ND1 3.44Å; E575-H586 CarbonylContact O-C 3.52Å; E575-H586 VanDerWaalsContact O-CA 3.25Å; E575-H586 WeakPolarHBondContact O-CA 3.29Å; E584-H586 IonicContact OE2-CD2 2.77Å; E584-H586 IonicContact OE2-CE1 3.56Å; E584-H586 PolarHBondContact OE2-CE1 3.32Å; E584-H586 IonicContact OE2-NE2 3.64Å; E584-H586 PolarHBondContact OE2-NE2 3.49Å; H586-V615 PolarHBondContact N-O 3.4Å; H586-V615 PolarHBondContact O-N 2.85Å; H586-M617 WeakPolarHBondContact CE1-CE 3.24Å; H586-M617 WeakPolarHBondContact ND1-CE 3.46Å
587	L	93.3	Very high	80.8	Confident	15 Å²	15	43.2 Å²	43.2	8%	0.079	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	127.6	162.4	179.9	56.9	0	0	0	108.5	K574 E575 L577 L612 Y664	K574-L587 HydrophobicContact CB-CB 4.38Å; K574-L587 HydrophobicContact CB-CD2 4.38Å; K574-L587 HydrophobicContact CB-CG 4.15Å; K574-L587 WeakPolarHBondContact CB-O 3.41Å; K574-L587 PolarHBondContact N-O 3.01Å; E575-L587 HydrophobicContact CB-CB 4.27Å; E575-L587 PolarHBondContact N-O 2.71Å; E575-L587 PolarHBondContact O-N 3.42Å; L577-L587 HydrophobicContact CD1-CB 3.96Å; L577-L587 HydrophobicContact CD2-CB 4.14Å; L577-L587 HydrophobicContact CG-CB 3.97Å; L587-L612 HydrophobicContact CD1-CB 4.22Å; L587-L612 HydrophobicContact CD1-CD2 4.06Å; L587-L612 HydrophobicContact CG-CD2 4.39Å; L587-Y664 HydrophobicContact CD1-CD1 3.85Å; L587-Y664 HydrophobicContact CD1-CD2 3.62Å; L587-Y664 HydrophobicContact CD1-CE1 4.03Å; L587-Y664 HydrophobicContact CD1-CE2 3.81Å; L587-Y664 HydrophobicContact CD1-CG 3.64Å; L587-Y664 HydrophobicContact CD2-CE1 4.38Å; L587-Y664 HydrophobicContact CD2-CE2 4.39Å
588	C	94.3	Very high	79.9	Confident	7 Å²	7	44.6 Å²	44.6	5%	0.047	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	150.7	175.6	-63.6	0	0	0	0	111.2	L571 T572 L612 V613 V615	L571-C588 HydrophobicContact CB-CB 4.49Å; L571-C588 HydrophobicContact CD2-CB 4.44Å; T572-C588 CarbonylContact O-C 3.57Å; T572-C588 VanDerWaalsContact O-CA 3.26Å; T572-C588 WeakPolarHBondContact O-CA 3.19Å; C588-L612 WeakPolarHBondContact O-CA 3.48Å; C588-V613 HydrophobicContact CB-CG2 4.12Å; C588-V613 PolarHBondContact N-O 3.08Å; C588-V613 PolarHBondContact O-N 2.89Å; C588-V615 HydrophobicContact CB-CG2 3.78Å
589	E	93.9	Very high	78.9	Confident	59 Å²	59	52.7 Å²	52.7	28%	0.276	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	131.1	156.7	-91.6	166.1	-152.8	0	0	109	L571 T572 K574 P610 V611 L612	L571-E589 CarbonylContact C-O 3.59Å; L571-E589 WeakPolarHBondContact CA-O 3.27Å; T572-E589 PolarHBondContact N-O 3.2Å; T572-E589 PolarHBondContact O-N 3.47Å; K574-E589 WeakPolarHBondContact CE-OE1 3.44Å; K574-E589 WeakPolarHBondContact CE-OE2 3.45Å; K574-E589 IonicContact NZ-OE1 2.69Å; K574-E589 PolarHBondContact NZ-OE1 3.09Å; K574-E589 IonicContact NZ-OE2 2.68Å; K574-E589 PolarHBondContact NZ-OE2 2.61Å; E589-P610 HydrophobicContact CB-CB 3.96Å; E589-P610 HydrophobicContact CB-CG 4.43Å; E589-P610 HydrophobicContact CG-CB 4.03Å; E589-P610 HydrophobicContact CG-CG 4.07Å; E589-V611 CarbonylContact C-O 3.57Å; E589-V611 WeakPolarHBondContact CA-O 3.21Å; E589-L612 HydrophobicContact CG-CD2 3.85Å
590	A	91.7	Very high	78	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	114.1	176.9	0	0	0	0	0	110.5	F566 L570 L571 M593 P610 V611 V613	F566-A590 HydrophobicContact CE1-CB 4.29Å; F566-A590 HydrophobicContact CZ-CB 3.9Å; L570-A590 WeakPolarHBondContact O-CA 3.19Å; L571-A590 HydrophobicContact CD2-CB 3.88Å; A590-M593 HydrophobicContact CB-CB 3.81Å; A590-M593 HydrophobicContact CB-CG 4.02Å; A590-M593 HydrophobicContact CB-SD 4.05Å; A590-P610 WeakPolarHBondContact O-CA 3.5Å; A590-V611 PolarHBondContact N-O 3.27Å; A590-V611 PolarHBondContact O-N 2.99Å; A590-V613 HydrophobicContact CB-CG1 4.21Å; A590-V613 HydrophobicContact CB-CG2 3.79Å
591	E	90.4	Very high	77.7	Confident	103 Å²	103	58.5 Å²	58.5	48%	0.481	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	136.5	175	-65.4	-179.4	177.5	0	0	111.1	F566 L570 M593 P610	F566-E591 WeakPolarHBondContact CZ-O 3.44Å; L570-E591 HydrophobicContact CB-CB 4.23Å; L570-E591 HydrophobicContact CD2-CB 4.37Å; L570-E591 PolarHBondContact O-N 3.2Å; E591-M593 PolarHBondContact O-N 3.06Å; E591-P610 HydrophobicContact CG-CB 4.34Å
592	G	84.9	Confident	77.4	Confident	33 Å²	33	61 Å²	61	34%	0.34	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	9.4	-179.8	0	0	0	0	0	114.9	Q594 E595	G592-Q594 PolarHBondContact O-N 3Å; G592-Q594 VanDerWaalsContact O-N 3.08Å; G592-E595 PolarHBondContact O-N 3.49Å; G592-E595 VanDerWaalsContact O-N 3.14Å
593	M	85.6	Confident	77.1	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-59.5	-23.2	-176.5	-165.4	63.2	-149.8	0	0	113.6	F566 A590 E591 E595 F596 I597 V611 V613 L649 A650 I661	F566-M593 HydrophobicContact CD2-SD 3.71Å; F566-M593 HydrophobicContact CE2-CB 4.48Å; F566-M593 HydrophobicContact CE2-SD 3.5Å; F566-M593 VanDerWaalsContact CE2-SD 3.5Å; F566-M593 HydrophobicContact CZ-SD 4.16Å; A590-M593 HydrophobicContact CB-CB 3.81Å; A590-M593 HydrophobicContact CB-CG 4.02Å; A590-M593 HydrophobicContact CB-SD 4.05Å; E591-M593 PolarHBondContact O-N 3.06Å; M593-E595 PolarHBondContact O-N 3.22Å; M593-F596 HydrophobicContact CE-CB 3.87Å; M593-F596 PolarHBondContact O-N 3.28Å; M593-F596 VanDerWaalsContact O-N 3.09Å; M593-I597 HydrophobicContact CG-CD1 4.07Å; M593-I597 WeakPolarHBondContact O-CG1 3.48Å; M593-V611 HydrophobicContact CB-CB 3.92Å; M593-V611 HydrophobicContact CB-CG2 3.92Å; M593-V611 HydrophobicContact CG-CB 4.21Å; M593-V611 HydrophobicContact CG-CG2 4.48Å; M593-V613 HydrophobicContact CG-CG1 4.25Å; M593-L649 HydrophobicContact CE-CB 3.36Å; M593-L649 HydrophobicContact CE-CD1 3.98Å; M593-L649 HydrophobicContact CE-CG 4.29Å; M593-A650 HydrophobicContact CE-CB 4.06Å; M593-I661 HydrophobicContact CE-CG2 4.35Å
594	Q	79.4	Confident	76.2	Confident	65 Å²	65	70.7 Å²	70.7	30%	0.304	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-57.4	-31.5	175.9	-67.2	82.9	-8.7	0	0	113.3	G592 F596 I597 Q609	G592-Q594 PolarHBondContact O-N 3Å; G592-Q594 VanDerWaalsContact O-N 3.08Å; Q594-F596 PolarHBondContact O-N 3.12Å; Q594-I597 PolarHBondContact O-N 3.22Å; Q594-Q609 PolarHBondContact NE2-O 3.47Å
595	E	76.9	Confident	75.1	Confident	171 Å²	171	70.8 Å²	70.8	80%	0.799	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-65.8	-24.5	178	-64.3	-178	-175.7	0	0	112.5	G592 M593	G592-E595 PolarHBondContact O-N 3.49Å; G592-E595 VanDerWaalsContact O-N 3.14Å; M593-E595 PolarHBondContact O-N 3.22Å
596	F	75.9	Confident	73.9	Confident	38 Å²	38	73.9 Å²	73.9	17%	0.167	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-97.3	9.1	-177.2	-58.7	-96.3	0	0	0	112.7	E564 F566 M593 Q594 A650	E564-F596 HydrophobicContact CB-CD1 3.77Å; E564-F596 HydrophobicContact CB-CE1 3.97Å; E564-F596 WeakPolarHBondContact OE2-CD1 3.36Å; F566-F596 HydrophobicContact CD2-CD1 4.46Å; F566-F596 AromaticContact CD2-CD2 3.8Å; F566-F596 HydrophobicContact CD2-CD2 3.8Å; F566-F596 HydrophobicContact CD2-CE1 4.29Å; F566-F596 AromaticContact CD2-CE2 3.63Å; F566-F596 HydrophobicContact CD2-CE2 3.63Å; F566-F596 HydrophobicContact CD2-CG 4.23Å; F566-F596 AromaticContact CD2-CZ 3.89Å; F566-F596 HydrophobicContact CD2-CZ 3.89Å; F566-F596 AromaticContact CE2-CD2 3.92Å; F566-F596 HydrophobicContact CE2-CD2 3.92Å; F566-F596 AromaticContact CE2-CE2 3.76Å; F566-F596 HydrophobicContact CE2-CE2 3.76Å; F566-F596 HydrophobicContact CE2-CZ 4.42Å; M593-F596 HydrophobicContact CE-CB 3.87Å; M593-F596 PolarHBondContact O-N 3.28Å; M593-F596 VanDerWaalsContact O-N 3.09Å; Q594-F596 PolarHBondContact O-N 3.12Å; F596-A650 HydrophobicContact CD1-CB 4.34Å
597	I	72.9	Confident	72.6	Confident	24 Å²	24	82.4 Å²	82.4	12%	0.123	42%	0.422	C	S	.	.	S	Bend	trans	-122.9	110.3	-174.7	-63.8	175.4	0	0	0	109.3	M593 Q594 Y601 L603 L649	M593-I597 HydrophobicContact CG-CD1 4.07Å; M593-I597 WeakPolarHBondContact O-CG1 3.48Å; Q594-I597 PolarHBondContact O-N 3.22Å; I597-Y601 HydrophobicContact CG2-CD1 4.35Å; I597-Y601 WeakPolarHBondContact CG2-O 3.41Å; I597-L603 HydrophobicContact CD1-CD1 3.68Å; I597-L649 HydrophobicContact CG1-CD2 4.48Å
598	N	62.1	Low	71.3	Confident	101 Å²	101	85.3 Å²	85.3	54%	0.54	46%	0.455	S	S	.	.			trans	-49.6	146.6	175.1	-74.4	35.9	0	0	0	112.8	D600 Y601	N598-D600 PolarHBondContact O-N 2.99Å; N598-Y601 PolarHBondContact O-N 3.36Å
599	E	55.2	Low	70.4	Confident	191 Å²	191	90.1 Å²	90.1	89%	0.893	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-26.8	175.8	-62.2	-173.6	161.6	0	0	114	Y601	E599-Y601 PolarHBondContact O-N 3.39Å
600	D	55.2	Low	69.7	Low	147 Å²	147	89.8 Å²	89.8	79%	0.786	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-5.9	172.3	-60.1	-56.5	0	0	0	114.2	N598	N598-D600 PolarHBondContact O-N 2.99Å
601	Y	58.8	Low	69.6	Low	54 Å²	54	90.2 Å²	90.2	21%	0.212	48%	0.483	C	S	.	.			trans	-128.4	69.6	-177.9	-145.5	-126.7	0	0	0	112.9	I597 N598 E599 L603 R647 E663 K735	I597-Y601 HydrophobicContact CG2-CD1 4.35Å; I597-Y601 WeakPolarHBondContact CG2-O 3.41Å; N598-Y601 PolarHBondContact O-N 3.36Å; E599-Y601 PolarHBondContact O-N 3.39Å; Y601-L603 PolarHBondContact O-N 2.78Å; Y601-R647 VanDerWaalsContact CG-NH2 3.29Å; Y601-E663 PolarHBondContact OH-OE2 3.15Å; Y601-K735 WeakPolarHBondContact OH-CE 3.41Å; Y601-K735 PolarHBondContact OH-NZ 3.19Å
602	L	53.8	Low	69.6	Low	162 Å²	162	89.1 Å²	89.1	85%	0.848	48%	0.48	S	S	*	.			trans	-56.9	98.2	168	-70.1	167.7	0	0	0	111
603	L	57.8	Low	70	Confident	72 Å²	72	87.6 Å²	87.6	38%	0.377	46%	0.464	S	S	.	.			trans	-77.8	133.8	154.9	-68	176.2	0	0	0	108.3	I597 Y601 V605 V611	I597-L603 HydrophobicContact CD1-CD1 3.68Å; Y601-L603 PolarHBondContact O-N 2.78Å; L603-V605 HydrophobicContact CB-CB 4.35Å; L603-V605 HydrophobicContact CB-CG2 3.97Å; L603-V605 PolarHBondContact O-N 2.93Å; L603-V611 HydrophobicContact CD1-CG1 3.66Å; L603-V611 HydrophobicContact CD1-CG2 4.23Å
604	D	56.9	Low	70.3	Confident	166 Å²	166	88.1 Å²	88.1	89%	0.888	47%	0.468	S	S	*	.			trans	-72.1	49.4	171.1	-67.1	-50.7	0	0	0	112
605	V	61.3	Low	70.9	Confident	48 Å²	48	85 Å²	85	29%	0.291	45%	0.454	S	S	.	.			trans	-109	119.6	-178.8	175.8	0	0	0	0	108.7	L603 Q609 V611	L603-V605 HydrophobicContact CB-CB 4.35Å; L603-V605 HydrophobicContact CB-CG2 3.97Å; L603-V605 PolarHBondContact O-N 2.93Å; V605-Q609 HydrophobicContact CG1-CB 3.97Å; V605-V611 HydrophobicContact CG1-CG2 4.3Å
606	P	61.5	Low	71.5	Confident	73 Å²	73	77.8 Å²	77.8	47%	0.474	42%	0.42	S	S	.	.			trans	-55.7	141	176.2	-26.3	35	0	0	0	112.7	G608 Q609	P606-G608 PolarHBondContact O-N 3.38Å; P606-Q609 HydrophobicContact CB-CG 4.3Å; P606-Q609 PolarHBondContact O-N 3.11Å
607	E	63.2	Low	72.1	Confident	202 Å²	202	78 Å²	78	94%	0.944	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	121.9	179.4	-167.5	176	-165.8	0	0	111
608	G	65.1	Low	72.8	Confident	75 Å²	75	77.4 Å²	77.4	77%	0.773	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.8	4.4	-178	0	0	0	0	0	116.8	P606	P606-G608 PolarHBondContact O-N 3.38Å
609	Q	75.6	Confident	73.8	Confident	109 Å²	109	76.1 Å²	76.1	51%	0.509	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-91.5	147.8	169.4	-68.3	-168	-5.2	0	0	112.5	Q594 V605 P606	Q594-Q609 PolarHBondContact NE2-O 3.47Å; V605-Q609 HydrophobicContact CG1-CB 3.97Å; P606-Q609 HydrophobicContact CB-CG 4.3Å; P606-Q609 PolarHBondContact O-N 3.11Å
610	P	80.4	Confident	74.9	Confident	52 Å²	52	73.1 Å²	73.1	34%	0.338	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-69.3	144.8	176.1	29.6	-35	0	0	0	111.7	E589 A590 E591	E589-P610 HydrophobicContact CB-CB 3.96Å; E589-P610 HydrophobicContact CB-CG 4.43Å; E589-P610 HydrophobicContact CG-CB 4.03Å; E589-P610 HydrophobicContact CG-CG 4.07Å; A590-P610 WeakPolarHBondContact O-CA 3.5Å; E591-P610 HydrophobicContact CG-CB 4.34Å
611	V	88.8	Confident	76	Confident	8 Å²	8	71 Å²	71	5%	0.048	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	135.7	179.6	179.1	0	0	0	0	110.1	E589 A590 M593 L603 V605 V613	E589-V611 CarbonylContact C-O 3.57Å; E589-V611 WeakPolarHBondContact CA-O 3.21Å; A590-V611 PolarHBondContact N-O 3.27Å; A590-V611 PolarHBondContact O-N 2.99Å; M593-V611 HydrophobicContact CB-CB 3.92Å; M593-V611 HydrophobicContact CB-CG2 3.92Å; M593-V611 HydrophobicContact CG-CB 4.21Å; M593-V611 HydrophobicContact CG-CG2 4.48Å; L603-V611 HydrophobicContact CD1-CG1 3.66Å; L603-V611 HydrophobicContact CD1-CG2 4.23Å; V605-V611 HydrophobicContact CG1-CG2 4.3Å; V611-V613 HydrophobicContact CG1-CG1 4.07Å; V611-V613 PolarHBondContact O-N 3.32Å
612	L	91.4	Very high	76.8	Confident	81 Å²	81	69.5 Å²	69.5	42%	0.424	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	123.7	169.8	-69.9	175.3	0	0	0	110.5	L587 C588 E589 Y664	L587-L612 HydrophobicContact CD1-CB 4.22Å; L587-L612 HydrophobicContact CD1-CD2 4.06Å; L587-L612 HydrophobicContact CG-CD2 4.39Å; C588-L612 WeakPolarHBondContact O-CA 3.48Å; E589-L612 HydrophobicContact CG-CD2 3.85Å; L612-Y664 HydrophobicContact CB-CD1 4.01Å; L612-Y664 HydrophobicContact CB-CG 4.49Å; L612-Y664 HydrophobicContact CD1-CD1 4.33Å; L612-Y664 HydrophobicContact CD1-CE1 4.49Å; L612-Y664 WeakPolarHBondContact O-CB 3.5Å
613	V	92.6	Very high	77.8	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	150.1	-178.1	-65.1	0	0	0	0	111.1	L571 C588 A590 M593 V611 V615 L649 I661 T662	L571-V613 HydrophobicContact CD2-CG2 4.22Å; C588-V613 HydrophobicContact CB-CG2 4.12Å; C588-V613 PolarHBondContact N-O 3.08Å; C588-V613 PolarHBondContact O-N 2.89Å; A590-V613 HydrophobicContact CB-CG1 4.21Å; A590-V613 HydrophobicContact CB-CG2 3.79Å; M593-V613 HydrophobicContact CG-CG1 4.25Å; V611-V613 HydrophobicContact CG1-CG1 4.07Å; V611-V613 PolarHBondContact O-N 3.32Å; V613-V615 HydrophobicContact CG2-CG2 3.9Å; V613-L649 HydrophobicContact CG1-CD1 4.11Å; V613-I661 HydrophobicContact CB-CG2 3.71Å; V613-I661 HydrophobicContact CG1-CG2 3.96Å; V613-I661 HydrophobicContact CG2-CG2 3.8Å; V613-T662 WeakPolarHBondContact CB-O 3.4Å
614	A	91.9	Very high	78.8	Confident	11 Å²	11	70.7 Å²	70.7	9%	0.091	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	122.6	170.7	0	0	0	0	0	109.2	L577 V585 T662	L577-A614 HydrophobicContact CD1-CB 4.39Å; V585-A614 HydrophobicContact CG1-CB 4.21Å; A614-T662 PolarHBondContact N-O 3Å; A614-T662 PolarHBondContact O-N 3.08Å; A614-T662 PolarHBondContact O-OG1 2.91Å
615	V	92	Very high	79.6	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.006	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	107.1	-175.2	-171.7	0	0	0	0	109.4	L571 V585 H586 C588 V613 M617 C659 M660 I661	L571-V615 HydrophobicContact CD1-CG1 4.2Å; L571-V615 HydrophobicContact CD1-CG2 4.28Å; L571-V615 HydrophobicContact CD2-CG2 4.26Å; V585-V615 WeakPolarHBondContact CA-O 3.5Å; H586-V615 PolarHBondContact N-O 3.4Å; H586-V615 PolarHBondContact O-N 2.85Å; C588-V615 HydrophobicContact CB-CG2 3.78Å; V613-V615 HydrophobicContact CG2-CG2 3.9Å; V615-M617 HydrophobicContact CG1-CG 3.84Å; V615-M617 HydrophobicContact CG1-SD 4.33Å; V615-C659 HydrophobicContact CG1-CB 3.98Å; V615-M660 CarbonylContact C-O 3.58Å; V615-M660 WeakPolarHBondContact CA-O 3.41Å; V615-I661 HydrophobicContact CG1-CG1 4.33Å; V615-I661 HydrophobicContact CG2-CG1 4.33Å
616	K	89.5	Confident	80	Confident	18 Å²	18	66.1 Å²	66.1	8%	0.078	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	120.3	173.2	-174	163.5	158.7	-173.2	0	109.1	E584 V585 F630 E633 C659 M660	E584-K616 CarbonylContact O-C 3.58Å; E584-K616 WeakPolarHBondContact O-CA 3.42Å; V585-K616 HydrophobicContact CG2-CB 3.56Å; V585-K616 HydrophobicContact CG2-CD 4.11Å; V585-K616 HydrophobicContact CG2-CG 3.71Å; K616-F630 HydrophobicContact CG-CE2 4.19Å; K616-F630 WeakPolarHBondContact O-CZ 3.38Å; K616-E633 IonicContact NZ-OE1 3.48Å; K616-E633 PolarHBondContact NZ-OE1 3.36Å; K616-E633 IonicContact NZ-OE2 2.71Å; K616-E633 PolarHBondContact NZ-OE2 2.93Å; K616-C659 CarbonylContact O-C 3.42Å; K616-C659 VanDerWaalsContact O-CA 3.28Å; K616-C659 WeakPolarHBondContact O-CA 3.13Å; K616-M660 HydrophobicContact CB-CB 4.35Å; K616-M660 HydrophobicContact CB-CE 4.22Å; K616-M660 HydrophobicContact CD-CE 3.62Å; K616-M660 HydrophobicContact CG-CE 3.93Å; K616-M660 PolarHBondContact N-O 3.1Å; K616-M660 PolarHBondContact O-N 2.91Å
617	M	88.6	Confident	81	Confident	43 Å²	43	66.6 Å²	66.6	21%	0.212	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	131.1	-175.8	-58	-155.5	-75.8	0	0	111.6	G583 E584 H586 V615 P657 L658 C659	G583-M617 CarbonylContact C-O 3.6Å; G583-M617 WeakPolarHBondContact CA-O 3.36Å; E584-M617 PolarHBondContact N-O 2.97Å; E584-M617 PolarHBondContact O-N 2.97Å; H586-M617 WeakPolarHBondContact CE1-CE 3.24Å; H586-M617 WeakPolarHBondContact ND1-CE 3.46Å; V615-M617 HydrophobicContact CG1-CG 3.84Å; V615-M617 HydrophobicContact CG1-SD 4.33Å; M617-P657 HydrophobicContact SD-CG 4.45Å; M617-L658 WeakPolarHBondContact CA-O 3.41Å; M617-C659 HydrophobicContact CG-CB 4.44Å; M617-C659 VanDerWaalsContact CG-SG 3.54Å
618	L	87	Confident	81.7	Confident	11 Å²	11	61 Å²	61	6%	0.058	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	131.3	171.9	-170	73.4	0	0	0	109.6	F582 A622 R627 F630 P657 L658	F582-L618 HydrophobicContact CB-CD1 4.42Å; L618-A622 HydrophobicContact CD1-CB 3.72Å; L618-A622 HydrophobicContact CD2-CB 4.01Å; L618-A622 HydrophobicContact CG-CB 3.65Å; L618-R627 HydrophobicContact CD2-CB 3.92Å; L618-R627 HydrophobicContact CD2-CG 3.88Å; L618-F630 HydrophobicContact CB-CD2 3.91Å; L618-F630 HydrophobicContact CB-CE2 3.84Å; L618-F630 HydrophobicContact CB-CG 4.31Å; L618-F630 HydrophobicContact CB-CZ 4.18Å; L618-F630 HydrophobicContact CD1-CB 4.18Å; L618-F630 HydrophobicContact CD1-CD2 3.83Å; L618-F630 HydrophobicContact CD1-CE2 4.49Å; L618-F630 HydrophobicContact CD1-CG 4.22Å; L618-F630 HydrophobicContact CG-CD2 4.39Å; L618-P657 VanDerWaalsContact O-CB 3.24Å; L618-P657 WeakPolarHBondContact O-CB 3.43Å; L618-L658 HydrophobicContact CB-CB 4.13Å; L618-L658 HydrophobicContact CD2-CB 4.48Å; L618-L658 HydrophobicContact CD2-CD1 4.06Å; L618-L658 HydrophobicContact CD2-CG 4.46Å; L618-L658 PolarHBondContact N-O 2.92Å
619	R	82.3	Confident	82.1	Confident	74 Å²	74	58.5 Å²	58.5	28%	0.279	31%	0.306	S	S	.	.			trans	-67.7	153.7	177.4	-60.4	-161.8	-46.5	-120.9	-2.6	111.6	E579 F582 D621 A622	E579-R619 IonicContact OE1-NH1 2.92Å; E579-R619 PolarHBondContact OE1-NH1 2.89Å; F582-R619 PolarHBondContact O-N 3.15Å; R619-D621 VanDerWaalsContact C-N 3.26Å; R619-D621 WeakPolarHBondContact CB-OD1 3.36Å; R619-D621 IonicContact CZ-OD1 2.84Å; R619-D621 IonicContact CZ-OD2 2.74Å; R619-D621 IonicContact NE-OD1 3.79Å; R619-D621 PolarHBondContact NE-OD1 3.37Å; R619-D621 IonicContact NE-OD2 3.68Å; R619-D621 IonicContact NH2-OD1 3.95Å; R619-D621 PolarHBondContact NH2-OD1 2.81Å; R619-D621 IonicContact NH2-OD2 3.67Å; R619-D621 PolarHBondContact NH2-OD2 3.46Å; R619-D621 PolarHBondContact O-N 2.61Å; R619-A622 WeakPolarHBondContact O-CB 3.39Å; R619-A622 PolarHBondContact O-N 3.4Å; R619-A622 VanDerWaalsContact O-N 3.16Å
620	S	79.3	Confident	82.4	Confident	128 Å²	128	53.8 Å²	53.8	90%	0.895	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-15.6	179.4	49.1	0	0	0	0	114.6
621	D	78	Confident	82.5	Confident	102 Å²	102	54.1 Å²	54.1	55%	0.545	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-3.9	172.4	71.4	-41.8	0	0	0	113.4	R619 N623	R619-D621 VanDerWaalsContact C-N 3.26Å; R619-D621 WeakPolarHBondContact CB-OD1 3.36Å; R619-D621 IonicContact CZ-OD1 2.84Å; R619-D621 IonicContact CZ-OD2 2.74Å; R619-D621 IonicContact NE-OD1 3.79Å; R619-D621 PolarHBondContact NE-OD1 3.37Å; R619-D621 IonicContact NE-OD2 3.68Å; R619-D621 IonicContact NH2-OD1 3.95Å; R619-D621 PolarHBondContact NH2-OD1 2.81Å; R619-D621 IonicContact NH2-OD2 3.67Å; R619-D621 PolarHBondContact NH2-OD2 3.46Å; R619-D621 PolarHBondContact O-N 2.61Å; D621-N623 PolarHBondContact O-N 2.81Å
622	A	75.7	Confident	82.1	Confident	24 Å²	24	59.3 Å²	59.3	20%	0.198	30%	0.304	C	S	.	.			trans	-62.9	130.3	-174.2	0	0	0	0	0	112.3	L618 R619 A626	L618-A622 HydrophobicContact CD1-CB 3.72Å; L618-A622 HydrophobicContact CD2-CB 4.01Å; L618-A622 HydrophobicContact CG-CB 3.65Å; R619-A622 WeakPolarHBondContact O-CB 3.39Å; R619-A622 PolarHBondContact O-N 3.4Å; R619-A622 VanDerWaalsContact O-N 3.16Å; A622-A626 HydrophobicContact CB-CB 4.31Å
623	N	75.6	Confident	81.6	Confident	83 Å²	83	56 Å²	56	44%	0.444	29%	0.287	S	S	.	.			trans	-68.7	165.5	179.8	71.8	53.9	0	0	0	112.3	D621 N625 A626 R627	D621-N623 PolarHBondContact O-N 2.81Å; N623-N625 PolarHBondContact O-N 2.99Å; N623-N625 VanDerWaalsContact O-N 3.15Å; N623-N625 WeakPolarHBondContact OD1-CA 3.29Å; N623-N625 WeakPolarHBondContact OD1-CB 3.47Å; N623-N625 PolarHBondContact OD1-N 3.3Å; N623-A626 PolarHBondContact O-N 2.85Å; N623-A626 PolarHBondContact OD1-N 2.93Å; N623-R627 PolarHBondContact O-N 3.33Å
624	K	79.4	Confident	81.1	Confident	176 Å²	176	56.5 Å²	56.5	77%	0.765	29%	0.289	S	S	*	.	H	α-helix	trans	-57.8	-30	-177.6	-67.5	-175.5	178.3	-178.9	0	113.8	N628	K624-N628 WeakPolarHBondContact O-CB 3.36Å; K624-N628 PolarHBondContact O-N 2.88Å; K624-N628 PolarHBondContact O-ND2 3.06Å
625	N	72.6	Confident	80.7	Confident	111 Å²	111	61.5 Å²	61.5	59%	0.594	31%	0.309	S	S	*	.	H	α-helix	trans	-73.4	-48.9	179.1	-60.2	-5	0	0	0	110	N623 R627 N628 D629	N623-N625 PolarHBondContact O-N 2.99Å; N623-N625 VanDerWaalsContact O-N 3.15Å; N623-N625 WeakPolarHBondContact OD1-CA 3.29Å; N623-N625 WeakPolarHBondContact OD1-CB 3.47Å; N623-N625 PolarHBondContact OD1-N 3.3Å; N625-R627 VanDerWaalsContact C-N 3.27Å; N625-R627 PolarHBondContact O-N 2.82Å; N625-N628 CarbonylContact O-C 3.56Å; N625-N628 WeakPolarHBondContact O-CB 3.46Å; N625-N628 PolarHBondContact O-N 2.92Å; N625-D629 VanDerWaalsContact O-CG 3.28Å; N625-D629 PolarHBondContact O-N 3.45Å
626	A	70.6	Confident	80.1	Confident	6 Å²	6	62.9 Å²	62.9	5%	0.05	32%	0.316	C	S	.	.	H	α-helix	trans	-57.6	-38.2	174.2	0	0	0	0	0	112.4	F582 A622 N623 D629 F630	F582-A626 HydrophobicContact CB-CB 3.98Å; F582-A626 HydrophobicContact CD1-CB 4.09Å; F582-A626 HydrophobicContact CD2-CB 3.88Å; F582-A626 HydrophobicContact CE2-CB 4.42Å; F582-A626 HydrophobicContact CG-CB 3.71Å; A622-A626 HydrophobicContact CB-CB 4.31Å; N623-A626 PolarHBondContact O-N 2.85Å; N623-A626 PolarHBondContact OD1-N 2.93Å; A626-D629 PolarHBondContact O-N 2.67Å; A626-F630 WeakPolarHBondContact O-CB 3.28Å; A626-F630 PolarHBondContact O-N 2.76Å
627	R	81.5	Confident	79.8	Confident	83 Å²	83	63 Å²	63	31%	0.313	32%	0.317	S	S	.	.	H	α-helix	trans	-63.5	-44.4	172.6	-166.9	-174.3	-175.3	101.8	5.7	112.5	L618 N623 N625 L631 D656 L658	L618-R627 HydrophobicContact CD2-CB 3.92Å; L618-R627 HydrophobicContact CD2-CG 3.88Å; N623-R627 PolarHBondContact O-N 3.33Å; N625-R627 VanDerWaalsContact C-N 3.27Å; N625-R627 PolarHBondContact O-N 2.82Å; R627-L631 WeakPolarHBondContact O-CG 3.02Å; R627-L631 PolarHBondContact O-N 2.91Å; R627-L631 VanDerWaalsContact O-N 3.14Å; R627-D656 IonicContact CZ-OD1 3.54Å; R627-D656 VanDerWaalsContact CZ-OD1 3.22Å; R627-D656 IonicContact CZ-OD2 2.7Å; R627-D656 IonicContact NH1-OD1 2.7Å; R627-D656 PolarHBondContact NH1-OD1 3.18Å; R627-D656 IonicContact NH1-OD2 2.85Å; R627-D656 PolarHBondContact NH1-OD2 3.29Å; R627-D656 IonicContact NH2-OD1 3.24Å; R627-D656 PolarHBondContact NH2-OD1 3.01Å; R627-D656 IonicContact NH2-OD2 3.57Å; R627-L658 HydrophobicContact CG-CD1 3.69Å
628	N	78.2	Confident	79.6	Confident	86 Å²	86	61.6 Å²	61.6	46%	0.46	31%	0.312	S	S	.	.	H	α-helix	trans	-65.7	-38.8	176.9	-72.9	-16.1	0	0	0	111.9	K624 N625 L631 K632	K624-N628 WeakPolarHBondContact O-CB 3.36Å; K624-N628 PolarHBondContact O-N 2.88Å; K624-N628 PolarHBondContact O-ND2 3.06Å; N625-N628 CarbonylContact O-C 3.56Å; N625-N628 WeakPolarHBondContact O-CB 3.46Å; N625-N628 PolarHBondContact O-N 2.92Å; N628-L631 PolarHBondContact O-N 2.99Å; N628-K632 WeakPolarHBondContact O-CG 3.49Å; N628-K632 PolarHBondContact O-N 2.74Å
629	D	73.8	Confident	79.3	Confident	21 Å²	21	64.5 Å²	64.5	11%	0.112	32%	0.322	C	S	.	.	H	α-helix	trans	-69.6	-39.1	179.1	-64.5	-26.1	0	0	0	111.6	N625 A626 L631 K632 E633	N625-D629 VanDerWaalsContact O-CG 3.28Å; N625-D629 PolarHBondContact O-N 3.45Å; A626-D629 PolarHBondContact O-N 2.67Å; D629-L631 VanDerWaalsContact C-N 3.3Å; D629-L631 PolarHBondContact O-N 2.69Å; D629-K632 WeakPolarHBondContact O-CB 3.23Å; D629-K632 PolarHBondContact O-N 2.62Å; D629-K632 VanDerWaalsContact O-N 3.12Å; D629-K632 WeakPolarHBondContact OD1-CE 3.19Å; D629-K632 IonicContact OD1-NZ 3.83Å; D629-K632 PolarHBondContact OD1-NZ 3.5Å; D629-E633 PolarHBondContact O-N 2.81Å
630	F	81.4	Confident	79.5	Confident	10 Å²	10	61.9 Å²	61.9	4%	0.044	31%	0.313	C	S	.	.	H	α-helix	trans	-58.3	-40.5	170	-166.7	-83.5	0	0	0	112.1	K616 L618 A626 E633 I634 L658 M660	K616-F630 HydrophobicContact CG-CE2 4.19Å; K616-F630 WeakPolarHBondContact O-CZ 3.38Å; L618-F630 HydrophobicContact CB-CD2 3.91Å; L618-F630 HydrophobicContact CB-CE2 3.84Å; L618-F630 HydrophobicContact CB-CG 4.31Å; L618-F630 HydrophobicContact CB-CZ 4.18Å; L618-F630 HydrophobicContact CD1-CB 4.18Å; L618-F630 HydrophobicContact CD1-CD2 3.83Å; L618-F630 HydrophobicContact CD1-CE2 4.49Å; L618-F630 HydrophobicContact CD1-CG 4.22Å; L618-F630 HydrophobicContact CG-CD2 4.39Å; A626-F630 WeakPolarHBondContact O-CB 3.28Å; A626-F630 PolarHBondContact O-N 2.76Å; F630-E633 WeakPolarHBondContact O-CB 3.48Å; F630-E633 PolarHBondContact O-N 2.78Å; F630-I634 HydrophobicContact CD1-CD1 4.03Å; F630-I634 HydrophobicContact CE1-CD1 3.98Å; F630-I634 PolarHBondContact O-N 3.41Å; F630-I634 VanDerWaalsContact O-N 3.1Å; F630-L658 HydrophobicContact CD1-CB 3.97Å; F630-L658 HydrophobicContact CD1-CD1 4.24Å; F630-L658 HydrophobicContact CE1-CB 3.62Å; F630-L658 HydrophobicContact CZ-CB 4.29Å; F630-L658 WeakPolarHBondContact CZ-O 3.32Å; F630-M660 HydrophobicContact CD1-CE 4.45Å; F630-M660 HydrophobicContact CD2-CE 3.96Å; F630-M660 HydrophobicContact CE1-CE 4.16Å; F630-M660 HydrophobicContact CE1-CG 3.83Å; F630-M660 HydrophobicContact CE1-SD 4.49Å; F630-M660 HydrophobicContact CE2-CE 3.66Å; F630-M660 HydrophobicContact CG-CE 4.36Å; F630-M660 HydrophobicContact CZ-CE 3.76Å; F630-M660 HydrophobicContact CZ-CG 3.91Å
631	L	83.2	Confident	79.9	Confident	59 Å²	59	62.1 Å²	62.1	31%	0.309	30%	0.298	S	S	.	.	H	α-helix	trans	-71.4	-28.9	175.3	-68.8	168.4	0	0	0	113.1	R627 N628 D629 I634 K635 I653 L658	R627-L631 WeakPolarHBondContact O-CG 3.02Å; R627-L631 PolarHBondContact O-N 2.91Å; R627-L631 VanDerWaalsContact O-N 3.14Å; N628-L631 PolarHBondContact O-N 2.99Å; D629-L631 VanDerWaalsContact C-N 3.3Å; D629-L631 PolarHBondContact O-N 2.69Å; L631-I634 HydrophobicContact CD2-CD1 4.34Å; L631-K635 WeakPolarHBondContact O-CG 3.43Å; L631-K635 PolarHBondContact O-N 2.9Å; L631-I653 HydrophobicContact CD2-CG2 4.32Å; L631-L658 HydrophobicContact CD2-CD1 4.16Å; L631-L658 HydrophobicContact CG-CD1 4.21Å
632	K	79.6	Confident	80.6	Confident	117 Å²	117	58.3 Å²	58.3	51%	0.509	28%	0.278	S	S	.	.	H	α-helix	trans	-68.1	-42.8	168.7	-66.6	168.8	-163.5	164.5	0	110.9	N628 D629 I634 K635 I636	N628-K632 WeakPolarHBondContact O-CG 3.49Å; N628-K632 PolarHBondContact O-N 2.74Å; D629-K632 WeakPolarHBondContact O-CB 3.23Å; D629-K632 PolarHBondContact O-N 2.62Å; D629-K632 VanDerWaalsContact O-N 3.12Å; D629-K632 WeakPolarHBondContact OD1-CE 3.19Å; D629-K632 IonicContact OD1-NZ 3.83Å; D629-K632 PolarHBondContact OD1-NZ 3.5Å; K632-I634 VanDerWaalsContact C-N 3.35Å; K632-I634 PolarHBondContact O-N 3.35Å; K632-K635 PolarHBondContact O-N 3.08Å; K632-K635 VanDerWaalsContact O-N 3.09Å; K632-I636 WeakPolarHBondContact O-CG1 3.08Å; K632-I636 PolarHBondContact O-N 3.43Å
633	E	80.7	Confident	81.4	Confident	13 Å²	13	61.2 Å²	61.2	6%	0.061	30%	0.295	C	S	.	.	H	α-helix	trans	-57.3	-47.4	178.4	-152.7	-172.3	131.1	0	0	110.6	K616 D629 F630 K635 I636 M637 M660	K616-E633 IonicContact NZ-OE1 3.48Å; K616-E633 PolarHBondContact NZ-OE1 3.36Å; K616-E633 IonicContact NZ-OE2 2.71Å; K616-E633 PolarHBondContact NZ-OE2 2.93Å; D629-E633 PolarHBondContact O-N 2.81Å; F630-E633 WeakPolarHBondContact O-CB 3.48Å; F630-E633 PolarHBondContact O-N 2.78Å; E633-K635 PolarHBondContact O-N 2.95Å; E633-I636 PolarHBondContact O-N 2.79Å; E633-I636 VanDerWaalsContact O-N 3.15Å; E633-M637 HydrophobicContact CG-CG 4.5Å; E633-M637 HydrophobicContact CG-SD 4.17Å; E633-M637 WeakPolarHBondContact O-CG 3.37Å; E633-M637 PolarHBondContact O-N 2.85Å; E633-M660 HydrophobicContact CB-CE 4.44Å; E633-M660 HydrophobicContact CB-SD 4.34Å; E633-M660 HydrophobicContact CG-CE 4.42Å; E633-M660 WeakPolarHBondContact OE1-CE 3.32Å
634	I	83.2	Confident	82.3	Confident	9 Å²	9	58 Å²	58	5%	0.046	28%	0.278	C	S	.	.	H	α-helix	trans	-52.3	-50.3	171.3	-72.3	172.8	0	0	0	112.1	V563 F630 L631 K632 I636 M637 S638 L648 V651 I653 M660	V563-I634 HydrophobicContact CG2-CG2 4.47Å; F630-I634 HydrophobicContact CD1-CD1 4.03Å; F630-I634 HydrophobicContact CE1-CD1 3.98Å; F630-I634 PolarHBondContact O-N 3.41Å; F630-I634 VanDerWaalsContact O-N 3.1Å; L631-I634 HydrophobicContact CD2-CD1 4.34Å; K632-I634 VanDerWaalsContact C-N 3.35Å; K632-I634 PolarHBondContact O-N 3.35Å; I634-I636 PolarHBondContact O-N 3.44Å; I634-M637 PolarHBondContact O-N 2.84Å; I634-S638 WeakPolarHBondContact O-CB 3.18Å; I634-S638 PolarHBondContact O-N 2.83Å; I634-S638 PolarHBondContact O-OG 3.1Å; I634-L648 HydrophobicContact CG2-CD2 4.45Å; I634-V651 HydrophobicContact CD1-CG1 3.98Å; I634-V651 HydrophobicContact CG1-CG1 4.09Å; I634-V651 HydrophobicContact CG2-CG1 3.99Å; I634-I653 HydrophobicContact CD1-CG2 3.71Å; I634-M660 HydrophobicContact CD1-CG 3.85Å; I634-M660 HydrophobicContact CD1-SD 4.39Å; I634-M660 HydrophobicContact CG1-CG 3.43Å; I634-M660 VanDerWaalsContact CG1-CG 3.43Å; I634-M660 HydrophobicContact CG1-SD 3.45Å; I634-M660 WeakPolarHBondContact CG1-SD 3.48Å
635	K	82.3	Confident	83	Confident	116 Å²	116	49.9 Å²	49.9	50%	0.504	24%	0.242	S	C	.	.	H	α-helix	trans	-67.7	-21.3	-177.5	-74.5	-170.2	177.2	-154.7	0	113.9	L631 K632 E633 R639	L631-K635 WeakPolarHBondContact O-CG 3.43Å; L631-K635 PolarHBondContact O-N 2.9Å; K632-K635 PolarHBondContact O-N 3.08Å; K632-K635 VanDerWaalsContact O-N 3.09Å; E633-K635 PolarHBondContact O-N 2.95Å; K635-R639 VanDerWaalsContact O-CD 3.29Å; K635-R639 WeakPolarHBondContact O-CD 3.12Å; K635-R639 PolarHBondContact O-NE 2.91Å
636	I	80.6	Confident	83.9	Confident	30 Å²	30	45 Å²	45	15%	0.154	22%	0.216	C	C	.	.	H	α-helix	trans	-81.9	-57.1	172	-70.4	166.3	0	0	0	109.2	T545 K632 E633 I634 S638 R639 L640 F716	T545-I636 HydrophobicContact CG2-CD1 4.22Å; K632-I636 WeakPolarHBondContact O-CG1 3.08Å; K632-I636 PolarHBondContact O-N 3.43Å; E633-I636 PolarHBondContact O-N 2.79Å; E633-I636 VanDerWaalsContact O-N 3.15Å; I634-I636 PolarHBondContact O-N 3.44Å; I636-S638 VanDerWaalsContact C-N 3.29Å; I636-S638 PolarHBondContact O-N 2.86Å; I636-R639 WeakPolarHBondContact O-CB 3.46Å; I636-R639 PolarHBondContact O-N 2.78Å; I636-L640 HydrophobicContact CG2-CD1 4.2Å; I636-F716 HydrophobicContact CG2-CE2 3.52Å; I636-F716 HydrophobicContact CG2-CZ 3.63Å
637	M	83.1	Confident	84.8	Confident	20 Å²	20	46.8 Å²	46.8	10%	0.099	22%	0.222	C	C	.	.	H	α-helix	trans	-62.3	-32.2	-173.2	-64.8	-178.7	75.6	0	0	113.4	E633 I634 R639 L640 I646 L648 M660 T662	E633-M637 HydrophobicContact CG-CG 4.5Å; E633-M637 HydrophobicContact CG-SD 4.17Å; E633-M637 WeakPolarHBondContact O-CG 3.37Å; E633-M637 PolarHBondContact O-N 2.85Å; I634-M637 PolarHBondContact O-N 2.84Å; M637-R639 PolarHBondContact O-N 3.2Å; M637-R639 VanDerWaalsContact O-N 3.12Å; M637-L640 PolarHBondContact O-N 2.88Å; M637-L640 VanDerWaalsContact O-N 3.12Å; M637-I646 HydrophobicContact CE-CG2 3.82Å; M637-L648 HydrophobicContact CB-CB 3.87Å; M637-L648 HydrophobicContact CB-CD2 4.17Å; M637-M660 HydrophobicContact SD-SD 4.09Å; M637-T662 HydrophobicContact CE-CG2 3.79Å
638	S	83.3	Confident	85.1	Confident	15 Å²	15	43.6 Å²	43.6	11%	0.105	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-17.6	176.6	66.5	0	0	0	0	114.7	V563 I634 I636	V563-S638 VanDerWaalsContact CG2-CB 3.4Å; I634-S638 WeakPolarHBondContact O-CB 3.18Å; I634-S638 PolarHBondContact O-N 2.83Å; I634-S638 PolarHBondContact O-OG 3.1Å; I636-S638 VanDerWaalsContact C-N 3.29Å; I636-S638 PolarHBondContact O-N 2.86Å
639	R	81.4	Confident	85.6	Confident	72 Å²	72	40.5 Å²	40.5	27%	0.272	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-17.3	178.8	-60.2	170	180	-97.2	-1.3	112.6	L555 G558 V561 K635 I636 M637 K641 Y710	L555-R639 PolarHBondContact O-NH1 3.44Å; L555-R639 PolarHBondContact O-NH2 2.87Å; L555-R639 VanDerWaalsContact O-NH2 3.08Å; G558-R639 PolarHBondContact O-NH2 2.79Å; V561-R639 HydrophobicContact CG2-CG 4.3Å; K635-R639 VanDerWaalsContact O-CD 3.29Å; K635-R639 WeakPolarHBondContact O-CD 3.12Å; K635-R639 PolarHBondContact O-NE 2.91Å; I636-R639 WeakPolarHBondContact O-CB 3.46Å; I636-R639 PolarHBondContact O-N 2.78Å; M637-R639 PolarHBondContact O-N 3.2Å; M637-R639 VanDerWaalsContact O-N 3.12Å; R639-K641 PolarHBondContact O-N 3.01Å; R639-Y710 PolarHBondContact O-OH 3.34Å
640	L	86.3	Confident	86.4	Confident	19 Å²	19	39.5 Å²	39.5	10%	0.099	19%	0.189	C	C	.	.			trans	-84.9	113.7	-177.9	-57.7	-178.4	0	0	0	110.2	I636 M637 I645 Y710 L711 L714	I636-L640 HydrophobicContact CG2-CD1 4.2Å; M637-L640 PolarHBondContact O-N 2.88Å; M637-L640 VanDerWaalsContact O-N 3.12Å; L640-I645 HydrophobicContact CB-CG2 4Å; L640-I645 HydrophobicContact CD1-CG2 4.09Å; L640-Y710 HydrophobicContact CD2-CE1 4.2Å; L640-L711 HydrophobicContact CD1-CD2 4.31Å; L640-L711 HydrophobicContact CD2-CD2 3.8Å; L640-L714 HydrophobicContact CD2-CD1 3.93Å
641	K	87.8	Confident	86.9	Confident	132 Å²	132	39 Å²	39	57%	0.574	19%	0.187	S	C	*	.			trans	-140.5	84.3	-174.5	-63.3	-171.1	179.4	-169.6	0	109.9	R639 Y710	R639-K641 PolarHBondContact O-N 3.01Å; K641-Y710 PolarHBondContact N-OH 2.83Å; K641-Y710 PolarHBondContact O-OH 2.86Å
642	D	92.1	Very high	87.3	Confident	23 Å²	23	36.2 Å²	36.2	12%	0.123	17%	0.172	C	C	.	.			trans	-144.5	149.7	176	179.4	-90.1	0	0	0	109.1	N644 I645 Y710	D642-N644 VanDerWaalsContact C-N 3.25Å; D642-N644 PolarHBondContact O-N 2.86Å; D642-N644 WeakPolarHBondContact OD1-CA 3.29Å; D642-N644 PolarHBondContact OD1-N 3.45Å; D642-I645 HydrophobicContact CB-CB 4.31Å; D642-I645 HydrophobicContact CB-CG1 3.99Å; D642-I645 PolarHBondContact O-N 2.96Å; D642-Y710 HydrophobicContact CB-CD1 3.56Å; D642-Y710 HydrophobicContact CB-CD2 3.76Å; D642-Y710 HydrophobicContact CB-CE1 3.87Å; D642-Y710 HydrophobicContact CB-CE2 4.06Å; D642-Y710 HydrophobicContact CB-CG 3.5Å; D642-Y710 VanDerWaalsContact CB-CG 3.5Å
643	P	92.2	Very high	87.8	Confident	85 Å²	85	33.6 Å²	33.6	55%	0.552	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-34.8	178.8	-26.7	36.6	0	0	0	114.1	K735	P643-K735 WeakPolarHBondContact O-CE 3.45Å; P643-K735 WeakPolarHBondContact O-CG 3.41Å; P643-K735 PolarHBondContact O-NZ 2.93Å
644	N	95.7	Very high	87.8	Confident	16 Å²	16	42.5 Å²	42.5	9%	0.086	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	15.3	-174	-61.1	122.6	0	0	0	113.9	D642 Q703 S706 I734 K735 I736	D642-N644 VanDerWaalsContact C-N 3.25Å; D642-N644 PolarHBondContact O-N 2.86Å; D642-N644 WeakPolarHBondContact OD1-CA 3.29Å; D642-N644 PolarHBondContact OD1-N 3.45Å; N644-Q703 WeakPolarHBondContact CB-O 3.39Å; N644-Q703 WeakPolarHBondContact ND2-CB 3.33Å; N644-Q703 WeakPolarHBondContact ND2-CG 3.43Å; N644-Q703 PolarHBondContact ND2-OE1 2.91Å; N644-Q703 VanDerWaalsContact ND2-OE1 3.12Å; N644-S706 WeakPolarHBondContact OD1-CB 3.4Å; N644-S706 PolarHBondContact OD1-OG 2.89Å; N644-I734 WeakPolarHBondContact CA-O 3.07Å; N644-I734 PolarHBondContact ND2-O 3.45Å; N644-K735 WeakPolarHBondContact O-CA 3.34Å; N644-I736 PolarHBondContact O-N 2.76Å
645	I	93.4	Very high	87.7	Confident	5 Å²	5	44.8 Å²	44.8	3%	0.026	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-115.2	147.2	167.1	-57.4	-60.3	0	0	0	108.6	L640 D642 R647 Y710 L711 I736	L640-I645 HydrophobicContact CB-CG2 4Å; L640-I645 HydrophobicContact CD1-CG2 4.09Å; D642-I645 HydrophobicContact CB-CB 4.31Å; D642-I645 HydrophobicContact CB-CG1 3.99Å; D642-I645 PolarHBondContact O-N 2.96Å; I645-R647 PolarHBondContact O-N 2.86Å; I645-Y710 HydrophobicContact CG1-CD1 3.98Å; I645-L711 HydrophobicContact CD1-CD1 3.8Å; I645-L711 HydrophobicContact CD1-CD2 4.05Å; I645-L711 HydrophobicContact CD1-CG 3.77Å; I645-L711 HydrophobicContact CG1-CD2 4.25Å; I645-L711 HydrophobicContact CG1-CG 4.38Å; I645-I736 HydrophobicContact CD1-CB 3.92Å; I645-I736 HydrophobicContact CD1-CD1 4.12Å; I645-I736 HydrophobicContact CD1-CG1 4.28Å
646	I	91.4	Very high	87.9	Confident	7 Å²	7	43.8 Å²	43.8	4%	0.036	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-65.1	126.4	177.4	-166.5	70.8	0	0	0	111.2	M637 T662 E663 M665 L727 K735 I736 A737 F739	M637-I646 HydrophobicContact CE-CG2 3.82Å; I646-T662 HydrophobicContact CG1-CG2 4.29Å; I646-E663 HydrophobicContact CD1-CG 3.52Å; I646-E663 HydrophobicContact CG1-CG 4.44Å; I646-M665 HydrophobicContact CD1-CG 4.26Å; I646-L727 HydrophobicContact CD1-CD1 4.37Å; I646-K735 HydrophobicContact CD1-CD 4.28Å; I646-I736 PolarHBondContact N-O 2.91Å; I646-A737 HydrophobicContact CB-CB 3.97Å; I646-A737 HydrophobicContact CG2-CB 3.52Å; I646-F739 HydrophobicContact CG1-CZ 4.28Å
647	R	88.5	Confident	88.3	Confident	45 Å²	45	44.8 Å²	44.8	17%	0.17	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-83.9	123.3	-179.4	-172	84.7	72.7	70.4	3.3	110.9	Y601 I645 L649 T662 E663	Y601-R647 VanDerWaalsContact CG-NH2 3.29Å; I645-R647 PolarHBondContact O-N 2.86Å; R647-L649 HydrophobicContact CB-CD2 4.2Å; R647-L649 HydrophobicContact CG-CD2 3.6Å; R647-T662 VanDerWaalsContact O-CA 3.28Å; R647-T662 WeakPolarHBondContact O-CA 3.28Å; R647-T662 VanDerWaalsContact O-CB 3.29Å; R647-T662 WeakPolarHBondContact O-CB 3.34Å; R647-E663 HydrophobicContact CB-CG 4.41Å; R647-E663 WeakPolarHBondContact CB-OE1 3.1Å; R647-E663 PolarHBondContact N-OE1 2.99Å; R647-E663 PolarHBondContact O-N 2.87Å
648	L	89.8	Confident	88.6	Confident	16 Å²	16	44 Å²	44	8%	0.084	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	121.3	156.4	-177.8	71.1	0	0	0	108.4	V563 I634 M637 V651 M660	V563-L648 HydrophobicContact CG1-CD2 4.09Å; I634-L648 HydrophobicContact CG2-CD2 4.45Å; M637-L648 HydrophobicContact CB-CB 3.87Å; M637-L648 HydrophobicContact CB-CD2 4.17Å; L648-V651 HydrophobicContact CD1-CG1 4.14Å; L648-V651 HydrophobicContact CD2-CG1 4.1Å; L648-M660 HydrophobicContact CD1-CB 3.83Å; L648-M660 HydrophobicContact CD1-CG 4.32Å
649	L	88.5	Confident	89	Confident	21 Å²	21	43.3 Å²	43.3	11%	0.11	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-51.9	179.7	-54.3	175.1	0	0	0	110.7	M593 I597 V613 R647 I661 E663	M593-L649 HydrophobicContact CE-CB 3.36Å; M593-L649 HydrophobicContact CE-CD1 3.98Å; M593-L649 HydrophobicContact CE-CG 4.29Å; I597-L649 HydrophobicContact CG1-CD2 4.48Å; V613-L649 HydrophobicContact CG1-CD1 4.11Å; R647-L649 HydrophobicContact CB-CD2 4.2Å; R647-L649 HydrophobicContact CG-CD2 3.6Å; L649-I661 WeakPolarHBondContact CB-O 3.22Å; L649-I661 PolarHBondContact N-O 2.92Å; L649-E663 HydrophobicContact CD1-CB 4.32Å
650	A	90.3	Very high	89.4	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	177.7	179.9	0	0	0	0	0	111.5	F566 M593 F596 I661	F566-A650 HydrophobicContact CB-CB 3.85Å; M593-A650 HydrophobicContact CE-CB 4.06Å; F596-A650 HydrophobicContact CD1-CB 4.34Å; A650-I661 HydrophobicContact CB-CD1 4.23Å; A650-I661 PolarHBondContact N-O 2.98Å; A650-I661 WeakPolarHBondContact O-CB 3.37Å; A650-I661 PolarHBondContact O-N 3.04Å
651	V	92.4	Very high	89.6	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	166.4	179.7	-66.2	0	0	0	0	112.5	V563 E564 E565 F566 I634 L648 I653 C659	V563-V651 HydrophobicContact CB-CG2 4.19Å; V563-V651 HydrophobicContact CG1-CB 4.47Å; V563-V651 HydrophobicContact CG1-CG1 3.87Å; V563-V651 HydrophobicContact CG1-CG2 3.92Å; E564-V651 PolarHBondContact O-N 3.16Å; E565-V651 CarbonylContact C-O 3.06Å; E565-V651 WeakPolarHBondContact CA-O 3.19Å; F566-V651 PolarHBondContact N-O 2.9Å; I634-V651 HydrophobicContact CD1-CG1 3.98Å; I634-V651 HydrophobicContact CG1-CG1 4.09Å; I634-V651 HydrophobicContact CG2-CG1 3.99Å; L648-V651 HydrophobicContact CD1-CG1 4.14Å; L648-V651 HydrophobicContact CD2-CG1 4.1Å; V651-I653 HydrophobicContact CB-CG2 4.15Å; V651-I653 HydrophobicContact CG2-CD1 4.38Å; V651-I653 HydrophobicContact CG2-CG1 4.13Å; V651-I653 HydrophobicContact CG2-CG2 4.2Å; V651-C659 WeakPolarHBondContact CA-O 3.47Å; V651-C659 WeakPolarHBondContact CB-O 3.5Å
652	C	91.3	Very high	89.8	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	103.5	161.4	-51.8	0	0	0	0	108.8	E565 F566 L658 C659	E565-C652 WeakPolarHBondContact OE2-CA 3.4Å; F566-C652 PolarHBondContact O-SG 3.41Å; C652-L658 WeakPolarHBondContact O-CA 3.26Å; C652-C659 HydrophobicContact CB-CB 3.87Å; C652-C659 PolarHBondContact N-O 3.38Å; C652-C659 PolarHBondContact O-N 3.45Å
653	I	88.4	Confident	89.7	Confident	62 Å²	62	32.7 Å²	32.7	32%	0.318	17%	0.168	S	C	.	.			trans	-125	-14.4	-173.1	58.8	167.8	0	0	0	115.5	E565 L631 I634 V651 S655 L658	E565-I653 VanDerWaalsContact CD-N 3.31Å; E565-I653 PolarHBondContact OE1-N 2.04Å; E565-I653 VanDerWaalsContact OE1-N 3.08Å; E565-I653 VanDerWaalsContact OE2-CG1 3.31Å; E565-I653 WeakPolarHBondContact OE2-CG1 3.45Å; E565-I653 PolarHBondContact OE2-N 3.05Å; L631-I653 HydrophobicContact CD2-CG2 4.32Å; I634-I653 HydrophobicContact CD1-CG2 3.71Å; V651-I653 HydrophobicContact CB-CG2 4.15Å; V651-I653 HydrophobicContact CG2-CD1 4.38Å; V651-I653 HydrophobicContact CG2-CG1 4.13Å; V651-I653 HydrophobicContact CG2-CG2 4.2Å; I653-S655 VanDerWaalsContact C-N 3.28Å; I653-S655 PolarHBondContact O-N 2.74Å; I653-L658 HydrophobicContact CB-CD2 4.21Å; I653-L658 HydrophobicContact CG2-CD2 4.27Å
654	Y	82.6	Confident	89.6	Confident	199 Å²	199	31.8 Å²	31.8	78%	0.78	16%	0.155	S	C	*	.	S	Bend	trans	-78.2	-12.3	176.9	-64.5	-56.9	0	0	0	113.9	E565	E565-Y654 HydrophobicContact CB-CD2 4Å; E565-Y654 HydrophobicContact CB-CE2 3.78Å; E565-Y654 HydrophobicContact CG-CD2 3.58Å; E565-Y654 HydrophobicContact CG-CE2 3.93Å; E565-Y654 WeakPolarHBondContact OE1-CD2 3.44Å; E565-Y654 PolarHBondContact OE1-N 3.24Å
655	S	81.2	Confident	89.4	Confident	57 Å²	57	31.6 Å²	31.6	40%	0.399	15%	0.153	S	C	.	.	S	Bend	trans	-141.7	146.5	179.4	55.9	0	0	0	0	110.6	R568 I653	R568-S655 PolarHBondContact NH2-O 2.87Å; I653-S655 VanDerWaalsContact C-N 3.28Å; I653-S655 PolarHBondContact O-N 2.74Å
656	D	84.9	Confident	89.1	Confident	96 Å²	96	35.9 Å²	35.9	51%	0.513	17%	0.173	S	C	.	.	S	Bend	trans	-80.3	151.7	173.5	-76.7	-15.9	0	0	0	111.7	R627	R627-D656 IonicContact CZ-OD1 3.54Å; R627-D656 VanDerWaalsContact CZ-OD1 3.22Å; R627-D656 IonicContact CZ-OD2 2.7Å; R627-D656 IonicContact NH1-OD1 2.7Å; R627-D656 PolarHBondContact NH1-OD1 3.18Å; R627-D656 IonicContact NH1-OD2 2.85Å; R627-D656 PolarHBondContact NH1-OD2 3.29Å; R627-D656 IonicContact NH2-OD1 3.24Å; R627-D656 PolarHBondContact NH2-OD1 3.01Å; R627-D656 IonicContact NH2-OD2 3.57Å
657	P	88.7	Confident	89.1	Confident	51 Å²	51	38.5 Å²	38.5	33%	0.331	19%	0.187	S	C	.	.	S	Bend	cis	-75	139.6	-2.7	30.2	-34.1	0	0	0	112.5	R568 M617 L618 C659	R568-P657 VanDerWaalsContact CZ-O 3.23Å; R568-P657 PolarHBondContact NH1-O 3.14Å; R568-P657 PolarHBondContact NH2-O 2.9Å; M617-P657 HydrophobicContact SD-CG 4.45Å; L618-P657 VanDerWaalsContact O-CB 3.24Å; L618-P657 WeakPolarHBondContact O-CB 3.43Å; P657-C659 PolarHBondContact O-N 2.74Å; P657-C659 PolarHBondContact O-SG 2.97Å
658	L	90.3	Very high	89.2	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.016	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-59.1	137.4	178.4	-61.5	-177.3	0	0	0	111.4	M617 L618 R627 F630 L631 C652 I653	M617-L658 WeakPolarHBondContact CA-O 3.41Å; L618-L658 HydrophobicContact CB-CB 4.13Å; L618-L658 HydrophobicContact CD2-CB 4.48Å; L618-L658 HydrophobicContact CD2-CD1 4.06Å; L618-L658 HydrophobicContact CD2-CG 4.46Å; L618-L658 PolarHBondContact N-O 2.92Å; R627-L658 HydrophobicContact CG-CD1 3.69Å; F630-L658 HydrophobicContact CD1-CB 3.97Å; F630-L658 HydrophobicContact CD1-CD1 4.24Å; F630-L658 HydrophobicContact CE1-CB 3.62Å; F630-L658 HydrophobicContact CZ-CB 4.29Å; F630-L658 WeakPolarHBondContact CZ-O 3.32Å; L631-L658 HydrophobicContact CD2-CD1 4.16Å; L631-L658 HydrophobicContact CG-CD1 4.21Å; C652-L658 WeakPolarHBondContact O-CA 3.26Å; I653-L658 HydrophobicContact CB-CD2 4.21Å; I653-L658 HydrophobicContact CG2-CD2 4.27Å
659	C	91.2	Very high	89.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	147.9	-179.4	-55.1	0	0	0	0	113.7	R568 V615 K616 M617 V651 C652 P657	R568-C659 PolarHBondContact NH1-SG 2.73Å; V615-C659 HydrophobicContact CG1-CB 3.98Å; K616-C659 CarbonylContact O-C 3.42Å; K616-C659 VanDerWaalsContact O-CA 3.28Å; K616-C659 WeakPolarHBondContact O-CA 3.13Å; M617-C659 HydrophobicContact CG-CB 4.44Å; M617-C659 VanDerWaalsContact CG-SG 3.54Å; V651-C659 WeakPolarHBondContact CA-O 3.47Å; V651-C659 WeakPolarHBondContact CB-O 3.5Å; C652-C659 HydrophobicContact CB-CB 3.87Å; C652-C659 PolarHBondContact N-O 3.38Å; C652-C659 PolarHBondContact O-N 3.45Å; P657-C659 PolarHBondContact O-N 2.74Å; P657-C659 PolarHBondContact O-SG 2.97Å
660	M	90.1	Very high	89.6	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	133.3	162.5	-62.1	-175.4	-79.5	0	0	108.7	V615 K616 F630 E633 I634 M637 L648	V615-M660 CarbonylContact C-O 3.58Å; V615-M660 WeakPolarHBondContact CA-O 3.41Å; K616-M660 HydrophobicContact CB-CB 4.35Å; K616-M660 HydrophobicContact CB-CE 4.22Å; K616-M660 HydrophobicContact CD-CE 3.62Å; K616-M660 HydrophobicContact CG-CE 3.93Å; K616-M660 PolarHBondContact N-O 3.1Å; K616-M660 PolarHBondContact O-N 2.91Å; F630-M660 HydrophobicContact CD1-CE 4.45Å; F630-M660 HydrophobicContact CD2-CE 3.96Å; F630-M660 HydrophobicContact CE1-CE 4.16Å; F630-M660 HydrophobicContact CE1-CG 3.83Å; F630-M660 HydrophobicContact CE1-SD 4.49Å; F630-M660 HydrophobicContact CE2-CE 3.66Å; F630-M660 HydrophobicContact CG-CE 4.36Å; F630-M660 HydrophobicContact CZ-CE 3.76Å; F630-M660 HydrophobicContact CZ-CG 3.91Å; E633-M660 HydrophobicContact CB-CE 4.44Å; E633-M660 HydrophobicContact CB-SD 4.34Å; E633-M660 HydrophobicContact CG-CE 4.42Å; E633-M660 WeakPolarHBondContact OE1-CE 3.32Å; I634-M660 HydrophobicContact CD1-CG 3.85Å; I634-M660 HydrophobicContact CD1-SD 4.39Å; I634-M660 HydrophobicContact CG1-CG 3.43Å; I634-M660 VanDerWaalsContact CG1-CG 3.43Å; I634-M660 HydrophobicContact CG1-SD 3.45Å; I634-M660 WeakPolarHBondContact CG1-SD 3.48Å; M637-M660 HydrophobicContact SD-SD 4.09Å; L648-M660 HydrophobicContact CD1-CB 3.83Å; L648-M660 HydrophobicContact CD1-CG 4.32Å
661	I	91.9	Very high	89.8	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	111.9	-179.5	-56.8	164.5	0	0	0	107.3	F566 L571 M593 V613 V615 L649 A650	F566-I661 HydrophobicContact CB-CD1 3.39Å; F566-I661 HydrophobicContact CD1-CD1 3.71Å; F566-I661 HydrophobicContact CG-CD1 3.64Å; L571-I661 HydrophobicContact CD1-CD1 4.13Å; L571-I661 HydrophobicContact CD1-CG1 4.47Å; L571-I661 HydrophobicContact CD2-CD1 4.19Å; M593-I661 HydrophobicContact CE-CG2 4.35Å; V613-I661 HydrophobicContact CB-CG2 3.71Å; V613-I661 HydrophobicContact CG1-CG2 3.96Å; V613-I661 HydrophobicContact CG2-CG2 3.8Å; V615-I661 HydrophobicContact CG1-CG1 4.33Å; V615-I661 HydrophobicContact CG2-CG1 4.33Å; L649-I661 WeakPolarHBondContact CB-O 3.22Å; L649-I661 PolarHBondContact N-O 2.92Å; A650-I661 HydrophobicContact CB-CD1 4.23Å; A650-I661 PolarHBondContact N-O 2.98Å; A650-I661 WeakPolarHBondContact O-CB 3.37Å; A650-I661 PolarHBondContact O-N 3.04Å
662	T	91.4	Very high	89.7	Confident	7 Å²	7	40.6 Å²	40.6	4%	0.043	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	166	173.3	67.4	0	0	0	0	110.6	V613 A614 M637 I646 R647	V613-T662 WeakPolarHBondContact CB-O 3.4Å; A614-T662 PolarHBondContact N-O 3Å; A614-T662 PolarHBondContact O-N 3.08Å; A614-T662 PolarHBondContact O-OG1 2.91Å; M637-T662 HydrophobicContact CE-CG2 3.79Å; I646-T662 HydrophobicContact CG1-CG2 4.29Å; R647-T662 VanDerWaalsContact O-CA 3.28Å; R647-T662 WeakPolarHBondContact O-CA 3.28Å; R647-T662 VanDerWaalsContact O-CB 3.29Å; R647-T662 WeakPolarHBondContact O-CB 3.34Å
663	E	88.6	Confident	89.9	Confident	15 Å²	15	41.3 Å²	41.3	7%	0.07	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	149.4	164	61.5	-167.5	140.3	0	0	111.9	Y601 I646 R647 L649 K735	Y601-E663 PolarHBondContact OH-OE2 3.15Å; I646-E663 HydrophobicContact CD1-CG 3.52Å; I646-E663 HydrophobicContact CG1-CG 4.44Å; R647-E663 HydrophobicContact CB-CG 4.41Å; R647-E663 WeakPolarHBondContact CB-OE1 3.1Å; R647-E663 PolarHBondContact N-OE1 2.99Å; R647-E663 PolarHBondContact O-N 2.87Å; L649-E663 HydrophobicContact CD1-CB 4.32Å; E663-K735 VanDerWaalsContact CD-NZ 3.29Å; E663-K735 HydrophobicContact CG-CD 4.4Å; E663-K735 WeakPolarHBondContact OE1-CD 3.28Å; E663-K735 WeakPolarHBondContact OE1-CE 3.44Å; E663-K735 IonicContact OE1-NZ 2.74Å; E663-K735 PolarHBondContact OE1-NZ 2.84Å; E663-K735 WeakPolarHBondContact OE2-CE 3.48Å; E663-K735 IonicContact OE2-NZ 2.73Å; E663-K735 PolarHBondContact OE2-NZ 2.76Å; E663-K735 VanDerWaalsContact OE2-NZ 3.12Å
664	Y	90.8	Very high	90.2	Very high	67 Å²	67	38.4 Å²	38.4	26%	0.263	20%	0.196	S	C	.	.			trans	-94	139.3	174.8	176.4	-119.6	0	0	0	111	L577 L587 L612 E666	L577-Y664 HydrophobicContact CD1-CD2 4.03Å; L577-Y664 HydrophobicContact CD1-CE2 3.8Å; L577-Y664 HydrophobicContact CD2-CE2 4.17Å; L587-Y664 HydrophobicContact CD1-CD1 3.85Å; L587-Y664 HydrophobicContact CD1-CD2 3.62Å; L587-Y664 HydrophobicContact CD1-CE1 4.03Å; L587-Y664 HydrophobicContact CD1-CE2 3.81Å; L587-Y664 HydrophobicContact CD1-CG 3.64Å; L587-Y664 HydrophobicContact CD2-CE1 4.38Å; L587-Y664 HydrophobicContact CD2-CE2 4.39Å; L612-Y664 HydrophobicContact CB-CD1 4.01Å; L612-Y664 HydrophobicContact CB-CG 4.49Å; L612-Y664 HydrophobicContact CD1-CD1 4.33Å; L612-Y664 HydrophobicContact CD1-CE1 4.49Å; L612-Y664 WeakPolarHBondContact O-CB 3.5Å; Y664-E666 HydrophobicContact CD1-CB 4.43Å; Y664-E666 HydrophobicContact CE1-CB 3.86Å
665	M	91.5	Very high	90.6	Very high	12 Å²	12	31.5 Å²	31.5	6%	0.059	18%	0.177	C	C	.	.			trans	-119	99.9	-177.9	-65.3	-69.4	-82.9	0	0	108.6	I646 N667 G668 L727 V728 T733 K735	I646-M665 HydrophobicContact CD1-CG 4.26Å; M665-N667 PolarHBondContact O-N 3.12Å; M665-N667 VanDerWaalsContact O-N 3.13Å; M665-G668 PolarHBondContact O-N 2.99Å; M665-L727 HydrophobicContact CB-CB 3.72Å; M665-L727 HydrophobicContact CB-CD1 3.86Å; M665-L727 HydrophobicContact CB-CG 4.43Å; M665-L727 HydrophobicContact CE-CB 4.12Å; M665-L727 WeakPolarHBondContact CE-O 3.2Å; M665-L727 HydrophobicContact CG-CB 3.75Å; M665-L727 HydrophobicContact CG-CD1 3.85Å; M665-L727 HydrophobicContact CG-CG 4.48Å; M665-V728 CarbonylContact C-O 3.52Å; M665-T733 WeakPolarHBondContact CE-O 3.19Å; M665-K735 HydrophobicContact CE-CB 3.96Å; M665-K735 HydrophobicContact CE-CD 3.74Å; M665-K735 HydrophobicContact CE-CG 3.82Å; M665-K735 HydrophobicContact SD-CD 3.77Å
666	E	88.3	Confident	91	Very high	94 Å²	94	36.2 Å²	36.2	44%	0.439	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-17.2	-162.5	64.5	-174.8	-149	0	0	116.1	Y664 K730	Y664-E666 HydrophobicContact CD1-CB 4.43Å; Y664-E666 HydrophobicContact CE1-CB 3.86Å; E666-K730 HydrophobicContact CG-CG 4.44Å; E666-K730 WeakPolarHBondContact OE1-CG 3.26Å; E666-K730 WeakPolarHBondContact OE2-CE 3.17Å; E666-K730 IonicContact OE2-NZ 2.8Å
667	N	91	Very high	91.2	Very high	63 Å²	63	32.7 Å²	32.7	34%	0.337	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	4.9	-179.3	-71.1	-60.3	0	0	0	113.5	M665 F673 V728 G729	M665-N667 PolarHBondContact O-N 3.12Å; M665-N667 VanDerWaalsContact O-N 3.13Å; N667-F673 HydrophobicContact CB-CD2 3.72Å; N667-F673 HydrophobicContact CB-CE2 3.79Å; N667-V728 HydrophobicContact CB-CB 3.78Å; N667-V728 HydrophobicContact CB-CG1 3.83Å; N667-V728 WeakPolarHBondContact CB-O 3.47Å; N667-V728 PolarHBondContact N-O 3.43Å; N667-V728 VanDerWaalsContact N-O 3.09Å; N667-G729 PolarHBondContact ND2-O 2.89Å
668	G	90.6	Very high	91.1	Very high	30 Å²	30	33.9 Å²	33.9	31%	0.309	17%	0.167	S	C	.	.			trans	77.2	-152	177.1	0	0	0	0	0	113.5	M665 L727 V728	M665-G668 PolarHBondContact O-N 2.99Å; G668-L727 CarbonylContact O-C 3.59Å; G668-L727 WeakPolarHBondContact O-CA 3.09Å; G668-V728 PolarHBondContact O-N 3.04Å
669	D	91.4	Very high	90.8	Very high	17 Å²	17	35.8 Å²	35.8	9%	0.091	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-82.1	154.8	174.2	71.1	77.5	0	0	0	112.7	N671 Q672 F673 C726 L727 Y746	D669-N671 PolarHBondContact O-N 3.48Å; D669-N671 WeakPolarHBondContact OD1-CA 3.16Å; D669-N671 VanDerWaalsContact OD1-CB 3.27Å; D669-N671 WeakPolarHBondContact OD1-CB 3.34Å; D669-N671 PolarHBondContact OD1-N 3.43Å; D669-Q672 PolarHBondContact O-N 3.22Å; D669-Q672 PolarHBondContact OD1-N 3.09Å; D669-Q672 WeakPolarHBondContact OD2-CG 3.47Å; D669-Q672 PolarHBondContact OD2-NE2 2.63Å; D669-F673 VanDerWaalsContact O-CB 3.31Å; D669-F673 WeakPolarHBondContact O-CB 3.49Å; D669-F673 PolarHBondContact O-N 3.43Å; D669-C726 CarbonylContact C-O 3.35Å; D669-C726 VanDerWaalsContact CA-O 3.31Å; D669-C726 WeakPolarHBondContact CA-O 3.2Å; D669-L727 HydrophobicContact CB-CD2 3.98Å; D669-Y746 PolarHBondContact OD1-OH 2.71Å
670	L	95.1	Very high	90.2	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67.9	-24.3	-174	-177.9	61	0	0	0	112.9	F673 L674 M700 I704 T723 C726 V728 I734 I790	L670-F673 HydrophobicContact CD1-CD1 4.47Å; L670-L674 HydrophobicContact CD1-CD1 3.81Å; L670-L674 HydrophobicContact CD1-CD2 4.41Å; L670-L674 HydrophobicContact CD1-CG 3.78Å; L670-L674 HydrophobicContact CG-CD1 4.02Å; L670-L674 HydrophobicContact CG-CG 4.34Å; L670-L674 WeakPolarHBondContact O-CB 3.35Å; L670-L674 WeakPolarHBondContact O-CG 3.17Å; L670-L674 PolarHBondContact O-N 3.09Å; L670-M700 HydrophobicContact CD1-SD 3.62Å; L670-I704 HydrophobicContact CD2-CD1 3.85Å; L670-T723 HydrophobicContact CD2-CG2 4.19Å; L670-T723 HydrophobicContact CG-CG2 4.37Å; L670-C726 HydrophobicContact CB-CB 3.98Å; L670-C726 HydrophobicContact CD2-CB 4.08Å; L670-C726 PolarHBondContact N-O 2.79Å; L670-V728 HydrophobicContact CB-CG2 3.88Å; L670-V728 HydrophobicContact CD1-CG2 3.71Å; L670-V728 HydrophobicContact CG-CG2 4.42Å; L670-I734 HydrophobicContact CD1-CD1 3.97Å; L670-I734 HydrophobicContact CD2-CD1 4.38Å; L670-I790 HydrophobicContact CD2-CD1 4.03Å; L670-I790 HydrophobicContact CD2-CG1 4.1Å
671	N	93.8	Very high	89.2	Confident	24 Å²	24	44.1 Å²	44.1	13%	0.128	23%	0.229	C	C	.	.	H	α-helix	trans	-72.4	-51.7	178.1	-172.6	-83.3	0	0	0	110.9	D669 F673 S675 T723 R724 Y746	D669-N671 PolarHBondContact O-N 3.48Å; D669-N671 WeakPolarHBondContact OD1-CA 3.16Å; D669-N671 VanDerWaalsContact OD1-CB 3.27Å; D669-N671 WeakPolarHBondContact OD1-CB 3.34Å; D669-N671 PolarHBondContact OD1-N 3.43Å; N671-F673 VanDerWaalsContact C-N 3.27Å; N671-F673 PolarHBondContact O-N 2.76Å; N671-S675 VanDerWaalsContact O-CB 3.3Å; N671-S675 WeakPolarHBondContact O-CB 3.4Å; N671-S675 PolarHBondContact O-N 3.04Å; N671-S675 PolarHBondContact O-OG 2.83Å; N671-T723 VanDerWaalsContact CB-OG1 3.3Å; N671-T723 WeakPolarHBondContact CB-OG1 3.45Å; N671-T723 PolarHBondContact ND2-OG1 2.97Å; N671-R724 HydrophobicContact CB-CB 4.39Å; N671-Y746 HydrophobicContact CB-CE1 4.32Å; N671-Y746 WeakPolarHBondContact OD1-CE1 3.46Å; N671-Y746 PolarHBondContact OD1-OH 3.19Å; N671-Y746 VanDerWaalsContact OD1-OH 3.06Å
672	Q	91.6	Very high	87.5	Confident	55 Å²	55	52.5 Å²	52.5	26%	0.257	27%	0.268	S	S	.	.	H	α-helix	trans	-62.2	-34.8	171.3	-71.1	-170.9	61.4	0	0	112.3	D669 S675 R676 Y746	D669-Q672 PolarHBondContact O-N 3.22Å; D669-Q672 PolarHBondContact OD1-N 3.09Å; D669-Q672 WeakPolarHBondContact OD2-CG 3.47Å; D669-Q672 PolarHBondContact OD2-NE2 2.63Å; Q672-S675 WeakPolarHBondContact CA-OG 3.47Å; Q672-S675 PolarHBondContact O-OG 3.41Å; Q672-R676 VanDerWaalsContact O-CD 3.27Å; Q672-R676 WeakPolarHBondContact O-CD 3.14Å; Q672-R676 VanDerWaalsContact O-CG 3.24Å; Q672-R676 WeakPolarHBondContact O-CG 3.42Å; Q672-Y746 WeakPolarHBondContact CG-OH 3.43Å
673	F	94.1	Very high	86	Confident	15 Å²	15	58.9 Å²	58.9	7%	0.066	30%	0.301	C	S	.	.	H	α-helix	trans	-63.9	-57.8	177.5	-171.9	-101.4	0	0	0	110.9	N667 D669 L670 N671 S675 R676 H677 V692 V728 Y732	N667-F673 HydrophobicContact CB-CD2 3.72Å; N667-F673 HydrophobicContact CB-CE2 3.79Å; D669-F673 VanDerWaalsContact O-CB 3.31Å; D669-F673 WeakPolarHBondContact O-CB 3.49Å; D669-F673 PolarHBondContact O-N 3.43Å; L670-F673 HydrophobicContact CD1-CD1 4.47Å; N671-F673 VanDerWaalsContact C-N 3.27Å; N671-F673 PolarHBondContact O-N 2.76Å; F673-S675 PolarHBondContact O-N 3.48Å; F673-R676 PolarHBondContact O-N 2.88Å; F673-H677 AromaticContact CD2-CE1 3.92Å; F673-H677 AromaticContact CE1-CE1 3.87Å; F673-H677 AromaticContact CE2-CE1 3.51Å; F673-H677 AromaticContact CZ-CE1 3.48Å; F673-H677 VanDerWaalsContact CZ-CE1 3.48Å; F673-H677 WeakPolarHBondContact CZ-CE1 3.45Å; F673-H677 AromaticContact CZ-NE2 3.83Å; F673-H677 PolarHBondContact O-ND1 2.84Å; F673-V692 HydrophobicContact CE1-CG2 4.34Å; F673-V728 HydrophobicContact CB-CG2 3.87Å; F673-V728 HydrophobicContact CD1-CG1 4.23Å; F673-V728 HydrophobicContact CD1-CG2 4.25Å; F673-V728 HydrophobicContact CD2-CB 4.49Å; F673-V728 HydrophobicContact CD2-CG1 4.24Å; F673-V728 HydrophobicContact CE1-CG1 4.3Å; F673-V728 HydrophobicContact CE2-CG1 4.29Å; F673-V728 HydrophobicContact CG-CB 4.35Å; F673-V728 HydrophobicContact CG-CG1 4.2Å; F673-V728 HydrophobicContact CG-CG2 3.99Å; F673-V728 HydrophobicContact CZ-CG1 4.32Å; F673-Y732 AromaticContact CE1-CD1 3.83Å; F673-Y732 HydrophobicContact CE1-CD1 3.83Å; F673-Y732 AromaticContact CE1-CE1 3.78Å; F673-Y732 HydrophobicContact CE1-CE1 3.78Å; F673-Y732 AromaticContact CZ-CD1 3.93Å; F673-Y732 HydrophobicContact CZ-CD1 3.93Å; F673-Y732 AromaticContact CZ-CE1 3.72Å; F673-Y732 HydrophobicContact CZ-CE1 3.72Å
674	L	94.6	Very high	84.6	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-68.5	-34.9	-176.1	-67.7	177.8	0	0	0	113.2	L670 R676 H677 V692 L697 M700 I790 F793 C794	L670-L674 HydrophobicContact CD1-CD1 3.81Å; L670-L674 HydrophobicContact CD1-CD2 4.41Å; L670-L674 HydrophobicContact CD1-CG 3.78Å; L670-L674 HydrophobicContact CG-CD1 4.02Å; L670-L674 HydrophobicContact CG-CG 4.34Å; L670-L674 WeakPolarHBondContact O-CB 3.35Å; L670-L674 WeakPolarHBondContact O-CG 3.17Å; L670-L674 PolarHBondContact O-N 3.09Å; L674-R676 PolarHBondContact O-N 2.99Å; L674-R676 VanDerWaalsContact O-N 3.14Å; L674-H677 PolarHBondContact O-N 3.36Å; L674-V692 HydrophobicContact CD2-CG2 4.41Å; L674-L697 HydrophobicContact CD1-CD2 4.45Å; L674-L697 HydrophobicContact CD2-CD2 3.81Å; L674-M700 HydrophobicContact CD2-CE 4.33Å; L674-M700 HydrophobicContact CD2-SD 4.42Å; L674-I790 HydrophobicContact CD1-CB 4.14Å; L674-I790 HydrophobicContact CD1-CG1 3.97Å; L674-I790 HydrophobicContact CD1-CG2 4.12Å; L674-F793 CarbonylContact C-O 3.59Å; L674-C794 HydrophobicContact CB-CB 4.4Å
675	S	91.4	Very high	82.9	Confident	55 Å²	55	62.4 Å²	62.4	39%	0.385	33%	0.326	S	S	.	.	H	α-helix	trans	-65.5	-15.6	177.9	60.4	0	0	0	0	114.2	N671 Q672 F673 F793	N671-S675 VanDerWaalsContact O-CB 3.3Å; N671-S675 WeakPolarHBondContact O-CB 3.4Å; N671-S675 PolarHBondContact O-N 3.04Å; N671-S675 PolarHBondContact O-OG 2.83Å; Q672-S675 WeakPolarHBondContact CA-OG 3.47Å; Q672-S675 PolarHBondContact O-OG 3.41Å; F673-S675 PolarHBondContact O-N 3.48Å; S675-F793 VanDerWaalsContact CA-O 3.29Å; S675-F793 WeakPolarHBondContact CA-O 3.37Å; S675-F793 PolarHBondContact N-O 3.11Å
676	R	89.6	Confident	81.4	Confident	156 Å²	156	68.8 Å²	68.8	59%	0.589	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-7.4	173.1	-68.4	170.5	-175.8	145.8	8.4	114	Q672 F673 L674	Q672-R676 VanDerWaalsContact O-CD 3.27Å; Q672-R676 WeakPolarHBondContact O-CD 3.14Å; Q672-R676 VanDerWaalsContact O-CG 3.24Å; Q672-R676 WeakPolarHBondContact O-CG 3.42Å; F673-R676 PolarHBondContact O-N 2.88Å; L674-R676 PolarHBondContact O-N 2.99Å; L674-R676 VanDerWaalsContact O-N 3.14Å
677	H	90	Very high	80.1	Confident	22 Å²	22	68.3 Å²	68.3	10%	0.102	37%	0.367	C	S	.	.			trans	-109.5	160.1	-175.7	-72.5	77.1	0	0	0	112.4	F673 L674 S690 V692 F793	F673-H677 AromaticContact CD2-CE1 3.92Å; F673-H677 AromaticContact CE1-CE1 3.87Å; F673-H677 AromaticContact CE2-CE1 3.51Å; F673-H677 AromaticContact CZ-CE1 3.48Å; F673-H677 VanDerWaalsContact CZ-CE1 3.48Å; F673-H677 WeakPolarHBondContact CZ-CE1 3.45Å; F673-H677 AromaticContact CZ-NE2 3.83Å; F673-H677 PolarHBondContact O-ND1 2.84Å; L674-H677 PolarHBondContact O-N 3.36Å; H677-S690 VanDerWaalsContact CA-O 3.28Å; H677-S690 WeakPolarHBondContact CA-O 3.36Å; H677-S690 WeakPolarHBondContact CB-O 3.35Å; H677-S690 VanDerWaalsContact CD2-C 3.49Å; H677-S690 WeakPolarHBondContact CD2-CB 3.39Å; H677-S690 PolarHBondContact CD2-O 3.04Å; H677-S690 VanDerWaalsContact CD2-O 3.28Å; H677-S690 PolarHBondContact CD2-OG 2.95Å; H677-S690 WeakPolarHBondContact NE2-CB 3.37Å; H677-S690 PolarHBondContact NE2-OG 3.46Å; H677-V692 HydrophobicContact CB-CG2 3.77Å; H677-F793 HydrophobicContact CB-CD1 4.19Å; H677-F793 HydrophobicContact CB-CE1 4.17Å; H677-F793 WeakPolarHBondContact O-CD1 3.45Å
678	E	85.8	Confident	78.7	Confident	75 Å²	75	73 Å²	73	35%	0.35	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	157.3	172.5	-69.3	-60.9	161.4	0	0	112.2	A689 S690 T691 V692 F793 K795	E678-A689 HydrophobicContact CB-CB 4.4Å; E678-A689 HydrophobicContact CG-CB 3.92Å; E678-S690 PolarHBondContact N-O 3.2Å; E678-T691 VanDerWaalsContact O-CA 3.26Å; E678-T691 WeakPolarHBondContact O-CA 3.33Å; E678-V692 PolarHBondContact O-N 2.74Å; E678-F793 WeakPolarHBondContact O-CE1 3.21Å; E678-K795 IonicContact OE1-NZ 2.8Å; E678-K795 PolarHBondContact OE1-NZ 3.29Å; E678-K795 IonicContact OE2-NZ 3.97Å; E678-K795 PolarHBondContact OE2-NZ 3.12Å
679	P	83.4	Confident	77.5	Confident	44 Å²	44	73.3 Å²	73.3	29%	0.286	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	139.3	167.9	-18.7	30.9	0	0	0	111.3	G681 F793 L829	P679-G681 PolarHBondContact O-N 3.32Å; P679-F793 HydrophobicContact CB-CE2 4.14Å; P679-F793 HydrophobicContact CB-CZ 4.1Å; P679-F793 HydrophobicContact CG-CD2 4.12Å; P679-F793 HydrophobicContact CG-CE2 3.7Å; P679-F793 HydrophobicContact CG-CZ 3.94Å; P679-L829 HydrophobicContact CB-CD1 3.84Å; P679-L829 HydrophobicContact CG-CD1 3.75Å
680	E	78.7	Confident	77	Confident	138 Å²	138	75.4 Å²	75.4	65%	0.645	41%	0.407	S	S	*	.	S	Bend	trans	-59.7	122.8	173.2	-170.9	-179.3	-172.9	0	0	111.4	V692 S693	E680-V692 PolarHBondContact N-O 3Å; E680-S693 VanDerWaalsContact OE2-CB 3.24Å; E680-S693 WeakPolarHBondContact OE2-CB 3.47Å
681	G	70.3	Confident	76.6	Confident	38 Å²	38	78 Å²	78	39%	0.392	42%	0.423	S	S	.	.	S	Bend	trans	176.5	170.1	-178.3	0	0	0	0	0	114	P679 L683 A684	P679-G681 PolarHBondContact O-N 3.32Å; G681-L683 PolarHBondContact O-N 3.09Å; G681-L683 VanDerWaalsContact O-N 3.08Å; G681-A684 PolarHBondContact O-N 2.78Å
682	Q	55.8	Low	76.4	Confident	175 Å²	175	76.9 Å²	76.9	82%	0.818	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-21.8	-173.2	-70.4	179.9	-18.2	0	0	114.6
683	L	59.2	Low	76.3	Confident	142 Å²	142	75.5 Å²	75.5	74%	0.743	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-34	175.5	-78.8	155.1	0	0	0	112.8	G681 L685 L686 S687	G681-L683 PolarHBondContact O-N 3.09Å; G681-L683 VanDerWaalsContact O-N 3.08Å; L683-L685 VanDerWaalsContact C-N 3.31Å; L683-L685 PolarHBondContact O-N 2.73Å; L683-L686 PolarHBondContact O-N 3.47Å; L683-S687 PolarHBondContact O-OG 2.78Å
684	A	58.8	Low	76.1	Confident	11 Å²	11	78.4 Å²	78.4	9%	0.091	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-67.7	-32.9	-179.6	0	0	0	0	0	112.2	G681 L686 S687 N688 T691	G681-A684 PolarHBondContact O-N 2.78Å; A684-L686 PolarHBondContact O-N 2.96Å; A684-L686 VanDerWaalsContact O-N 3.11Å; A684-S687 PolarHBondContact O-N 3.08Å; A684-N688 PolarHBondContact O-N 3.22Å; A684-T691 HydrophobicContact CB-CG2 3.35Å
685	L	56.9	Low	75.9	Confident	144 Å²	144	79.7 Å²	79.7	75%	0.754	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-60.2	-16.6	173.7	-65	175.4	0	0	0	114.1	L683	L683-L685 VanDerWaalsContact C-N 3.31Å; L683-L685 PolarHBondContact O-N 2.73Å
686	L	58.7	Low	76	Confident	146 Å²	146	79 Å²	79	76%	0.764	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-93.9	-14.5	175.8	-61.4	173.5	0	0	0	113	L683 A684	L683-L686 PolarHBondContact O-N 3.47Å; A684-L686 PolarHBondContact O-N 2.96Å; A684-L686 VanDerWaalsContact O-N 3.11Å
687	S	61.8	Low	76.2	Confident	85 Å²	85	71.6 Å²	71.6	59%	0.594	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	-10.2	-168.3	-58	0	0	0	0	114.4	L683 A684 A689	L683-S687 PolarHBondContact O-OG 2.78Å; A684-S687 PolarHBondContact O-N 3.08Å; S687-A689 PolarHBondContact O-N 2.82Å; S687-A689 VanDerWaalsContact O-N 3.11Å
688	N	61.8	Low	76.3	Confident	162 Å²	162	70.8 Å²	70.8	87%	0.866	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	22.8	-168.8	-68.8	-15	0	0	0	114.3	A684	A684-N688 PolarHBondContact O-N 3.22Å
689	A	65.4	Low	76.7	Confident	36 Å²	36	71.8 Å²	71.8	30%	0.298	40%	0.401	S	S	.	.			trans	-74.3	144.6	176.6	0	0	0	0	0	110	E678 S687 T691	E678-A689 HydrophobicContact CB-CB 4.4Å; E678-A689 HydrophobicContact CG-CB 3.92Å; S687-A689 PolarHBondContact O-N 2.82Å; S687-A689 VanDerWaalsContact O-N 3.11Å; A689-T691 PolarHBondContact O-N 2.84Å
690	S	80.7	Confident	77.4	Confident	60 Å²	60	69.7 Å²	69.7	42%	0.42	39%	0.388	S	S	.	.			trans	-69.6	131.8	171	51.9	0	0	0	0	110	H677 E678	H677-S690 VanDerWaalsContact CA-O 3.28Å; H677-S690 WeakPolarHBondContact CA-O 3.36Å; H677-S690 WeakPolarHBondContact CB-O 3.35Å; H677-S690 VanDerWaalsContact CD2-C 3.49Å; H677-S690 WeakPolarHBondContact CD2-CB 3.39Å; H677-S690 PolarHBondContact CD2-O 3.04Å; H677-S690 VanDerWaalsContact CD2-O 3.28Å; H677-S690 PolarHBondContact CD2-OG 2.95Å; H677-S690 WeakPolarHBondContact NE2-CB 3.37Å; H677-S690 PolarHBondContact NE2-OG 3.46Å; E678-S690 PolarHBondContact N-O 3.2Å
691	T	85.8	Confident	78.2	Confident	55 Å²	55	63.2 Å²	63.2	34%	0.337	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	145.4	-176.1	50	0	0	0	0	112.3	E678 A684 A689	E678-T691 VanDerWaalsContact O-CA 3.26Å; E678-T691 WeakPolarHBondContact O-CA 3.33Å; A684-T691 HydrophobicContact CB-CG2 3.35Å; A689-T691 PolarHBondContact O-N 2.84Å
692	V	89.7	Confident	79.5	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.006	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131.6	169.2	179	0	0	0	0	108.1	F673 L674 H677 E678 E680 D696 L697 M700 Y732 F793	F673-V692 HydrophobicContact CE1-CG2 4.34Å; L674-V692 HydrophobicContact CD2-CG2 4.41Å; H677-V692 HydrophobicContact CB-CG2 3.77Å; E678-V692 PolarHBondContact O-N 2.74Å; E680-V692 PolarHBondContact N-O 3Å; V692-D696 HydrophobicContact CG1-CB 3.58Å; V692-L697 HydrophobicContact CG1-CD2 3.72Å; V692-L697 HydrophobicContact CG1-CG 3.99Å; V692-M700 HydrophobicContact CG1-CE 3.54Å; V692-Y732 HydrophobicContact CG2-CE1 4.27Å; V692-F793 HydrophobicContact CB-CE1 3.96Å; V692-F793 HydrophobicContact CB-CZ 4.24Å
693	S	90.3	Very high	81.5	Confident	25 Å²	25	54.1 Å²	54.1	18%	0.175	31%	0.306	C	S	.	.			trans	-78.2	159.8	178.1	78.7	0	0	0	0	111.1	E680 G695 D696 L697	E680-S693 VanDerWaalsContact OE2-CB 3.24Å; E680-S693 WeakPolarHBondContact OE2-CB 3.47Å; S693-G695 PolarHBondContact O-N 3.4Å; S693-G695 PolarHBondContact OG-N 2.89Å; S693-D696 VanDerWaalsContact CB-OD2 3.26Å; S693-D696 WeakPolarHBondContact CB-OD2 3.45Å; S693-D696 PolarHBondContact N-OD2 2.94Å; S693-D696 PolarHBondContact O-N 2.85Å; S693-D696 VanDerWaalsContact O-N 3.12Å; S693-D696 PolarHBondContact OG-N 2.68Å; S693-D696 VanDerWaalsContact OG-N 3.12Å; S693-D696 PolarHBondContact OG-OD2 2.86Å; S693-L697 PolarHBondContact O-N 2.98Å; S693-L697 VanDerWaalsContact O-N 3.11Å
694	F	89.4	Confident	83.4	Confident	77 Å²	77	47.4 Å²	47.4	34%	0.338	27%	0.27	S	S	.	.	H	α-helix	trans	-60.4	-30.4	172.3	179.6	-98.4	0	0	0	112.4	L697 C698 L791 L829 P831 L834	F694-L697 PolarHBondContact O-N 2.76Å; F694-C698 VanDerWaalsContact CE1-SG 3.59Å; F694-C698 VanDerWaalsContact CZ-SG 3.52Å; F694-C698 PolarHBondContact O-N 2.9Å; F694-C698 VanDerWaalsContact O-N 3.09Å; F694-L791 HydrophobicContact CD2-CD2 4.39Å; F694-L791 HydrophobicContact CE2-CD2 3.85Å; F694-L829 WeakPolarHBondContact CE2-O 3.29Å; F694-P831 HydrophobicContact CE1-CG 4.32Å; F694-P831 HydrophobicContact CE2-CG 4.42Å; F694-P831 VanDerWaalsContact CZ-CD 3.5Å; F694-P831 HydrophobicContact CZ-CG 3.75Å; F694-L834 HydrophobicContact CE2-CD2 4.36Å; F694-L834 HydrophobicContact CZ-CD2 4.07Å
695	G	90.4	Very high	85.2	Confident	26 Å²	26	46.9 Å²	46.9	27%	0.268	27%	0.266	S	S	.	.	H	α-helix	trans	-62.9	-43.8	173.5	0	0	0	0	0	112.2	S693 C698 Y699	S693-G695 PolarHBondContact O-N 3.4Å; S693-G695 PolarHBondContact OG-N 2.89Å; G695-C698 PolarHBondContact O-N 2.89Å; G695-Y699 WeakPolarHBondContact O-CB 3.49Å; G695-Y699 PolarHBondContact O-N 2.72Å
696	D	92.8	Very high	87.2	Confident	40 Å²	40	40.7 Å²	40.7	21%	0.214	24%	0.235	C	C	.	.	H	α-helix	trans	-65.6	-40.2	177.5	-58.7	-55.9	0	0	0	111.8	V692 S693 C698 Y699 M700 Y732	V692-D696 HydrophobicContact CG1-CB 3.58Å; S693-D696 VanDerWaalsContact CB-OD2 3.26Å; S693-D696 WeakPolarHBondContact CB-OD2 3.45Å; S693-D696 PolarHBondContact N-OD2 2.94Å; S693-D696 PolarHBondContact O-N 2.85Å; S693-D696 VanDerWaalsContact O-N 3.12Å; S693-D696 PolarHBondContact OG-N 2.68Å; S693-D696 VanDerWaalsContact OG-N 3.12Å; S693-D696 PolarHBondContact OG-OD2 2.86Å; D696-C698 PolarHBondContact O-N 3.36Å; D696-Y699 WeakPolarHBondContact O-CB 3.45Å; D696-Y699 PolarHBondContact O-N 2.85Å; D696-M700 HydrophobicContact CB-CE 3.94Å; D696-M700 WeakPolarHBondContact O-CE 3.37Å; D696-M700 WeakPolarHBondContact O-CG 3.33Å; D696-M700 PolarHBondContact O-N 3.38Å; D696-Y732 HydrophobicContact CB-CD2 4.07Å; D696-Y732 HydrophobicContact CB-CE2 4Å; D696-Y732 VanDerWaalsContact CG-CE2 3.41Å; D696-Y732 WeakPolarHBondContact OD1-CD2 3.33Å; D696-Y732 VanDerWaalsContact OD1-CE2 3.26Å; D696-Y732 WeakPolarHBondContact OD1-CE2 3.21Å
697	L	93.9	Very high	89	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-59.7	-45.4	174.2	-62.4	175.5	0	0	0	111.4	L674 V692 S693 F694 Y699 M700 A701 I790 F793	L674-L697 HydrophobicContact CD1-CD2 4.45Å; L674-L697 HydrophobicContact CD2-CD2 3.81Å; V692-L697 HydrophobicContact CG1-CD2 3.72Å; V692-L697 HydrophobicContact CG1-CG 3.99Å; S693-L697 PolarHBondContact O-N 2.98Å; S693-L697 VanDerWaalsContact O-N 3.11Å; F694-L697 PolarHBondContact O-N 2.76Å; L697-Y699 VanDerWaalsContact C-N 3.34Å; L697-M700 PolarHBondContact O-N 3.07Å; L697-A701 WeakPolarHBondContact O-CB 3.38Å; L697-A701 PolarHBondContact O-N 2.88Å; L697-I790 HydrophobicContact CB-CG2 3.98Å; L697-I790 HydrophobicContact CD2-CG2 3.85Å; L697-I790 HydrophobicContact CG-CG2 4.45Å; L697-F793 HydrophobicContact CD1-CD2 4.49Å; L697-F793 HydrophobicContact CD1-CE2 3.6Å; L697-F793 HydrophobicContact CD1-CZ 3.9Å; L697-F793 HydrophobicContact CD2-CE2 4.34Å; L697-F793 HydrophobicContact CD2-CZ 4.19Å; L697-F793 HydrophobicContact CG-CZ 4.45Å
698	C	93.3	Very high	90.7	Very high	4 Å²	4	29.8 Å²	29.8	3%	0.027	17%	0.17	C	C	.	.	H	α-helix	trans	-65.8	-34.3	174.8	-75.7	0	0	0	0	112.6	F694 G695 D696 T702	F694-C698 VanDerWaalsContact CE1-SG 3.59Å; F694-C698 VanDerWaalsContact CZ-SG 3.52Å; F694-C698 PolarHBondContact O-N 2.9Å; F694-C698 VanDerWaalsContact O-N 3.09Å; G695-C698 PolarHBondContact O-N 2.89Å; D696-C698 PolarHBondContact O-N 3.36Å; C698-T702 WeakPolarHBondContact O-CB 3.14Å; C698-T702 PolarHBondContact O-N 2.85Å; C698-T702 PolarHBondContact O-OG1 3.08Å
699	Y	94.6	Very high	92.4	Very high	97 Å²	97	24.3 Å²	24.3	38%	0.38	14%	0.139	S	C	.	.	H	α-helix	trans	-66.2	-44.5	174.3	-179.5	-116.5	0	0	0	111.9	G695 D696 L697 T702 Q703	G695-Y699 WeakPolarHBondContact O-CB 3.49Å; G695-Y699 PolarHBondContact O-N 2.72Å; D696-Y699 WeakPolarHBondContact O-CB 3.45Å; D696-Y699 PolarHBondContact O-N 2.85Å; L697-Y699 VanDerWaalsContact C-N 3.34Å; Y699-T702 PolarHBondContact O-N 2.87Å; Y699-Q703 VanDerWaalsContact CD1-NE2 3.33Å; Y699-Q703 HydrophobicContact CE2-CG 4.48Å; Y699-Q703 WeakPolarHBondContact O-CG 3.27Å; Y699-Q703 PolarHBondContact O-N 2.83Å; Y699-Q703 VanDerWaalsContact O-N 3.09Å; Y699-Q703 PolarHBondContact O-NE2 3.1Å
700	M	96.4	Very high	93.8	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.3	-44.5	173.4	-68.3	-177.1	-116.1	0	0	111.7	L670 L674 V692 D696 L697 T702 Q703 I704 Y732 I734	L670-M700 HydrophobicContact CD1-SD 3.62Å; L674-M700 HydrophobicContact CD2-CE 4.33Å; L674-M700 HydrophobicContact CD2-SD 4.42Å; V692-M700 HydrophobicContact CG1-CE 3.54Å; D696-M700 HydrophobicContact CB-CE 3.94Å; D696-M700 WeakPolarHBondContact O-CE 3.37Å; D696-M700 WeakPolarHBondContact O-CG 3.33Å; D696-M700 PolarHBondContact O-N 3.38Å; L697-M700 PolarHBondContact O-N 3.07Å; M700-T702 PolarHBondContact O-N 2.92Å; M700-Q703 PolarHBondContact O-N 2.94Å; M700-I704 WeakPolarHBondContact O-CG1 3.32Å; M700-I704 PolarHBondContact O-N 2.92Å; M700-I704 VanDerWaalsContact O-N 3.15Å; M700-Y732 HydrophobicContact CE-CD1 3.7Å; M700-Y732 HydrophobicContact CE-CE1 4.23Å; M700-Y732 HydrophobicContact CE-CG 4Å; M700-Y732 HydrophobicContact SD-CD1 4.47Å; M700-I734 HydrophobicContact CB-CD1 4.21Å; M700-I734 HydrophobicContact CB-CG1 3.76Å; M700-I734 HydrophobicContact CG-CD1 3.79Å; M700-I734 HydrophobicContact CG-CG1 3.7Å; M700-I734 HydrophobicContact SD-CD1 4.03Å
701	A	96.7	Very high	94.3	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.008	11%	0.113	C	C	.	.	H	α-helix	trans	-62.4	-40.1	176.5	0	0	0	0	0	113.2	L697 I704 A705 Y783 L787	L697-A701 WeakPolarHBondContact O-CB 3.38Å; L697-A701 PolarHBondContact O-N 2.88Å; A701-I704 PolarHBondContact O-N 2.82Å; A701-A705 PolarHBondContact O-N 3.18Å; A701-Y783 PolarHBondContact O-OH 2.91Å; A701-L787 HydrophobicContact CB-CD1 3.78Å
702	T	97.3	Very high	94.5	Very high	10 Å²	10	20.8 Å²	20.8	6%	0.061	11%	0.108	C	C	.	.	H	α-helix	trans	-65.7	-39.8	177.9	-58.6	0	0	0	0	111.6	C698 Y699 M700 A705 S706 L859 L860 Q863	C698-T702 WeakPolarHBondContact O-CB 3.14Å; C698-T702 PolarHBondContact O-N 2.85Å; C698-T702 PolarHBondContact O-OG1 3.08Å; Y699-T702 PolarHBondContact O-N 2.87Å; M700-T702 PolarHBondContact O-N 2.92Å; T702-A705 CarbonylContact O-C 3.57Å; T702-A705 WeakPolarHBondContact O-CB 3.49Å; T702-A705 PolarHBondContact O-N 3.33Å; T702-S706 PolarHBondContact O-N 3.43Å; T702-L859 WeakPolarHBondContact OG1-CB 3.23Å; T702-L860 HydrophobicContact CG2-CD2 3.9Å; T702-L860 HydrophobicContact CG2-CG 4.01Å; T702-Q863 PolarHBondContact OG1-NE2 3.39Å
703	Q	97.8	Very high	94.6	Very high	13 Å²	13	24.9 Å²	24.9	6%	0.061	14%	0.137	C	C	.	.	H	α-helix	trans	-62.8	-43	175	-76	179.4	87.1	0	0	112.4	N644 Y699 M700 A705 S706 G707 Y732 I734	N644-Q703 WeakPolarHBondContact CB-O 3.39Å; N644-Q703 WeakPolarHBondContact ND2-CB 3.33Å; N644-Q703 WeakPolarHBondContact ND2-CG 3.43Å; N644-Q703 PolarHBondContact ND2-OE1 2.91Å; N644-Q703 VanDerWaalsContact ND2-OE1 3.12Å; Y699-Q703 VanDerWaalsContact CD1-NE2 3.33Å; Y699-Q703 HydrophobicContact CE2-CG 4.48Å; Y699-Q703 WeakPolarHBondContact O-CG 3.27Å; Y699-Q703 PolarHBondContact O-N 2.83Å; Y699-Q703 VanDerWaalsContact O-N 3.09Å; Y699-Q703 PolarHBondContact O-NE2 3.1Å; M700-Q703 PolarHBondContact O-N 2.94Å; Q703-A705 VanDerWaalsContact C-N 3.34Å; Q703-A705 PolarHBondContact O-N 3.28Å; Q703-S706 WeakPolarHBondContact O-CA 3.14Å; Q703-S706 VanDerWaalsContact O-CB 3.25Å; Q703-S706 WeakPolarHBondContact O-CB 3.43Å; Q703-S706 PolarHBondContact O-N 2.79Å; Q703-G707 PolarHBondContact O-N 3.42Å; Q703-Y732 PolarHBondContact NE2-O 3.43Å; Q703-I734 HydrophobicContact CB-CB 4.03Å; Q703-I734 HydrophobicContact CB-CG1 4.48Å
704	I	98.2	Very high	94.3	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-63.4	-41.7	174.3	-61.5	167.1	0	0	0	110.3	L670 M700 A701 S706 G707 M708 L721 I734 I736 Y783 T786 I790	L670-I704 HydrophobicContact CD2-CD1 3.85Å; M700-I704 WeakPolarHBondContact O-CG1 3.32Å; M700-I704 PolarHBondContact O-N 2.92Å; M700-I704 VanDerWaalsContact O-N 3.15Å; A701-I704 PolarHBondContact O-N 2.82Å; I704-S706 PolarHBondContact O-N 3.49Å; I704-G707 PolarHBondContact O-N 3.46Å; I704-M708 HydrophobicContact CG2-CG 4.38Å; I704-M708 WeakPolarHBondContact O-CB 3.29Å; I704-M708 WeakPolarHBondContact O-CG 3.37Å; I704-M708 PolarHBondContact O-N 2.98Å; I704-L721 HydrophobicContact CG2-CD1 4.22Å; I704-I734 HydrophobicContact CD1-CG2 4.16Å; I704-I734 HydrophobicContact CG1-CG2 3.61Å; I704-I736 HydrophobicContact CB-CD1 4.49Å; I704-I736 HydrophobicContact CG2-CD1 3.88Å; I704-I736 HydrophobicContact CG2-CG1 4.33Å; I704-Y783 HydrophobicContact CB-CE2 3.98Å; I704-Y783 HydrophobicContact CG2-CD2 3.78Å; I704-Y783 HydrophobicContact CG2-CE2 3.7Å; I704-T786 HydrophobicContact CD1-CG2 4.11Å; I704-I790 HydrophobicContact CD1-CD1 3.75Å
705	A	98	Very high	93.9	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.9	-29.1	173.1	0	0	0	0	0	112.5	A701 T702 Q703 K709 Y783 H856 L859	A701-A705 PolarHBondContact O-N 3.18Å; T702-A705 CarbonylContact O-C 3.57Å; T702-A705 WeakPolarHBondContact O-CB 3.49Å; T702-A705 PolarHBondContact O-N 3.33Å; Q703-A705 VanDerWaalsContact C-N 3.34Å; Q703-A705 PolarHBondContact O-N 3.28Å; A705-K709 WeakPolarHBondContact O-CB 3.16Å; A705-K709 PolarHBondContact O-N 3.48Å; A705-Y783 HydrophobicContact CB-CE2 4.05Å; A705-H856 HydrophobicContact CB-CB 4.12Å; A705-L859 HydrophobicContact CB-CD1 3.93Å
706	S	97.9	Very high	93.5	Very high	14 Å²	14	26.3 Å²	26.3	10%	0.098	14%	0.139	C	C	.	.	H	α-helix	trans	-70.7	-50.7	175.8	-170.3	0	0	0	0	111.8	N644 T702 Q703 I704 M708 K709 Y710 H856	N644-S706 WeakPolarHBondContact OD1-CB 3.4Å; N644-S706 PolarHBondContact OD1-OG 2.89Å; T702-S706 PolarHBondContact O-N 3.43Å; Q703-S706 WeakPolarHBondContact O-CA 3.14Å; Q703-S706 VanDerWaalsContact O-CB 3.25Å; Q703-S706 WeakPolarHBondContact O-CB 3.43Å; Q703-S706 PolarHBondContact O-N 2.79Å; I704-S706 PolarHBondContact O-N 3.49Å; S706-M708 VanDerWaalsContact C-N 3.35Å; S706-M708 PolarHBondContact O-N 3.41Å; S706-K709 WeakPolarHBondContact O-CB 3.5Å; S706-K709 WeakPolarHBondContact O-CE 3.01Å; S706-K709 PolarHBondContact O-N 2.94Å; S706-K709 PolarHBondContact OG-NZ 3.29Å; S706-Y710 PolarHBondContact O-N 3.35Å; S706-H856 VanDerWaalsContact CA-CD2 3.46Å; S706-H856 WeakPolarHBondContact CA-CD2 3.45Å
707	G	96.7	Very high	93.2	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.4	-43.4	176.5	0	0	0	0	0	111.9	Q703 I704 K709 Y710 L711	Q703-G707 PolarHBondContact O-N 3.42Å; I704-G707 PolarHBondContact O-N 3.46Å; G707-K709 PolarHBondContact O-N 3.39Å; G707-Y710 WeakPolarHBondContact O-CB 3.05Å; G707-Y710 PolarHBondContact O-N 3.4Å; G707-Y710 VanDerWaalsContact O-N 3.13Å; G707-L711 WeakPolarHBondContact O-CG 3.09Å; G707-L711 PolarHBondContact O-N 2.84Å
708	M	97.3	Very high	93	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-69	-32.8	177	-67.9	-53.3	-57	0	0	113.6	I704 S706 Y710 L711 S712 H718 L721 I736 D779 F852	I704-M708 HydrophobicContact CG2-CG 4.38Å; I704-M708 WeakPolarHBondContact O-CB 3.29Å; I704-M708 WeakPolarHBondContact O-CG 3.37Å; I704-M708 PolarHBondContact O-N 2.98Å; S706-M708 VanDerWaalsContact C-N 3.35Å; S706-M708 PolarHBondContact O-N 3.41Å; M708-Y710 VanDerWaalsContact C-N 3.32Å; M708-L711 HydrophobicContact SD-CD1 3.95Å; M708-S712 WeakPolarHBondContact O-CB 3.4Å; M708-S712 PolarHBondContact O-N 2.89Å; M708-H718 HydrophobicContact CE-CB 3.93Å; M708-H718 HydrophobicContact SD-CB 4.26Å; M708-L721 HydrophobicContact CE-CD2 4.14Å; M708-L721 HydrophobicContact CG-CD1 4.39Å; M708-L721 HydrophobicContact CG-CD2 3.75Å; M708-L721 HydrophobicContact SD-CD1 3.99Å; M708-L721 HydrophobicContact SD-CD2 3.84Å; M708-L721 HydrophobicContact SD-CG 4.46Å; M708-I736 HydrophobicContact CG-CD1 3.6Å; M708-I736 HydrophobicContact SD-CD1 3.67Å; M708-D779 HydrophobicContact CE-CB 3.72Å; M708-F852 HydrophobicContact CB-CD1 3.44Å; M708-F852 VanDerWaalsContact CB-CD1 3.44Å; M708-F852 HydrophobicContact CB-CD2 3.87Å; M708-F852 HydrophobicContact CB-CE1 3.37Å; M708-F852 HydrophobicContact CB-CE2 3.8Å; M708-F852 HydrophobicContact CB-CG 3.69Å; M708-F852 HydrophobicContact CB-CZ 3.56Å; M708-F852 HydrophobicContact CE-CE2 3.84Å; M708-F852 HydrophobicContact CE-CZ 3.82Å; M708-F852 HydrophobicContact CG-CD1 4.39Å; M708-F852 HydrophobicContact CG-CE1 3.87Å; M708-F852 HydrophobicContact CG-CE2 4.5Å; M708-F852 HydrophobicContact CG-CZ 3.93Å
709	K	97.3	Very high	92.7	Very high	47 Å²	47	26.4 Å²	26.4	20%	0.204	14%	0.136	C	C	.	.	H	α-helix	trans	-61.2	-40	168.1	163.6	-154.3	71.3	-162.2	0	111.1	A705 S706 G707 S713 F852 H856	A705-K709 WeakPolarHBondContact O-CB 3.16Å; A705-K709 PolarHBondContact O-N 3.48Å; S706-K709 WeakPolarHBondContact O-CB 3.5Å; S706-K709 WeakPolarHBondContact O-CE 3.01Å; S706-K709 PolarHBondContact O-N 2.94Å; S706-K709 PolarHBondContact OG-NZ 3.29Å; G707-K709 PolarHBondContact O-N 3.39Å; K709-S713 PolarHBondContact O-N 3.15Å; K709-F852 HydrophobicContact CB-CB 3.86Å; K709-H856 HydrophobicContact CD-CB 4.46Å; K709-H856 PolarHBondContact NZ-CD2 3.19Å; K709-H856 PolarHBondContact NZ-NE2 2.84Å
710	Y	95.4	Very high	92.4	Very high	41 Å²	41	21.9 Å²	21.9	16%	0.161	12%	0.118	C	C	.	.	H	α-helix	trans	-65.2	-52.9	174.6	171.8	-96.5	0	0	0	111.8	R639 L640 K641 D642 I645 S706 G707 M708 S712 S713 L714	R639-Y710 PolarHBondContact O-OH 3.34Å; L640-Y710 HydrophobicContact CD2-CE1 4.2Å; K641-Y710 PolarHBondContact N-OH 2.83Å; K641-Y710 PolarHBondContact O-OH 2.86Å; D642-Y710 HydrophobicContact CB-CD1 3.56Å; D642-Y710 HydrophobicContact CB-CD2 3.76Å; D642-Y710 HydrophobicContact CB-CE1 3.87Å; D642-Y710 HydrophobicContact CB-CE2 4.06Å; D642-Y710 HydrophobicContact CB-CG 3.5Å; D642-Y710 VanDerWaalsContact CB-CG 3.5Å; I645-Y710 HydrophobicContact CG1-CD1 3.98Å; S706-Y710 PolarHBondContact O-N 3.35Å; G707-Y710 WeakPolarHBondContact O-CB 3.05Å; G707-Y710 PolarHBondContact O-N 3.4Å; G707-Y710 VanDerWaalsContact O-N 3.13Å; M708-Y710 VanDerWaalsContact C-N 3.32Å; Y710-S712 VanDerWaalsContact C-N 3.29Å; Y710-S712 PolarHBondContact O-N 3.41Å; Y710-S713 WeakPolarHBondContact O-CB 3.44Å; Y710-S713 PolarHBondContact O-N 3.02Å; Y710-S713 PolarHBondContact O-OG 2.89Å; Y710-L714 HydrophobicContact CD1-CD1 4.4Å; Y710-L714 HydrophobicContact CE1-CD1 3.67Å; Y710-L714 HydrophobicContact CE2-CD1 4.43Å; Y710-L714 PolarHBondContact O-N 2.96Å
711	L	91	Very high	92.3	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.016	12%	0.119	C	C	.	.	H	α-helix	trans	-57.3	-42.4	177.5	-64.4	-177.9	0	0	0	111.8	L640 I645 G707 M708 S713 L714 N715 F716	L640-L711 HydrophobicContact CD1-CD2 4.31Å; L640-L711 HydrophobicContact CD2-CD2 3.8Å; I645-L711 HydrophobicContact CD1-CD1 3.8Å; I645-L711 HydrophobicContact CD1-CD2 4.05Å; I645-L711 HydrophobicContact CD1-CG 3.77Å; I645-L711 HydrophobicContact CG1-CD2 4.25Å; I645-L711 HydrophobicContact CG1-CG 4.38Å; G707-L711 WeakPolarHBondContact O-CG 3.09Å; G707-L711 PolarHBondContact O-N 2.84Å; M708-L711 HydrophobicContact SD-CD1 3.95Å; L711-S713 PolarHBondContact O-N 3.08Å; L711-L714 PolarHBondContact O-N 2.83Å; L711-N715 PolarHBondContact O-N 3.47Å; L711-F716 HydrophobicContact CB-CB 4.19Å; L711-F716 HydrophobicContact CB-CD1 4.12Å; L711-F716 HydrophobicContact CD1-CD1 4.01Å; L711-F716 HydrophobicContact CD1-CE1 4.34Å; L711-F716 HydrophobicContact CD2-CB 4.49Å; L711-F716 HydrophobicContact CD2-CD1 3.7Å; L711-F716 HydrophobicContact CD2-CE1 4.16Å; L711-F716 HydrophobicContact CD2-CG 4.31Å; L711-F716 HydrophobicContact CG-CD1 4.14Å; L711-F716 WeakPolarHBondContact O-CB 3.29Å; L711-F716 PolarHBondContact O-N 2.78Å
712	S	90.7	Very high	92.3	Very high	34 Å²	34	21.9 Å²	21.9	24%	0.238	12%	0.118	C	C	.	.	H	α-helix	trans	-57.8	-30.8	173.1	176.6	0	0	0	0	113.7	M708 Y710 L714 N715 T776	M708-S712 WeakPolarHBondContact O-CB 3.4Å; M708-S712 PolarHBondContact O-N 2.89Å; Y710-S712 VanDerWaalsContact C-N 3.29Å; Y710-S712 PolarHBondContact O-N 3.41Å; S712-L714 VanDerWaalsContact C-N 3.28Å; S712-N715 PolarHBondContact O-N 2.68Å; S712-T776 VanDerWaalsContact OG-CG2 3.31Å; S712-T776 WeakPolarHBondContact OG-CG2 3.36Å
713	S	90.4	Very high	92.2	Very high	86 Å²	86	21.4 Å²	21.4	60%	0.601	12%	0.115	S	C	*	.	H	α-helix	trans	-79.1	-14.1	179	74.3	0	0	0	0	113.2	K709 Y710 L711	K709-S713 PolarHBondContact O-N 3.15Å; Y710-S713 WeakPolarHBondContact O-CB 3.44Å; Y710-S713 PolarHBondContact O-N 3.02Å; Y710-S713 PolarHBondContact O-OG 2.89Å; L711-S713 PolarHBondContact O-N 3.08Å
714	L	85.4	Confident	91.9	Very high	56 Å²	56	21 Å²	21	29%	0.293	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	11.1	172.8	-57.6	-178.9	0	0	0	113.1	L640 Y710 L711 S712 F716	L640-L714 HydrophobicContact CD2-CD1 3.93Å; Y710-L714 HydrophobicContact CD1-CD1 4.4Å; Y710-L714 HydrophobicContact CE1-CD1 3.67Å; Y710-L714 HydrophobicContact CE2-CD1 4.43Å; Y710-L714 PolarHBondContact O-N 2.96Å; L711-L714 PolarHBondContact O-N 2.83Å; S712-L714 VanDerWaalsContact C-N 3.28Å; L714-F716 HydrophobicContact CB-CB 4.29Å; L714-F716 PolarHBondContact O-N 2.78Å; L714-F716 VanDerWaalsContact O-N 3.12Å
715	N	80.6	Confident	91.6	Very high	90 Å²	90	21 Å²	21	48%	0.481	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	26.9	-169	-65.4	10	0	0	0	113.6	A550 L711 S712	A550-N715 PolarHBondContact N-O 3.28Å; L711-N715 PolarHBondContact O-N 3.47Å; S712-N715 PolarHBondContact O-N 2.68Å
716	F	82.8	Confident	91.5	Very high	12 Å²	12	21 Å²	21	5%	0.053	11%	0.113	C	C	.	.			trans	-89.2	138.2	-178.9	-165.2	-95.4	0	0	0	110	A547 P549 I636 L711 L714	A547-F716 HydrophobicContact CB-CE1 3.54Å; A547-F716 HydrophobicContact CB-CE2 4.4Å; A547-F716 HydrophobicContact CB-CZ 3.39Å; P549-F716 HydrophobicContact CG-CD2 4.23Å; P549-F716 HydrophobicContact CG-CE2 4.3Å; I636-F716 HydrophobicContact CG2-CE2 3.52Å; I636-F716 HydrophobicContact CG2-CZ 3.63Å; L711-F716 HydrophobicContact CB-CB 4.19Å; L711-F716 HydrophobicContact CB-CD1 4.12Å; L711-F716 HydrophobicContact CD1-CD1 4.01Å; L711-F716 HydrophobicContact CD1-CE1 4.34Å; L711-F716 HydrophobicContact CD2-CB 4.49Å; L711-F716 HydrophobicContact CD2-CD1 3.7Å; L711-F716 HydrophobicContact CD2-CE1 4.16Å; L711-F716 HydrophobicContact CD2-CG 4.31Å; L711-F716 HydrophobicContact CG-CD1 4.14Å; L711-F716 WeakPolarHBondContact O-CB 3.29Å; L711-F716 PolarHBondContact O-N 2.78Å; L714-F716 HydrophobicContact CB-CB 4.29Å; L714-F716 PolarHBondContact O-N 2.78Å; L714-F716 VanDerWaalsContact O-N 3.12Å
717	V	85.9	Confident	91.2	Very high	2 Å²	2	21.7 Å²	21.7	1%	0.012	12%	0.116	C	C	.	.			trans	-126.2	122.7	-175	-177.3	0	0	0	0	108.7	A550 R719 F774 D779	A550-V717 HydrophobicContact CB-CB 4.47Å; A550-V717 HydrophobicContact CB-CG2 3.59Å; V717-R719 HydrophobicContact CG1-CG 3.99Å; V717-F774 HydrophobicContact CG1-CB 4.1Å; V717-D779 VanDerWaalsContact CA-OD2 3.26Å; V717-D779 WeakPolarHBondContact CA-OD2 3.38Å; V717-D779 WeakPolarHBondContact CG1-OD2 3.41Å
718	H	88.5	Confident	91.2	Very high	5 Å²	5	21.7 Å²	21.7	2%	0.023	12%	0.116	C	C	.	.			trans	-80.5	-35.2	-168.5	-165.1	-83.8	0	0	0	113.1	M708 D720 L721 I736 D779	M708-H718 HydrophobicContact CE-CB 3.93Å; M708-H718 HydrophobicContact SD-CB 4.26Å; H718-D720 PolarHBondContact CE1-O 2.96Å; H718-D720 VanDerWaalsContact CE1-O 3.26Å; H718-D720 VanDerWaalsContact ND1-C 3.32Å; H718-D720 PolarHBondContact ND1-O 2.84Å; H718-D720 PolarHBondContact O-N 3.3Å; H718-L721 PolarHBondContact ND1-N 2.96Å; H718-I736 WeakPolarHBondContact NE2-CG2 3.24Å; H718-D779 PolarHBondContact N-OD1 3.43Å; H718-D779 PolarHBondContact N-OD2 3Å
719	R	87.4	Confident	90.9	Very high	42 Å²	42	21.9 Å²	21.9	16%	0.158	12%	0.118	C	C	.	.	S	Bend	trans	66.4	-30.5	175.3	-45.6	-167.7	-166.8	-160.3	-0.8	117.1	Y546 I548 V717 F774 D779	Y546-R719 WeakPolarHBondContact O-CD 3.32Å; Y546-R719 PolarHBondContact O-NE 2.87Å; I548-R719 PolarHBondContact O-NH2 3.12Å; V717-R719 HydrophobicContact CG1-CG 3.99Å; R719-F774 HydrophobicContact CB-CD1 3.61Å; R719-F774 HydrophobicContact CB-CE1 3.69Å; R719-F774 HydrophobicContact CB-CG 4.35Å; R719-F774 HydrophobicContact CB-CZ 4.48Å; R719-F774 HydrophobicContact CG-CB 4.09Å; R719-F774 HydrophobicContact CG-CD1 3.56Å; R719-F774 HydrophobicContact CG-CE1 4.1Å; R719-F774 HydrophobicContact CG-CG 3.84Å; R719-D779 PolarHBondContact N-OD1 3.28Å
720	D	89.5	Confident	90.5	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	13%	0.134	C	C	.	.			trans	-128.3	56.6	178.5	-170.2	10.9	0	0	0	110.4	Y546 H718 R724 N725 Y750 P760	Y546-D720 HydrophobicContact CD1-CB 4.38Å; H718-D720 PolarHBondContact CE1-O 2.96Å; H718-D720 VanDerWaalsContact CE1-O 3.26Å; H718-D720 VanDerWaalsContact ND1-C 3.32Å; H718-D720 PolarHBondContact ND1-O 2.84Å; H718-D720 PolarHBondContact O-N 3.3Å; D720-R724 IonicContact OD1-CZ 3.41Å; D720-R724 IonicContact OD1-NE 2.76Å; D720-R724 IonicContact OD1-NH2 2.69Å; D720-R724 PolarHBondContact OD1-NH2 3.22Å; D720-N725 VanDerWaalsContact CG-ND2 3.26Å; D720-N725 PolarHBondContact O-ND2 2.95Å; D720-N725 PolarHBondContact OD1-ND2 3.2Å; D720-N725 PolarHBondContact OD2-ND2 3.13Å; D720-Y750 VanDerWaalsContact CG-OH 3.31Å; D720-Y750 PolarHBondContact OD1-OH 2.98Å; D720-Y750 WeakPolarHBondContact OD2-CE1 3.31Å; D720-Y750 PolarHBondContact OD2-OH 2.77Å; D720-P760 HydrophobicContact CB-CG 4.34Å
721	L	94.4	Very high	90.2	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.163	C	C	.	.			trans	-85.5	116.9	176.7	-179.6	66.9	0	0	0	110.1	I704 M708 H718 I736 W763 A782 Y783 T786	I704-L721 HydrophobicContact CG2-CD1 4.22Å; M708-L721 HydrophobicContact CE-CD2 4.14Å; M708-L721 HydrophobicContact CG-CD1 4.39Å; M708-L721 HydrophobicContact CG-CD2 3.75Å; M708-L721 HydrophobicContact SD-CD1 3.99Å; M708-L721 HydrophobicContact SD-CD2 3.84Å; M708-L721 HydrophobicContact SD-CG 4.46Å; H718-L721 PolarHBondContact ND1-N 2.96Å; L721-I736 HydrophobicContact CD1-CD1 4.39Å; L721-I736 HydrophobicContact CD1-CG2 3.88Å; L721-W763 VanDerWaalsContact O-CD1 3.24Å; L721-A782 HydrophobicContact CB-CB 4.1Å; L721-Y783 HydrophobicContact CD2-CD2 4.31Å; L721-T786 PolarHBondContact O-OG1 2.83Å
722	A	95	Very high	90.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	-160	165.1	-178.9	0	0	0	0	0	109.6	R724 N725 W763	A722-R724 VanDerWaalsContact C-N 3.28Å; A722-R724 HydrophobicContact CB-CG 3.9Å; A722-R724 VanDerWaalsContact CB-CZ 3.45Å; A722-R724 PolarHBondContact O-N 2.78Å; A722-N725 PolarHBondContact O-N 2.86Å; A722-W763 HydrophobicContact CB-CD2 4.17Å; A722-W763 HydrophobicContact CB-CG 4.16Å; A722-W763 HydrophobicContact CB-CZ2 4.29Å; A722-W763 VanDerWaalsContact CB-NE1 3.29Å
723	T	95.4	Very high	90.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-60.7	-34.5	-179.4	61.1	0	0	0	0	113.7	L670 N671 N725 C726 T786 E789 I790 C794	L670-T723 HydrophobicContact CD2-CG2 4.19Å; L670-T723 HydrophobicContact CG-CG2 4.37Å; N671-T723 VanDerWaalsContact CB-OG1 3.3Å; N671-T723 WeakPolarHBondContact CB-OG1 3.45Å; N671-T723 PolarHBondContact ND2-OG1 2.97Å; T723-N725 PolarHBondContact O-N 2.85Å; T723-N725 VanDerWaalsContact O-N 3.09Å; T723-C726 PolarHBondContact O-N 3.25Å; T723-T786 HydrophobicContact CG2-CG2 3.94Å; T723-E789 WeakPolarHBondContact CB-OE1 3.48Å; T723-E789 HydrophobicContact CG2-CB 3.52Å; T723-E789 HydrophobicContact CG2-CG 4.23Å; T723-E789 PolarHBondContact N-OE1 2.98Å; T723-E789 PolarHBondContact N-OE2 3.13Å; T723-E789 PolarHBondContact OG1-OE1 3.41Å; T723-I790 HydrophobicContact CG2-CG1 3.85Å; T723-C794 PolarHBondContact OG1-SG 3.26Å
724	R	91.9	Very high	90.9	Very high	6 Å²	6	29.8 Å²	29.8	2%	0.023	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-58.8	-17.4	173.8	61.7	173	179.2	-79.5	-16.1	114.9	N671 D720 A722 Y746 D749 Y750	N671-R724 HydrophobicContact CB-CB 4.39Å; D720-R724 IonicContact OD1-CZ 3.41Å; D720-R724 IonicContact OD1-NE 2.76Å; D720-R724 IonicContact OD1-NH2 2.69Å; D720-R724 PolarHBondContact OD1-NH2 3.22Å; A722-R724 VanDerWaalsContact C-N 3.28Å; A722-R724 HydrophobicContact CB-CG 3.9Å; A722-R724 VanDerWaalsContact CB-CZ 3.45Å; A722-R724 PolarHBondContact O-N 2.78Å; R724-Y746 HydrophobicContact CB-CD1 4.3Å; R724-Y746 HydrophobicContact CB-CD2 3.78Å; R724-Y746 HydrophobicContact CB-CE1 4.29Å; R724-Y746 HydrophobicContact CB-CE2 3.75Å; R724-Y746 HydrophobicContact CB-CG 4.07Å; R724-D749 IonicContact CZ-OD2 3.56Å; R724-D749 IonicContact NE-OD2 3.42Å; R724-D749 VanDerWaalsContact NH1-CG 3.34Å; R724-D749 IonicContact NH1-OD2 3.19Å; R724-D749 PolarHBondContact NH1-OD2 2.96Å; R724-Y750 PolarHBondContact NE-OH 2.91Å
725	N	92.3	Very high	91.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-111.9	16.6	-179.7	-68.7	-16.2	0	0	0	112	D720 A722 T723 A737 S742	D720-N725 VanDerWaalsContact CG-ND2 3.26Å; D720-N725 PolarHBondContact O-ND2 2.95Å; D720-N725 PolarHBondContact OD1-ND2 3.2Å; D720-N725 PolarHBondContact OD2-ND2 3.13Å; A722-N725 PolarHBondContact O-N 2.86Å; T723-N725 PolarHBondContact O-N 2.85Å; T723-N725 VanDerWaalsContact O-N 3.09Å; N725-A737 PolarHBondContact O-N 3.19Å; N725-A737 VanDerWaalsContact O-O 3.13Å; N725-S742 PolarHBondContact OD1-OG 3.08Å
726	C	94.7	Very high	92	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	133.2	169.5	-68.3	0	0	0	0	109.2	D669 L670 T723 I734 K735	D669-C726 CarbonylContact C-O 3.35Å; D669-C726 VanDerWaalsContact CA-O 3.31Å; D669-C726 WeakPolarHBondContact CA-O 3.2Å; L670-C726 HydrophobicContact CB-CB 3.98Å; L670-C726 HydrophobicContact CD2-CB 4.08Å; L670-C726 PolarHBondContact N-O 2.79Å; T723-C726 PolarHBondContact O-N 3.25Å; C726-I734 HydrophobicContact CB-CG2 4.01Å; C726-K735 CarbonylContact C-O 3.47Å; C726-K735 WeakPolarHBondContact CA-O 3.26Å
727	L	93.6	Very high	92.1	Very high	29 Å²	29	22.7 Å²	22.7	15%	0.152	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	151.1	175.3	-62.5	-168.6	0	0	0	112.5	I646 M665 G668 D669 I734 K735 F739	I646-L727 HydrophobicContact CD1-CD1 4.37Å; M665-L727 HydrophobicContact CB-CB 3.72Å; M665-L727 HydrophobicContact CB-CD1 3.86Å; M665-L727 HydrophobicContact CB-CG 4.43Å; M665-L727 HydrophobicContact CE-CB 4.12Å; M665-L727 WeakPolarHBondContact CE-O 3.2Å; M665-L727 HydrophobicContact CG-CB 3.75Å; M665-L727 HydrophobicContact CG-CD1 3.85Å; M665-L727 HydrophobicContact CG-CG 4.48Å; G668-L727 CarbonylContact O-C 3.59Å; G668-L727 WeakPolarHBondContact O-CA 3.09Å; D669-L727 HydrophobicContact CB-CD2 3.98Å; L727-I734 WeakPolarHBondContact O-CA 3.43Å; L727-K735 PolarHBondContact N-O 3.27Å; L727-K735 PolarHBondContact O-N 3.24Å; L727-F739 HydrophobicContact CD1-CD2 4.36Å; L727-F739 HydrophobicContact CD1-CE2 3.44Å; L727-F739 VanDerWaalsContact CD1-CE2 3.44Å; L727-F739 HydrophobicContact CD1-CZ 4.06Å; L727-F739 HydrophobicContact CD2-CD2 4.4Å; L727-F739 HydrophobicContact CD2-CE2 4.24Å; L727-F739 HydrophobicContact CG-CD2 4.34Å; L727-F739 HydrophobicContact CG-CE2 3.78Å
728	V	95.4	Very high	91.2	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	123.7	-178.5	-168.7	0	0	0	0	110.6	M665 N667 G668 L670 F673 I734	M665-V728 CarbonylContact C-O 3.52Å; N667-V728 HydrophobicContact CB-CB 3.78Å; N667-V728 HydrophobicContact CB-CG1 3.83Å; N667-V728 WeakPolarHBondContact CB-O 3.47Å; N667-V728 PolarHBondContact N-O 3.43Å; N667-V728 VanDerWaalsContact N-O 3.09Å; G668-V728 PolarHBondContact O-N 3.04Å; L670-V728 HydrophobicContact CB-CG2 3.88Å; L670-V728 HydrophobicContact CD1-CG2 3.71Å; L670-V728 HydrophobicContact CG-CG2 4.42Å; F673-V728 HydrophobicContact CB-CG2 3.87Å; F673-V728 HydrophobicContact CD1-CG1 4.23Å; F673-V728 HydrophobicContact CD1-CG2 4.25Å; F673-V728 HydrophobicContact CD2-CB 4.49Å; F673-V728 HydrophobicContact CD2-CG1 4.24Å; F673-V728 HydrophobicContact CE1-CG1 4.3Å; F673-V728 HydrophobicContact CE2-CG1 4.29Å; F673-V728 HydrophobicContact CG-CB 4.35Å; F673-V728 HydrophobicContact CG-CG1 4.2Å; F673-V728 HydrophobicContact CG-CG2 3.99Å; F673-V728 HydrophobicContact CZ-CG1 4.32Å; V728-I734 HydrophobicContact CB-CD1 4.32Å; V728-I734 HydrophobicContact CG1-CD1 4.22Å; V728-I734 HydrophobicContact CG2-CD1 3.82Å
729	G	91.3	Very high	89.5	Confident	5 Å²	5	24.6 Å²	24.6	5%	0.052	12%	0.12	C	C	.	.			trans	-103.9	-156.2	177.3	0	0	0	0	0	112.1	N667 T733	N667-G729 PolarHBondContact ND2-O 2.89Å; G729-T733 PolarHBondContact N-O 3.24Å
730	K	88.4	Confident	87.9	Confident	126 Å²	126	22.9 Å²	22.9	55%	0.548	12%	0.115	S	C	.	.	G	3₁₀ helix	trans	-62.6	149.8	171.1	-72	175	-175.3	-177.7	0	111	E666 Y732 T733	E666-K730 HydrophobicContact CG-CG 4.44Å; E666-K730 WeakPolarHBondContact OE1-CG 3.26Å; E666-K730 WeakPolarHBondContact OE2-CE 3.17Å; E666-K730 IonicContact OE2-NZ 2.8Å; K730-Y732 VanDerWaalsContact C-N 3.26Å; K730-Y732 PolarHBondContact O-N 3.32Å; K730-T733 VanDerWaalsContact O-CB 3.26Å; K730-T733 WeakPolarHBondContact O-CB 3.23Å; K730-T733 PolarHBondContact O-N 3.01Å; K730-T733 PolarHBondContact O-OG1 3.31Å
731	N	90	Very high	86	Confident	144 Å²	144	24.5 Å²	24.5	77%	0.77	12%	0.123	S	C	*	.	G	3₁₀ helix	trans	51.5	39.9	172.8	-52.4	-20.3	0	0	0	113.9	T733	N731-T733 PolarHBondContact O-N 3.36Å
732	Y	93.6	Very high	84.2	Confident	60 Å²	60	25 Å²	25	24%	0.235	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	55.2	27.8	-175	-49.1	-66.4	0	0	0	114.9	F673 V692 D696 M700 Q703 K730 I734	F673-Y732 AromaticContact CE1-CD1 3.83Å; F673-Y732 HydrophobicContact CE1-CD1 3.83Å; F673-Y732 AromaticContact CE1-CE1 3.78Å; F673-Y732 HydrophobicContact CE1-CE1 3.78Å; F673-Y732 AromaticContact CZ-CD1 3.93Å; F673-Y732 HydrophobicContact CZ-CD1 3.93Å; F673-Y732 AromaticContact CZ-CE1 3.72Å; F673-Y732 HydrophobicContact CZ-CE1 3.72Å; V692-Y732 HydrophobicContact CG2-CE1 4.27Å; D696-Y732 HydrophobicContact CB-CD2 4.07Å; D696-Y732 HydrophobicContact CB-CE2 4Å; D696-Y732 VanDerWaalsContact CG-CE2 3.41Å; D696-Y732 WeakPolarHBondContact OD1-CD2 3.33Å; D696-Y732 VanDerWaalsContact OD1-CE2 3.26Å; D696-Y732 WeakPolarHBondContact OD1-CE2 3.21Å; M700-Y732 HydrophobicContact CE-CD1 3.7Å; M700-Y732 HydrophobicContact CE-CE1 4.23Å; M700-Y732 HydrophobicContact CE-CG 4Å; M700-Y732 HydrophobicContact SD-CD1 4.47Å; Q703-Y732 PolarHBondContact NE2-O 3.43Å; K730-Y732 VanDerWaalsContact C-N 3.26Å; K730-Y732 PolarHBondContact O-N 3.32Å; Y732-I734 PolarHBondContact O-N 2.9Å
733	T	95	Very high	82.4	Confident	47 Å²	47	26 Å²	26	29%	0.288	13%	0.131	S	C	.	.			trans	-64.9	123.6	173.6	-56.2	0	0	0	0	109.8	M665 G729 K730 N731	M665-T733 WeakPolarHBondContact CE-O 3.19Å; G729-T733 PolarHBondContact N-O 3.24Å; K730-T733 VanDerWaalsContact O-CB 3.26Å; K730-T733 WeakPolarHBondContact O-CB 3.23Å; K730-T733 PolarHBondContact O-N 3.01Å; K730-T733 PolarHBondContact O-OG1 3.31Å; N731-T733 PolarHBondContact O-N 3.36Å
734	I	97.2	Very high	80.9	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	136.7	-179.8	-55.2	-57.5	0	0	0	111.5	N644 L670 M700 Q703 I704 C726 L727 V728 Y732	N644-I734 WeakPolarHBondContact CA-O 3.07Å; N644-I734 PolarHBondContact ND2-O 3.45Å; L670-I734 HydrophobicContact CD1-CD1 3.97Å; L670-I734 HydrophobicContact CD2-CD1 4.38Å; M700-I734 HydrophobicContact CB-CD1 4.21Å; M700-I734 HydrophobicContact CB-CG1 3.76Å; M700-I734 HydrophobicContact CG-CD1 3.79Å; M700-I734 HydrophobicContact CG-CG1 3.7Å; M700-I734 HydrophobicContact SD-CD1 4.03Å; Q703-I734 HydrophobicContact CB-CB 4.03Å; Q703-I734 HydrophobicContact CB-CG1 4.48Å; I704-I734 HydrophobicContact CD1-CG2 4.16Å; I704-I734 HydrophobicContact CG1-CG2 3.61Å; C726-I734 HydrophobicContact CB-CG2 4.01Å; L727-I734 WeakPolarHBondContact O-CA 3.43Å; V728-I734 HydrophobicContact CB-CD1 4.32Å; V728-I734 HydrophobicContact CG1-CD1 4.22Å; V728-I734 HydrophobicContact CG2-CD1 3.82Å; Y732-I734 PolarHBondContact O-N 2.9Å
735	K	94.9	Very high	79.8	Confident	3 Å²	3	35.9 Å²	35.9	1%	0.013	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	129.6	170.5	-66.3	173.2	178.9	-93	0	112	Y601 P643 N644 I646 E663 M665 C726 L727	Y601-K735 WeakPolarHBondContact OH-CE 3.41Å; Y601-K735 PolarHBondContact OH-NZ 3.19Å; P643-K735 WeakPolarHBondContact O-CE 3.45Å; P643-K735 WeakPolarHBondContact O-CG 3.41Å; P643-K735 PolarHBondContact O-NZ 2.93Å; N644-K735 WeakPolarHBondContact O-CA 3.34Å; I646-K735 HydrophobicContact CD1-CD 4.28Å; E663-K735 VanDerWaalsContact CD-NZ 3.29Å; E663-K735 HydrophobicContact CG-CD 4.4Å; E663-K735 WeakPolarHBondContact OE1-CD 3.28Å; E663-K735 WeakPolarHBondContact OE1-CE 3.44Å; E663-K735 IonicContact OE1-NZ 2.74Å; E663-K735 PolarHBondContact OE1-NZ 2.84Å; E663-K735 WeakPolarHBondContact OE2-CE 3.48Å; E663-K735 IonicContact OE2-NZ 2.73Å; E663-K735 PolarHBondContact OE2-NZ 2.76Å; E663-K735 VanDerWaalsContact OE2-NZ 3.12Å; M665-K735 HydrophobicContact CE-CB 3.96Å; M665-K735 HydrophobicContact CE-CD 3.74Å; M665-K735 HydrophobicContact CE-CG 3.82Å; M665-K735 HydrophobicContact SD-CD 3.77Å; C726-K735 CarbonylContact C-O 3.47Å; C726-K735 WeakPolarHBondContact CA-O 3.26Å; L727-K735 PolarHBondContact N-O 3.27Å; L727-K735 PolarHBondContact O-N 3.24Å
736	I	94.3	Very high	79.1	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	143	176.6	-45.5	175.1	0	0	0	109.8	N644 I645 I646 I704 M708 H718 L721	N644-I736 PolarHBondContact O-N 2.76Å; I645-I736 HydrophobicContact CD1-CB 3.92Å; I645-I736 HydrophobicContact CD1-CD1 4.12Å; I645-I736 HydrophobicContact CD1-CG1 4.28Å; I646-I736 PolarHBondContact N-O 2.91Å; I704-I736 HydrophobicContact CB-CD1 4.49Å; I704-I736 HydrophobicContact CG2-CD1 3.88Å; I704-I736 HydrophobicContact CG2-CG1 4.33Å; M708-I736 HydrophobicContact CG-CD1 3.6Å; M708-I736 HydrophobicContact SD-CD1 3.67Å; H718-I736 WeakPolarHBondContact NE2-CG2 3.24Å; L721-I736 HydrophobicContact CD1-CD1 4.39Å; L721-I736 HydrophobicContact CD1-CG2 3.88Å
737	A	85.1	Confident	78.3	Confident	4 Å²	4	40.1 Å²	40.1	3%	0.033	21%	0.208	C	C	.	.			trans	-154	139.6	-177.8	0	0	0	0	0	114.7	I646 N725 F739	I646-A737 HydrophobicContact CB-CB 3.97Å; I646-A737 HydrophobicContact CG2-CB 3.52Å; N725-A737 PolarHBondContact O-N 3.19Å; N725-A737 VanDerWaalsContact O-O 3.13Å; A737-F739 VanDerWaalsContact C-N 3.28Å; A737-F739 HydrophobicContact CB-CD2 3.35Å; A737-F739 HydrophobicContact CB-CE2 3.11Å; A737-F739 HydrophobicContact CB-CG 4.17Å; A737-F739 HydrophobicContact CB-CZ 3.81Å; A737-F739 PolarHBondContact O-N 3.15Å
738	D	67.4	Low	77.6	Confident	25 Å²	25	41.1 Å²	41.1	13%	0.134	23%	0.225	C	C	.	.			trans	-81.8	67.8	172.2	-170.8	1.3	0	0	0	111.3	Y546 A547 G740	Y546-D738 PolarHBondContact N-OD2 3.05Å; A547-D738 HydrophobicContact CB-CB 4.44Å; A547-D738 PolarHBondContact N-OD2 2.79Å; D738-G740 PolarHBondContact O-N 2.87Å
739	F	52.2	Low	77	Confident	22 Å²	22	41.9 Å²	41.9	10%	0.096	23%	0.229	C	C	.	.			trans	-85.8	84.3	174.1	-67.6	-55.6	0	0	0	111.6	I646 L727 A737 M741 S742	I646-F739 HydrophobicContact CG1-CZ 4.28Å; L727-F739 HydrophobicContact CD1-CD2 4.36Å; L727-F739 HydrophobicContact CD1-CE2 3.44Å; L727-F739 VanDerWaalsContact CD1-CE2 3.44Å; L727-F739 HydrophobicContact CD1-CZ 4.06Å; L727-F739 HydrophobicContact CD2-CD2 4.4Å; L727-F739 HydrophobicContact CD2-CE2 4.24Å; L727-F739 HydrophobicContact CG-CD2 4.34Å; L727-F739 HydrophobicContact CG-CE2 3.78Å; A737-F739 VanDerWaalsContact C-N 3.28Å; A737-F739 HydrophobicContact CB-CD2 3.35Å; A737-F739 HydrophobicContact CB-CE2 3.11Å; A737-F739 HydrophobicContact CB-CG 4.17Å; A737-F739 HydrophobicContact CB-CZ 3.81Å; A737-F739 PolarHBondContact O-N 3.15Å; F739-M741 HydrophobicContact CB-CE 4.12Å; F739-M741 HydrophobicContact CD1-CE 3.82Å; F739-M741 HydrophobicContact CG-CE 4.06Å; F739-M741 PolarHBondContact O-N 2.94Å; F739-S742 PolarHBondContact O-N 3.08Å; F739-S742 PolarHBondContact O-OG 2.64Å; F739-S742 VanDerWaalsContact O-OG 3.08Å
740	G	54.4	Low	76.6	Confident	5 Å²	5	42 Å²	42	5%	0.052	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	23.2	166	0	0	0	0	0	116.4	D738	D738-G740 PolarHBondContact O-N 2.87Å
741	M	50	Low	76.3	Confident	36 Å²	36	38.3 Å²	38.3	18%	0.177	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-29.1	166.2	-53.2	-176	-65	0	0	111.9	V585 F739 R743 N744	V585-M741 HydrophobicContact CB-CE 3.85Å; V585-M741 HydrophobicContact CB-SD 3.61Å; V585-M741 HydrophobicContact CG1-CE 4.47Å; V585-M741 HydrophobicContact CG2-CE 3.54Å; V585-M741 HydrophobicContact CG2-SD 3.26Å; V585-M741 WeakPolarHBondContact CG2-SD 3.47Å; F739-M741 HydrophobicContact CB-CE 4.12Å; F739-M741 HydrophobicContact CD1-CE 3.82Å; F739-M741 HydrophobicContact CG-CE 4.06Å; F739-M741 PolarHBondContact O-N 2.94Å; M741-R743 PolarHBondContact O-N 3.19Å; M741-R743 VanDerWaalsContact O-N 3.1Å; M741-N744 PolarHBondContact O-N 3.33Å; M741-N744 VanDerWaalsContact O-N 3.12Å
742	S	55.6	Low	75.3	Confident	12 Å²	12	38.5 Å²	38.5	8%	0.084	20%	0.201	C	C	.	.	H	α-helix	trans	-54.6	-33.8	-177.1	55.3	0	0	0	0	111.8	N725 F739 N744 L745 Y746	N725-S742 PolarHBondContact OD1-OG 3.08Å; F739-S742 PolarHBondContact O-N 3.08Å; F739-S742 PolarHBondContact O-OG 2.64Å; F739-S742 VanDerWaalsContact O-OG 3.08Å; S742-N744 PolarHBondContact O-N 2.53Å; S742-L745 PolarHBondContact O-N 2.87Å; S742-Y746 WeakPolarHBondContact O-CB 3.29Å; S742-Y746 WeakPolarHBondContact O-CD2 3.31Å; S742-Y746 PolarHBondContact O-N 3.3Å
743	R	58.3	Low	73.5	Confident	20 Å²	20	37.4 Å²	37.4	8%	0.075	20%	0.199	C	C	.	.	H	α-helix	trans	-54.1	-21.4	177.6	-52	-172.4	-169.5	124.1	15.9	116.2	N544 Y546 M741 S747 Y750	N544-R743 PolarHBondContact O-NH1 3.01Å; N544-R743 PolarHBondContact O-NH2 2.93Å; Y546-R743 VanDerWaalsContact CE2-NH1 3.28Å; Y546-R743 VanDerWaalsContact CG-NH2 3.28Å; Y546-R743 VanDerWaalsContact CZ-CZ 3.4Å; M741-R743 PolarHBondContact O-N 3.19Å; M741-R743 VanDerWaalsContact O-N 3.1Å; R743-S747 WeakPolarHBondContact O-CA 3.45Å; R743-Y750 HydrophobicContact CB-CD2 4.39Å; R743-Y750 HydrophobicContact CB-CE2 4.26Å; R743-Y750 HydrophobicContact CG-CD1 4.48Å; R743-Y750 HydrophobicContact CG-CD2 4.22Å; R743-Y750 HydrophobicContact CG-CE1 4.07Å; R743-Y750 HydrophobicContact CG-CE2 3.79Å
744	N	62.6	Low	71	Confident	97 Å²	97	44.3 Å²	44.3	52%	0.519	23%	0.228	S	C	.	.	H	α-helix	trans	-84.2	-35	175.9	-79.6	-17.4	0	0	0	112.6	E579 M741 S742	E579-N744 PolarHBondContact O-ND2 3.49Å; M741-N744 PolarHBondContact O-N 3.33Å; M741-N744 VanDerWaalsContact O-N 3.12Å; S742-N744 PolarHBondContact O-N 2.53Å
745	L	69.5	Low	68.3	Low	117 Å²	117	48.7 Å²	48.7	61%	0.613	27%	0.273	S	S	*	.	H	α-helix	trans	-86.9	-41.1	178.5	-177	60.1	0	0	0	111.5	S742 S747	S742-L745 PolarHBondContact O-N 2.87Å; L745-S747 PolarHBondContact O-N 3.17Å
746	Y	78.6	Confident	66.3	Low	32 Å²	32	53.3 Å²	53.3	13%	0.125	29%	0.29	C	S	.	.	S	Bend	trans	-97.2	36.4	-178.7	-65.1	-79.9	0	0	0	112.1	D669 N671 Q672 R724 S742 G748 D749 Y750	D669-Y746 PolarHBondContact OD1-OH 2.71Å; N671-Y746 HydrophobicContact CB-CE1 4.32Å; N671-Y746 WeakPolarHBondContact OD1-CE1 3.46Å; N671-Y746 PolarHBondContact OD1-OH 3.19Å; N671-Y746 VanDerWaalsContact OD1-OH 3.06Å; Q672-Y746 WeakPolarHBondContact CG-OH 3.43Å; R724-Y746 HydrophobicContact CB-CD1 4.3Å; R724-Y746 HydrophobicContact CB-CD2 3.78Å; R724-Y746 HydrophobicContact CB-CE1 4.29Å; R724-Y746 HydrophobicContact CB-CE2 3.75Å; R724-Y746 HydrophobicContact CB-CG 4.07Å; S742-Y746 WeakPolarHBondContact O-CB 3.29Å; S742-Y746 WeakPolarHBondContact O-CD2 3.31Å; S742-Y746 PolarHBondContact O-N 3.3Å; Y746-G748 PolarHBondContact O-N 3Å; Y746-D749 WeakPolarHBondContact O-CB 3.44Å; Y746-D749 PolarHBondContact O-N 2.9Å; Y746-Y750 WeakPolarHBondContact O-CD2 3.21Å
747	S	77.2	Confident	64.6	Low	57 Å²	57	53.8 Å²	53.8	40%	0.399	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-61.2	-21.8	-172	63.2	0	0	0	0	114.4	R743 L745	R743-S747 WeakPolarHBondContact O-CA 3.45Å; L745-S747 PolarHBondContact O-N 3.17Å
748	G	78.9	Confident	64	Low	49 Å²	49	55.6 Å²	55.6	51%	0.505	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-82	-6.1	174.5	0	0	0	0	0	115.3	Y746 Y750 Q797	Y746-G748 PolarHBondContact O-N 3Å; G748-Y750 VanDerWaalsContact C-N 3.32Å; G748-Q797 PolarHBondContact O-NE2 2.9Å
749	D	83.4	Confident	64.7	Low	17 Å²	17	54.7 Å²	54.7	9%	0.091	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-83.6	-11.8	170.3	-74.7	-11.9	0	0	0	112.7	R724 Y746 P760 W763 Q797	R724-D749 IonicContact CZ-OD2 3.56Å; R724-D749 IonicContact NE-OD2 3.42Å; R724-D749 VanDerWaalsContact NH1-CG 3.34Å; R724-D749 IonicContact NH1-OD2 3.19Å; R724-D749 PolarHBondContact NH1-OD2 2.96Å; Y746-D749 WeakPolarHBondContact O-CB 3.44Å; Y746-D749 PolarHBondContact O-N 2.9Å; D749-P760 WeakPolarHBondContact O-CA 3.42Å; D749-W763 HydrophobicContact CB-CH2 4.02Å; D749-W763 HydrophobicContact CB-CZ3 3.74Å; D749-W763 VanDerWaalsContact CG-CH2 3.42Å; D749-W763 WeakPolarHBondContact OD1-CH2 3.21Å; D749-Q797 PolarHBondContact OD1-NE2 3.46Å
750	Y	82.9	Confident	66.5	Low	6 Å²	6	53.9 Å²	53.9	2%	0.024	30%	0.297	C	S	.	.	S	Bend	trans	-119.5	110.2	-171.2	-66.1	-89.2	0	0	0	112	D720 R724 R743 Y746 G748 V758 L759 P760	D720-Y750 VanDerWaalsContact CG-OH 3.31Å; D720-Y750 PolarHBondContact OD1-OH 2.98Å; D720-Y750 WeakPolarHBondContact OD2-CE1 3.31Å; D720-Y750 PolarHBondContact OD2-OH 2.77Å; R724-Y750 PolarHBondContact NE-OH 2.91Å; R743-Y750 HydrophobicContact CB-CD2 4.39Å; R743-Y750 HydrophobicContact CB-CE2 4.26Å; R743-Y750 HydrophobicContact CG-CD1 4.48Å; R743-Y750 HydrophobicContact CG-CD2 4.22Å; R743-Y750 HydrophobicContact CG-CE1 4.07Å; R743-Y750 HydrophobicContact CG-CE2 3.79Å; Y746-Y750 WeakPolarHBondContact O-CD2 3.21Å; G748-Y750 VanDerWaalsContact C-N 3.32Å; Y750-V758 HydrophobicContact CD1-CG1 4.08Å; Y750-V758 HydrophobicContact CG-CG1 4.08Å; Y750-L759 CarbonylContact C-O 3.6Å; Y750-L759 WeakPolarHBondContact CA-O 3.4Å; Y750-P760 HydrophobicContact CD1-CB 4.07Å; Y750-P760 HydrophobicContact CE1-CB 3.85Å; Y750-P760 HydrophobicContact CE1-CG 4.25Å
751	Y	81.4	Confident	68.3	Low	49 Å²	49	53.8 Å²	53.8	19%	0.192	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	139.8	171.5	-171.9	-120.4	0	0	0	110.6	I534 I753 L759 I761 D804 I808	I534-Y751 HydrophobicContact CD1-CD1 4.17Å; I534-Y751 HydrophobicContact CD1-CE1 3.55Å; Y751-I753 HydrophobicContact CD1-CD1 4.19Å; Y751-I753 HydrophobicContact CD1-CG1 3.76Å; Y751-I753 HydrophobicContact CE1-CD1 3.84Å; Y751-I753 HydrophobicContact CE1-CG1 3.33Å; Y751-L759 PolarHBondContact N-O 2.04Å; Y751-L759 PolarHBondContact O-N 3.26Å; Y751-I761 HydrophobicContact CG-CD1 4.1Å; Y751-D804 HydrophobicContact CD2-CB 3.64Å; Y751-D804 WeakPolarHBondContact CD2-OD2 3.16Å; Y751-D804 HydrophobicContact CE2-CB 3.96Å; Y751-D804 HydrophobicContact CG-CB 4.45Å; Y751-I808 HydrophobicContact CD1-CD1 4.09Å; Y751-I808 HydrophobicContact CE1-CD1 3.75Å
752	R	69.8	Low	70.5	Confident	148 Å²	148	52.6 Å²	52.6	56%	0.558	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.3	96.5	-172.8	-65.7	-178.9	-178.4	-179.4	-2	111	V758	R752-V758 HydrophobicContact CG-CG1 4.21Å; R752-V758 HydrophobicContact CG-CG2 4.31Å
753	I	55.5	Low	72.4	Confident	38 Å²	38	52.2 Å²	52.2	20%	0.195	29%	0.285	C	S	.	.			trans	-84.3	133.6	171.8	-49.8	163.5	0	0	0	108.3	I534 Y751 G755 R756	I534-I753 HydrophobicContact CB-CD1 4.31Å; I534-I753 HydrophobicContact CD1-CD1 3.88Å; I534-I753 HydrophobicContact CG2-CD1 4.32Å; Y751-I753 HydrophobicContact CD1-CD1 4.19Å; Y751-I753 HydrophobicContact CD1-CG1 3.76Å; Y751-I753 HydrophobicContact CE1-CD1 3.84Å; Y751-I753 HydrophobicContact CE1-CG1 3.33Å; I753-G755 PolarHBondContact O-N 3.35Å; I753-R756 HydrophobicContact CB-CB 4.06Å; I753-R756 HydrophobicContact CB-CG 4.12Å; I753-R756 HydrophobicContact CG2-CB 4.39Å; I753-R756 HydrophobicContact CG2-CG 3.88Å; I753-R756 PolarHBondContact O-N 3.31Å; I753-R756 VanDerWaalsContact O-N 3.14Å
754	Q	41.4	Very low	74.1	Confident	192 Å²	192	51.7 Å²	51.7	90%	0.897	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	129	178.1	-63	-170.4	11.1	0	0	110.6	R756	Q754-R756 VanDerWaalsContact C-N 3.26Å; Q754-R756 PolarHBondContact O-N 2.73Å
755	G	41.8	Very low	75.7	Confident	91 Å²	91	47.1 Å²	47.1	94%	0.938	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.7	-4.4	-179.2	0	0	0	0	0	116.8	I753	I753-G755 PolarHBondContact O-N 3.35Å
756	R	52.7	Low	76.8	Confident	101 Å²	101	42.8 Å²	42.8	38%	0.381	24%	0.235	S	C	.	.	S	Bend	trans	-110.6	-173	178.6	-44.7	-173.3	-173.6	172.1	3.1	112.4	I534 N536 I753 Q754	I534-R756 PolarHBondContact O-NH1 2.89Å; I534-R756 VanDerWaalsContact O-NH1 3.1Å; N536-R756 WeakPolarHBondContact OD1-CD 3.25Å; I753-R756 HydrophobicContact CB-CB 4.06Å; I753-R756 HydrophobicContact CB-CG 4.12Å; I753-R756 HydrophobicContact CG2-CB 4.39Å; I753-R756 HydrophobicContact CG2-CG 3.88Å; I753-R756 PolarHBondContact O-N 3.31Å; I753-R756 VanDerWaalsContact O-N 3.14Å; Q754-R756 VanDerWaalsContact C-N 3.26Å; Q754-R756 PolarHBondContact O-N 2.73Å
757	A	57.6	Low	77.1	Confident	11 Å²	11	41.6 Å²	41.6	9%	0.091	23%	0.231	C	C	.	.			trans	-61.7	159.4	175.5	0	0	0	0	0	113.2	L537 V540 L759	L537-A757 HydrophobicContact CB-CB 4.32Å; V540-A757 HydrophobicContact CB-CB 3.71Å; V540-A757 HydrophobicContact CG1-CB 4.12Å; V540-A757 HydrophobicContact CG2-CB 4.19Å; A757-L759 HydrophobicContact CB-CD2 3.66Å; A757-L759 HydrophobicContact CB-CG 4.11Å
758	V	72.5	Confident	77.6	Confident	43 Å²	43	39 Å²	39	26%	0.261	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	122.8	174.2	175.9	0	0	0	0	108.2	Y546 Y750 R752	Y546-V758 WeakPolarHBondContact CE1-O 3.5Å; Y546-V758 PolarHBondContact OH-O 2.73Å; Y546-V758 VanDerWaalsContact OH-O 3.12Å; Y750-V758 HydrophobicContact CD1-CG1 4.08Å; Y750-V758 HydrophobicContact CG-CG1 4.08Å; R752-V758 HydrophobicContact CG-CG1 4.21Å; R752-V758 HydrophobicContact CG-CG2 4.31Å
759	L	82.8	Confident	77.8	Confident	5 Å²	5	36.7 Å²	36.7	3%	0.026	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	125.4	-153.9	-62.4	177.9	0	0	0	114.2	I534 L537 Y750 Y751 A757 I761 M764	I534-L759 HydrophobicContact CG2-CD1 4.33Å; L537-L759 HydrophobicContact CB-CD2 4.41Å; L537-L759 HydrophobicContact CD1-CD1 3.78Å; L537-L759 HydrophobicContact CD1-CD2 4.18Å; L537-L759 HydrophobicContact CD2-CD2 3.7Å; L537-L759 HydrophobicContact CG-CD2 4.31Å; Y750-L759 CarbonylContact C-O 3.6Å; Y750-L759 WeakPolarHBondContact CA-O 3.4Å; Y751-L759 PolarHBondContact N-O 2.04Å; Y751-L759 PolarHBondContact O-N 3.26Å; A757-L759 HydrophobicContact CB-CD2 3.66Å; A757-L759 HydrophobicContact CB-CG 4.11Å; L759-I761 HydrophobicContact CB-CG2 3.85Å; L759-I761 PolarHBondContact O-N 2.97Å; L759-M764 HydrophobicContact CB-SD 4.24Å
760	P	90.4	Very high	77.6	Confident	5 Å²	5	36.9 Å²	36.9	3%	0.032	19%	0.189	C	C	.	.			trans	-79.7	57.2	177.6	35.3	-36.8	0	0	0	111.9	D720 D749 Y750 R762 W763 M764	D720-P760 HydrophobicContact CB-CG 4.34Å; D749-P760 WeakPolarHBondContact O-CA 3.42Å; Y750-P760 HydrophobicContact CD1-CB 4.07Å; Y750-P760 HydrophobicContact CE1-CB 3.85Å; Y750-P760 HydrophobicContact CE1-CG 4.25Å; P760-R762 PolarHBondContact O-N 2.89Å; P760-W763 HydrophobicContact CB-CE3 4.36Å; P760-W763 PolarHBondContact O-N 2.96Å; P760-M764 HydrophobicContact CG-CG 4.22Å; P760-M764 HydrophobicContact CG-SD 4.26Å; P760-M764 PolarHBondContact O-N 3.2Å
761	I	91.6	Very high	77.2	Confident	3 Å²	3	41.1 Å²	41.1	2%	0.015	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-33.2	-166.1	56.5	164.9	0	0	0	114.2	Y751 L759 W763 M764 I769 D804 V807 I808	Y751-I761 HydrophobicContact CG-CD1 4.1Å; L759-I761 HydrophobicContact CB-CG2 3.85Å; L759-I761 PolarHBondContact O-N 2.97Å; I761-W763 PolarHBondContact O-N 2.77Å; I761-M764 HydrophobicContact CG2-SD 4.35Å; I761-M764 PolarHBondContact O-N 3.15Å; I761-I769 HydrophobicContact CB-CD1 3.91Å; I761-I769 HydrophobicContact CG2-CD1 4.19Å; I761-I769 HydrophobicContact CG2-CG1 4.42Å; I761-I769 WeakPolarHBondContact O-CD1 3.32Å; I761-D804 HydrophobicContact CD1-CB 3.69Å; I761-V807 HydrophobicContact CD1-CB 4.39Å; I761-V807 HydrophobicContact CD1-CG1 4.3Å; I761-V807 HydrophobicContact CG1-CG1 4.46Å; I761-I808 HydrophobicContact CD1-CD1 3.94Å; I761-I808 HydrophobicContact CD1-CG1 3.99Å
762	R	95.8	Very high	76.8	Confident	11 Å²	11	39.7 Å²	39.7	4%	0.042	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-16.6	-180	-70.5	161	-176.9	-82.5	-3.7	113.9	P760 P798 Y799 L802 D804 V807	P760-R762 PolarHBondContact O-N 2.89Å; R762-P798 HydrophobicContact CB-CB 4.36Å; R762-P798 WeakPolarHBondContact CD-O 3.25Å; R762-P798 PolarHBondContact NH1-O 3.32Å; R762-Y799 VanDerWaalsContact NH1-C 3.26Å; R762-Y799 PolarHBondContact NH1-O 3.1Å; R762-L802 PolarHBondContact NH1-O 2.89Å; R762-L802 PolarHBondContact NH2-O 3.02Å; R762-D804 IonicContact CZ-OD1 2.89Å; R762-D804 VanDerWaalsContact CZ-OD1 3.23Å; R762-D804 IonicContact NE-OD1 3.84Å; R762-D804 PolarHBondContact NE-OD1 2.93Å; R762-D804 IonicContact NH2-OD1 3.02Å; R762-D804 PolarHBondContact NH2-OD1 2.86Å; R762-V807 HydrophobicContact CG-CG1 4.15Å; R762-V807 HydrophobicContact CG-CG2 4.19Å
763	W	96.3	Very high	77.3	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.015	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-17.9	174.3	-71.8	-102.1	0	0	0	113.8	L721 A722 D749 P760 I761 A782 V785 E789 Q797 P798	L721-W763 VanDerWaalsContact O-CD1 3.24Å; A722-W763 HydrophobicContact CB-CD2 4.17Å; A722-W763 HydrophobicContact CB-CG 4.16Å; A722-W763 HydrophobicContact CB-CZ2 4.29Å; A722-W763 VanDerWaalsContact CB-NE1 3.29Å; D749-W763 HydrophobicContact CB-CH2 4.02Å; D749-W763 HydrophobicContact CB-CZ3 3.74Å; D749-W763 VanDerWaalsContact CG-CH2 3.42Å; D749-W763 WeakPolarHBondContact OD1-CH2 3.21Å; P760-W763 HydrophobicContact CB-CE3 4.36Å; P760-W763 PolarHBondContact O-N 2.96Å; I761-W763 PolarHBondContact O-N 2.77Å; W763-A782 HydrophobicContact CB-CB 4.38Å; W763-A782 VanDerWaalsContact O-CA 3.32Å; W763-A782 WeakPolarHBondContact O-CA 3.45Å; W763-A782 WeakPolarHBondContact O-CB 3.19Å; W763-V785 HydrophobicContact CD2-CG1 4.3Å; W763-V785 HydrophobicContact CG-CB 4.36Å; W763-V785 HydrophobicContact CG-CG1 3.94Å; W763-E789 HydrophobicContact CZ2-CG 4.31Å; W763-E789 VanDerWaalsContact NE1-CD 3.34Å; W763-E789 PolarHBondContact NE1-OE2 3.31Å; W763-Q797 HydrophobicContact CH2-CG 4.4Å; W763-P798 HydrophobicContact CH2-CG 4.07Å; W763-P798 HydrophobicContact CZ2-CG 3.67Å
764	M	94.4	Very high	78.7	Confident	10 Å²	10	38 Å²	38	5%	0.049	21%	0.207	C	C	.	.	S	Bend	trans	-75.3	149.2	-174	-69.3	170.4	66.7	0	0	111.8	L537 L759 P760 I761 S768 I769 F774 W781	L537-M764 HydrophobicContact CD2-CE 3.65Å; L759-M764 HydrophobicContact CB-SD 4.24Å; P760-M764 HydrophobicContact CG-CG 4.22Å; P760-M764 HydrophobicContact CG-SD 4.26Å; P760-M764 PolarHBondContact O-N 3.2Å; I761-M764 HydrophobicContact CG2-SD 4.35Å; I761-M764 PolarHBondContact O-N 3.15Å; M764-S768 WeakPolarHBondContact CE-O 3.35Å; M764-I769 HydrophobicContact CB-CD1 3.84Å; M764-I769 HydrophobicContact CB-CG1 3.73Å; M764-I769 HydrophobicContact CE-CG1 3.8Å; M764-I769 HydrophobicContact SD-CG1 4.16Å; M764-F774 HydrophobicContact CE-CE1 4.32Å; M764-F774 HydrophobicContact CE-CZ 4.01Å; M764-W781 PolarHBondContact O-NE1 3.2Å
765	S	95.3	Very high	80.9	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.177	C	C	.	.			trans	-75.8	158.3	169.7	60.9	0	0	0	0	111.6	E767 S768 I769 S778	S765-E767 VanDerWaalsContact CB-OE1 3.28Å; S765-E767 WeakPolarHBondContact CB-OE1 3.45Å; S765-E767 PolarHBondContact O-N 3.46Å; S765-E767 PolarHBondContact OG-OE1 2.97Å; S765-E767 PolarHBondContact OG-OE2 2.9Å; S765-S768 WeakPolarHBondContact O-CB 3.27Å; S765-S768 PolarHBondContact O-N 3.33Å; S765-S768 PolarHBondContact OG-N 2.91Å; S765-S768 PolarHBondContact OG-OG 2.72Å; S765-S768 VanDerWaalsContact OG-OG 3.09Å; S765-I769 PolarHBondContact O-N 2.77Å; S765-I769 VanDerWaalsContact O-N 3.11Å; S765-S778 WeakPolarHBondContact OG-CB 3.34Å
766	W	91.9	Very high	83.4	Confident	27 Å²	27	28.3 Å²	28.3	10%	0.102	14%	0.143	C	C	.	.	H	α-helix	trans	-55.7	-37.3	179.7	75.9	-93.4	0	0	0	112.1	I769 L770 L771 W781 T811 F814 F815 R844	W766-I769 PolarHBondContact O-N 2.83Å; W766-L770 HydrophobicContact CE3-CD1 4.35Å; W766-L770 WeakPolarHBondContact O-CB 3.39Å; W766-L770 PolarHBondContact O-N 3.36Å; W766-L771 HydrophobicContact CH2-CD1 4.13Å; W766-L771 HydrophobicContact CZ3-CD1 3.89Å; W766-L771 HydrophobicContact CZ3-CG 4.42Å; W766-W781 AromaticContact CD1-CZ3 3.99Å; W766-T811 HydrophobicContact CB-CG2 4.3Å; W766-F814 HydrophobicContact CB-CB 3.75Å; W766-F814 HydrophobicContact CB-CG 4.48Å; W766-F814 HydrophobicContact CG-CB 3.86Å; W766-F815 HydrophobicContact CE3-CB 3.99Å; W766-F815 HydrophobicContact CE3-CD2 4.18Å; W766-F815 AromaticContact CH2-CD2 3.94Å; W766-F815 HydrophobicContact CH2-CD2 3.94Å; W766-F815 HydrophobicContact CZ3-CB 4.18Å; W766-F815 AromaticContact CZ3-CD2 3.49Å; W766-F815 HydrophobicContact CZ3-CD2 3.49Å; W766-F815 VanDerWaalsContact CZ3-CD2 3.49Å; W766-F815 HydrophobicContact CZ3-CE2 4.33Å; W766-F815 HydrophobicContact CZ3-CG 4.25Å; W766-R844 HydrophobicContact CZ2-CG 4.36Å; W766-R844 PolarHBondContact NE1-O 2.96Å
767	E	85.2	Confident	85.5	Confident	7 Å²	7	24.5 Å²	24.5	3%	0.033	13%	0.133	C	C	.	.	H	α-helix	trans	-76.9	-20.4	177.2	76.4	-72.4	163.1	0	0	114	S765 L771 G772 K773 R849	S765-E767 VanDerWaalsContact CB-OE1 3.28Å; S765-E767 WeakPolarHBondContact CB-OE1 3.45Å; S765-E767 PolarHBondContact O-N 3.46Å; S765-E767 PolarHBondContact OG-OE1 2.97Å; S765-E767 PolarHBondContact OG-OE2 2.9Å; E767-L771 HydrophobicContact CB-CD1 4.15Å; E767-L771 CarbonylContact O-C 3.35Å; E767-L771 WeakPolarHBondContact O-CA 3.21Å; E767-L771 WeakPolarHBondContact O-CB 3.45Å; E767-L771 PolarHBondContact O-N 2.82Å; E767-L771 VanDerWaalsContact O-N 3.14Å; E767-G772 PolarHBondContact O-N 3.01Å; E767-K773 HydrophobicContact CB-CB 4.5Å; E767-K773 HydrophobicContact CG-CB 4.26Å; E767-K773 HydrophobicContact CG-CD 4.42Å; E767-K773 WeakPolarHBondContact O-CB 3.45Å; E767-K773 PolarHBondContact O-N 3.2Å; E767-R849 IonicContact OE1-CZ 3.99Å; E767-R849 IonicContact OE1-NH1 3.73Å; E767-R849 PolarHBondContact OE1-NH1 3.27Å; E767-R849 IonicContact OE1-NH2 2.96Å; E767-R849 IonicContact OE2-CZ 2.87Å; E767-R849 IonicContact OE2-NH1 2.98Å; E767-R849 PolarHBondContact OE2-NH1 3Å; E767-R849 IonicContact OE2-NH2 3.56Å; E767-R849 PolarHBondContact OE2-NH2 2.76Å
768	S	88.3	Confident	87.2	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.007	13%	0.13	C	C	.	.	H	α-helix	trans	-74.8	-33.3	169.9	-64	0	0	0	0	112.2	M764 S765 G772 K773 S778	M764-S768 WeakPolarHBondContact CE-O 3.35Å; S765-S768 WeakPolarHBondContact O-CB 3.27Å; S765-S768 PolarHBondContact O-N 3.33Å; S765-S768 PolarHBondContact OG-N 2.91Å; S765-S768 PolarHBondContact OG-OG 2.72Å; S765-S768 VanDerWaalsContact OG-OG 3.09Å; S768-G772 WeakPolarHBondContact O-CA 3.42Å; S768-G772 PolarHBondContact O-N 2.88Å; S768-K773 WeakPolarHBondContact CA-O 3.47Å; S768-K773 PolarHBondContact OG-O 3.07Å; S768-S778 WeakPolarHBondContact OG-CB 3.22Å
769	I	83.4	Confident	88.4	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-79.6	-53	176.3	-70.1	171.3	0	0	0	111.2	I534 I761 M764 S765 W766 T811	I534-I769 HydrophobicContact CG2-CG2 4.27Å; I761-I769 HydrophobicContact CB-CD1 3.91Å; I761-I769 HydrophobicContact CG2-CD1 4.19Å; I761-I769 HydrophobicContact CG2-CG1 4.42Å; I761-I769 WeakPolarHBondContact O-CD1 3.32Å; M764-I769 HydrophobicContact CB-CD1 3.84Å; M764-I769 HydrophobicContact CB-CG1 3.73Å; M764-I769 HydrophobicContact CE-CG1 3.8Å; M764-I769 HydrophobicContact SD-CG1 4.16Å; S765-I769 PolarHBondContact O-N 2.77Å; S765-I769 VanDerWaalsContact O-N 3.11Å; W766-I769 PolarHBondContact O-N 2.83Å; I769-T811 HydrophobicContact CB-CG2 4.26Å; I769-T811 HydrophobicContact CD1-CG2 3.66Å; I769-T811 HydrophobicContact CG2-CG2 4.34Å
770	L	77.9	Confident	89.1	Confident	22 Å²	22	22.1 Å²	22.1	12%	0.115	12%	0.118	C	C	.	.	H	α-helix	trans	-87.8	-13.4	-171.5	-62.1	179.7	0	0	0	114.8	A532 V535 W766 T811 F815	A532-L770 HydrophobicContact CB-CD2 4.37Å; V535-L770 WeakPolarHBondContact CG2-O 3.5Å; W766-L770 HydrophobicContact CE3-CD1 4.35Å; W766-L770 WeakPolarHBondContact O-CB 3.39Å; W766-L770 PolarHBondContact O-N 3.36Å; L770-T811 WeakPolarHBondContact CD1-O 3.37Å; L770-T811 WeakPolarHBondContact CG-OG1 3.32Å; L770-F815 HydrophobicContact CD1-CB 3.88Å
771	L	74.4	Confident	89.5	Confident	95 Å²	95	22.1 Å²	22.1	50%	0.497	12%	0.117	S	C	.	.	S	Bend	trans	-132.3	7.2	-180	-54.9	172.2	0	0	0	113.1	W766 E767 K773	W766-L771 HydrophobicContact CH2-CD1 4.13Å; W766-L771 HydrophobicContact CZ3-CD1 3.89Å; W766-L771 HydrophobicContact CZ3-CG 4.42Å; E767-L771 HydrophobicContact CB-CD1 4.15Å; E767-L771 CarbonylContact O-C 3.35Å; E767-L771 WeakPolarHBondContact O-CA 3.21Å; E767-L771 WeakPolarHBondContact O-CB 3.45Å; E767-L771 PolarHBondContact O-N 2.82Å; E767-L771 VanDerWaalsContact O-N 3.14Å; L771-K773 HydrophobicContact CB-CB 4.32Å; L771-K773 PolarHBondContact O-N 2.94Å
772	G	74.6	Confident	89.8	Confident	18 Å²	18	22.2 Å²	22.2	19%	0.186	12%	0.119	C	C	.	.			trans	59.4	14.8	-175.5	0	0	0	0	0	114.9	E767 S768 F774	E767-G772 PolarHBondContact O-N 3.01Å; S768-G772 WeakPolarHBondContact O-CA 3.42Å; S768-G772 PolarHBondContact O-N 2.88Å; G772-F774 WeakPolarHBondContact O-CD2 3.31Å; G772-F774 PolarHBondContact O-N 3.36Å
773	K	79.5	Confident	89.9	Confident	117 Å²	117	21.8 Å²	21.8	51%	0.509	12%	0.117	S	C	.	.			trans	-91.1	107.2	-164.6	-175.5	174.2	-179.2	172	0	112.2	E767 S768 L771 T775	E767-K773 HydrophobicContact CB-CB 4.5Å; E767-K773 HydrophobicContact CG-CB 4.26Å; E767-K773 HydrophobicContact CG-CD 4.42Å; E767-K773 WeakPolarHBondContact O-CB 3.45Å; E767-K773 PolarHBondContact O-N 3.2Å; S768-K773 WeakPolarHBondContact CA-O 3.47Å; S768-K773 PolarHBondContact OG-O 3.07Å; L771-K773 HydrophobicContact CB-CB 4.32Å; L771-K773 PolarHBondContact O-N 2.94Å; K773-T775 HydrophobicContact CG-CG2 4.28Å
774	F	84.1	Confident	90	Very high	33 Å²	33	21.6 Å²	21.6	15%	0.145	12%	0.116	C	C	.	.			trans	-97.2	133.7	171.2	-63.8	-84.4	0	0	0	111.8	L537 V717 R719 M764 G772	L537-F774 HydrophobicContact CD2-CE2 3.38Å; L537-F774 HydrophobicContact CD2-CZ 3.32Å; L537-F774 HydrophobicContact CG-CE2 4.41Å; V717-F774 HydrophobicContact CG1-CB 4.1Å; R719-F774 HydrophobicContact CB-CD1 3.61Å; R719-F774 HydrophobicContact CB-CE1 3.69Å; R719-F774 HydrophobicContact CB-CG 4.35Å; R719-F774 HydrophobicContact CB-CZ 4.48Å; R719-F774 HydrophobicContact CG-CB 4.09Å; R719-F774 HydrophobicContact CG-CD1 3.56Å; R719-F774 HydrophobicContact CG-CE1 4.1Å; R719-F774 HydrophobicContact CG-CG 3.84Å; M764-F774 HydrophobicContact CE-CE1 4.32Å; M764-F774 HydrophobicContact CE-CZ 4.01Å; G772-F774 WeakPolarHBondContact O-CD2 3.31Å; G772-F774 PolarHBondContact O-N 3.36Å
775	T	89.3	Confident	90.2	Very high	42 Å²	42	21.1 Å²	21.1	26%	0.258	11%	0.114	S	C	.	.			trans	-152.4	168.9	175.5	59.3	0	0	0	0	109.6	K773 A777 S778 D779	K773-T775 HydrophobicContact CG-CG2 4.28Å; T775-A777 PolarHBondContact O-N 2.72Å; T775-A777 PolarHBondContact OG1-N 3.27Å; T775-S778 PolarHBondContact N-OG 2.86Å; T775-S778 PolarHBondContact O-N 3.21Å; T775-S778 PolarHBondContact O-OG 3.46Å; T775-S778 PolarHBondContact OG1-N 2.71Å; T775-D779 PolarHBondContact O-N 2.97Å; T775-D779 VanDerWaalsContact O-N 3.09Å
776	T	93.5	Very high	90.4	Very high	38 Å²	38	21.1 Å²	21.1	23%	0.233	11%	0.114	C	C	.	.	H	α-helix	trans	-51.6	-30.8	166.6	-47	0	0	0	0	112.6	S712 D779 V780 F852	S712-T776 VanDerWaalsContact OG-CG2 3.31Å; S712-T776 WeakPolarHBondContact OG-CG2 3.36Å; T776-D779 PolarHBondContact O-N 3.23Å; T776-V780 WeakPolarHBondContact O-CG2 3.42Å; T776-V780 PolarHBondContact O-N 2.82Å; T776-F852 HydrophobicContact CG2-CD2 3.77Å; T776-F852 HydrophobicContact CG2-CE2 3.9Å
777	A	96.3	Very high	90.6	Very high	22 Å²	22	20 Å²	20	18%	0.182	11%	0.11	C	C	.	.	H	α-helix	trans	-75.1	-21.7	177.6	0	0	0	0	0	113.9	T775 A846 R849	T775-A777 PolarHBondContact O-N 2.72Å; T775-A777 PolarHBondContact OG1-N 3.27Å; A777-A846 HydrophobicContact CB-CB 3.91Å; A777-R849 VanDerWaalsContact O-CD 3.23Å; A777-R849 WeakPolarHBondContact O-CD 3.45Å; A777-R849 PolarHBondContact O-NH1 3.46Å
778	S	94.8	Very high	91.2	Very high	4 Å²	4	19.9 Å²	19.9	3%	0.028	11%	0.109	C	C	.	.	H	α-helix	trans	-81.1	-34.7	168	62.1	0	0	0	0	111.1	S765 S768 T775 V780 W781 A782	S765-S778 WeakPolarHBondContact OG-CB 3.34Å; S768-S778 WeakPolarHBondContact OG-CB 3.22Å; T775-S778 PolarHBondContact N-OG 2.86Å; T775-S778 PolarHBondContact O-N 3.21Å; T775-S778 PolarHBondContact O-OG 3.46Å; T775-S778 PolarHBondContact OG1-N 2.71Å; S778-V780 VanDerWaalsContact C-N 3.29Å; S778-V780 PolarHBondContact O-N 3.18Å; S778-W781 WeakPolarHBondContact O-CB 3.32Å; S778-W781 PolarHBondContact O-N 3.11Å; S778-W781 VanDerWaalsContact O-N 3.12Å; S778-A782 PolarHBondContact O-N 3.31Å
779	D	96.4	Very high	91.7	Very high	2 Å²	2	20 Å²	20	1%	0.011	11%	0.11	C	C	.	.	H	α-helix	trans	-62.7	-35.6	170.6	-70.8	-13.3	0	0	0	111.8	M708 V717 H718 R719 T775 T776 W781 A782 Y783 F852	M708-D779 HydrophobicContact CE-CB 3.72Å; V717-D779 VanDerWaalsContact CA-OD2 3.26Å; V717-D779 WeakPolarHBondContact CA-OD2 3.38Å; V717-D779 WeakPolarHBondContact CG1-OD2 3.41Å; H718-D779 PolarHBondContact N-OD1 3.43Å; H718-D779 PolarHBondContact N-OD2 3Å; R719-D779 PolarHBondContact N-OD1 3.28Å; T775-D779 PolarHBondContact O-N 2.97Å; T775-D779 VanDerWaalsContact O-N 3.09Å; T776-D779 PolarHBondContact O-N 3.23Å; D779-W781 VanDerWaalsContact C-N 3.28Å; D779-W781 PolarHBondContact O-N 3.31Å; D779-A782 PolarHBondContact O-N 2.92Å; D779-Y783 WeakPolarHBondContact O-CB 3.13Å; D779-Y783 PolarHBondContact O-N 2.87Å; D779-F852 HydrophobicContact CB-CE2 3.95Å; D779-F852 HydrophobicContact CB-CZ 4.01Å
780	V	98.5	Very high	92.3	Very high	2 Å²	2	20 Å²	20	1%	0.012	11%	0.11	C	C	.	.	H	α-helix	trans	-61.1	-35.4	172.3	162.2	0	0	0	0	112.2	T776 S778 A784 C841 R849 P850 F852 L855	T776-V780 WeakPolarHBondContact O-CG2 3.42Å; T776-V780 PolarHBondContact O-N 2.82Å; S778-V780 VanDerWaalsContact C-N 3.29Å; S778-V780 PolarHBondContact O-N 3.18Å; V780-A784 PolarHBondContact O-N 2.53Å; V780-C841 HydrophobicContact CG1-CB 3.82Å; V780-C841 WeakPolarHBondContact O-CB 3.36Å; V780-R849 HydrophobicContact CG1-CB 3.95Å; V780-P850 HydrophobicContact CG1-CG 4.49Å; V780-P850 WeakPolarHBondContact CG1-O 3.41Å; V780-P850 WeakPolarHBondContact CG2-O 3.32Å; V780-F852 HydrophobicContact CB-CZ 4.36Å; V780-F852 HydrophobicContact CG2-CD1 4.37Å; V780-F852 HydrophobicContact CG2-CD2 3.86Å; V780-F852 HydrophobicContact CG2-CE1 4.11Å; V780-F852 HydrophobicContact CG2-CE2 3.56Å; V780-F852 HydrophobicContact CG2-CG 4.25Å; V780-F852 HydrophobicContact CG2-CZ 3.7Å; V780-L855 HydrophobicContact CG1-CD1 4.21Å; V780-L855 HydrophobicContact CG2-CD1 4.26Å
781	W	98.5	Very high	93.1	Very high	6 Å²	6	19.1 Å²	19.1	2%	0.023	11%	0.105	C	C	.	.	H	α-helix	trans	-67.4	-48	174.4	179.5	-67.7	0	0	0	110.9	M764 W766 S778 D779 Y783 A784 V785 F814 W842	M764-W781 PolarHBondContact O-NE1 3.2Å; W766-W781 AromaticContact CD1-CZ3 3.99Å; S778-W781 WeakPolarHBondContact O-CB 3.32Å; S778-W781 PolarHBondContact O-N 3.11Å; S778-W781 VanDerWaalsContact O-N 3.12Å; D779-W781 VanDerWaalsContact C-N 3.28Å; D779-W781 PolarHBondContact O-N 3.31Å; W781-Y783 VanDerWaalsContact C-N 3.27Å; W781-Y783 PolarHBondContact O-N 3.43Å; W781-A784 PolarHBondContact O-N 2.85Å; W781-A784 VanDerWaalsContact O-N 3.16Å; W781-V785 PolarHBondContact O-N 2.57Å; W781-F814 AromaticContact CH2-CD1 3.67Å; W781-F814 HydrophobicContact CH2-CD1 3.67Å; W781-F814 HydrophobicContact CH2-CD2 4.1Å; W781-F814 AromaticContact CH2-CE1 3.5Å; W781-F814 HydrophobicContact CH2-CE1 3.5Å; W781-F814 VanDerWaalsContact CH2-CE1 3.5Å; W781-F814 AromaticContact CH2-CE2 3.98Å; W781-F814 HydrophobicContact CH2-CE2 3.98Å; W781-F814 AromaticContact CH2-CG 3.97Å; W781-F814 HydrophobicContact CH2-CG 3.97Å; W781-F814 AromaticContact CH2-CZ 3.68Å; W781-F814 HydrophobicContact CH2-CZ 3.68Å; W781-F814 HydrophobicContact CZ2-CD2 4.48Å; W781-F814 HydrophobicContact CZ2-CE1 4.38Å; W781-F814 HydrophobicContact CZ2-CE2 4.17Å; W781-F814 HydrophobicContact CZ2-CZ 4.12Å; W781-F814 HydrophobicContact CZ3-CD1 4.32Å; W781-F814 HydrophobicContact CZ3-CE1 4.19Å; W781-W842 AromaticContact CD1-CD1 3.95Å; W781-W842 AromaticContact CD2-CD1 3.59Å; W781-W842 HydrophobicContact CD2-CG 4.44Å; W781-W842 AromaticContact CE2-CD1 3.75Å; W781-W842 HydrophobicContact CE3-CB 4.28Å; W781-W842 AromaticContact CG-CD1 3.74Å; W781-W842 HydrophobicContact CH2-CB 4.43Å; W781-W842 HydrophobicContact CZ3-CB 4.2Å; W781-W842 AromaticContact NE1-CD1 3.94Å; W781-W842 PolarHBondContact O-NE1 2.56Å
782	A	97.9	Very high	94	Very high	5 Å²	5	16.3 Å²	16.3	4%	0.041	9%	0.09	C	C	.	.	H	α-helix	trans	-61.5	-34.6	176	0	0	0	0	0	112.4	L721 W763 S778 D779 V785 T786	L721-A782 HydrophobicContact CB-CB 4.1Å; W763-A782 HydrophobicContact CB-CB 4.38Å; W763-A782 VanDerWaalsContact O-CA 3.32Å; W763-A782 WeakPolarHBondContact O-CA 3.45Å; W763-A782 WeakPolarHBondContact O-CB 3.19Å; S778-A782 PolarHBondContact O-N 3.31Å; D779-A782 PolarHBondContact O-N 2.92Å; A782-V785 PolarHBondContact O-N 3.46Å; A782-T786 PolarHBondContact O-N 3.11Å; A782-T786 PolarHBondContact O-OG1 2.66Å
783	Y	98.4	Very high	94.9	Very high	2 Å²	2	15.6 Å²	15.6	1%	0.008	8%	0.082	C	C	.	.	H	α-helix	trans	-61.8	-41.5	173.4	175.8	-94.1	0	0	0	112.6	A701 I704 A705 L721 D779 W781 V785 T786 L787 F852 L855 L859	A701-Y783 PolarHBondContact O-OH 2.91Å; I704-Y783 HydrophobicContact CB-CE2 3.98Å; I704-Y783 HydrophobicContact CG2-CD2 3.78Å; I704-Y783 HydrophobicContact CG2-CE2 3.7Å; A705-Y783 HydrophobicContact CB-CE2 4.05Å; L721-Y783 HydrophobicContact CD2-CD2 4.31Å; D779-Y783 WeakPolarHBondContact O-CB 3.13Å; D779-Y783 PolarHBondContact O-N 2.87Å; W781-Y783 VanDerWaalsContact C-N 3.27Å; W781-Y783 PolarHBondContact O-N 3.43Å; Y783-V785 VanDerWaalsContact C-N 3.31Å; Y783-V785 PolarHBondContact O-N 3.38Å; Y783-T786 CarbonylContact O-C 3.55Å; Y783-T786 WeakPolarHBondContact O-CA 3.21Å; Y783-T786 WeakPolarHBondContact O-CB 3.48Å; Y783-T786 PolarHBondContact O-N 3.28Å; Y783-T786 VanDerWaalsContact O-N 3.15Å; Y783-L787 HydrophobicContact CE1-CD2 4.42Å; Y783-L787 WeakPolarHBondContact O-CB 3.39Å; Y783-L787 PolarHBondContact O-N 3.39Å; Y783-F852 HydrophobicContact CD1-CE1 4.39Å; Y783-F852 HydrophobicContact CD2-CE1 4Å; Y783-F852 AromaticContact CG-CE1 3.72Å; Y783-F852 HydrophobicContact CG-CE1 3.72Å; Y783-L855 HydrophobicContact CD1-CD1 3.86Å; Y783-L855 HydrophobicContact CE1-CD1 4.23Å; Y783-L859 HydrophobicContact CE1-CD1 4.38Å; Y783-L859 WeakPolarHBondContact OH-CD1 3.34Å
784	A	98.3	Very high	95.6	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-69.5	-28.8	176.2	0	0	0	0	0	112.9	V780 W781 W788 M838 C841 W842	V780-A784 PolarHBondContact O-N 2.53Å; W781-A784 PolarHBondContact O-N 2.85Å; W781-A784 VanDerWaalsContact O-N 3.16Å; A784-W788 PolarHBondContact O-N 3.3Å; A784-W788 VanDerWaalsContact O-N 3.08Å; A784-M838 HydrophobicContact CB-CB 4.2Å; A784-M838 HydrophobicContact CB-CG 4.48Å; A784-C841 HydrophobicContact CB-CB 3.42Å; A784-C841 VanDerWaalsContact CB-CB 3.42Å; A784-W842 HydrophobicContact CB-CD2 4.41Å; A784-W842 HydrophobicContact CB-CZ2 3.87Å; A784-W842 WeakPolarHBondContact O-CZ2 3.17Å
785	V	98.4	Very high	96	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-68.9	-40.8	167.4	-175.9	0	0	0	0	110.6	W763 W781 A782 Y783 L787 W788 E789 P798 L824 W842	W763-V785 HydrophobicContact CD2-CG1 4.3Å; W763-V785 HydrophobicContact CG-CB 4.36Å; W763-V785 HydrophobicContact CG-CG1 3.94Å; W781-V785 PolarHBondContact O-N 2.57Å; A782-V785 PolarHBondContact O-N 3.46Å; Y783-V785 VanDerWaalsContact C-N 3.31Å; Y783-V785 PolarHBondContact O-N 3.38Å; V785-L787 VanDerWaalsContact C-N 3.33Å; V785-L787 PolarHBondContact O-N 3.15Å; V785-W788 WeakPolarHBondContact O-CA 3.35Å; V785-W788 VanDerWaalsContact O-CB 3.29Å; V785-W788 WeakPolarHBondContact O-CB 3.39Å; V785-W788 PolarHBondContact O-N 3.08Å; V785-E789 PolarHBondContact O-N 2.96Å; V785-P798 HydrophobicContact CG1-CB 3.71Å; V785-P798 HydrophobicContact CG1-CG 3.5Å; V785-P798 VanDerWaalsContact CG1-CG 3.5Å; V785-L824 HydrophobicContact CB-CD1 4.42Å; V785-L824 HydrophobicContact CG1-CD1 4.04Å; V785-L824 HydrophobicContact CG2-CD1 4.09Å; V785-W842 HydrophobicContact CG2-CZ2 4.18Å
786	T	97.9	Very high	96	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-60.7	-40.8	174.9	-51.7	0	0	0	0	112	I704 L721 T723 A782 Y783 W788 E789 I790	I704-T786 HydrophobicContact CD1-CG2 4.11Å; L721-T786 PolarHBondContact O-OG1 2.83Å; T723-T786 HydrophobicContact CG2-CG2 3.94Å; A782-T786 PolarHBondContact O-N 3.11Å; A782-T786 PolarHBondContact O-OG1 2.66Å; Y783-T786 CarbonylContact O-C 3.55Å; Y783-T786 WeakPolarHBondContact O-CA 3.21Å; Y783-T786 WeakPolarHBondContact O-CB 3.48Å; Y783-T786 PolarHBondContact O-N 3.28Å; Y783-T786 VanDerWaalsContact O-N 3.15Å; T786-W788 VanDerWaalsContact C-N 3.31Å; T786-W788 PolarHBondContact O-N 2.86Å; T786-E789 WeakPolarHBondContact CA-OE2 3.49Å; T786-E789 WeakPolarHBondContact O-CB 3.31Å; T786-E789 PolarHBondContact O-N 3.17Å; T786-I790 HydrophobicContact CG2-CD1 4.29Å; T786-I790 VanDerWaalsContact O-CG1 3.28Å; T786-I790 WeakPolarHBondContact O-CG1 3.45Å; T786-I790 PolarHBondContact O-N 3.23Å; T786-I790 VanDerWaalsContact O-N 3.08Å
787	L	97.4	Very high	96	Very high	3 Å²	3	18.4 Å²	18.4	2%	0.016	9%	0.092	C	C	.	.	H	α-helix	trans	-65	-34.1	172.8	179.1	56	0	0	0	112	A701 Y783 V785 L791 L834 M838	A701-L787 HydrophobicContact CB-CD1 3.78Å; Y783-L787 HydrophobicContact CE1-CD2 4.42Å; Y783-L787 WeakPolarHBondContact O-CB 3.39Å; Y783-L787 PolarHBondContact O-N 3.39Å; V785-L787 VanDerWaalsContact C-N 3.33Å; V785-L787 PolarHBondContact O-N 3.15Å; L787-L791 HydrophobicContact CD1-CD1 3.79Å; L787-L791 HydrophobicContact CD1-CG 4.12Å; L787-L791 HydrophobicContact CG-CD1 3.95Å; L787-L791 WeakPolarHBondContact O-CB 3.39Å; L787-L791 WeakPolarHBondContact O-CD1 3.24Å; L787-L791 VanDerWaalsContact O-CG 3.26Å; L787-L791 WeakPolarHBondContact O-CG 3.33Å; L787-L791 PolarHBondContact O-N 2.78Å; L787-L791 VanDerWaalsContact O-N 3.12Å; L787-L834 HydrophobicContact CD2-CD1 3.88Å; L787-L834 HydrophobicContact CD2-CG 4.34Å; L787-M838 HydrophobicContact CB-CE 4.5Å; L787-M838 HydrophobicContact CD2-CG 3.67Å; L787-M838 HydrophobicContact CD2-SD 4.16Å; L787-M838 HydrophobicContact CG-CE 4.3Å; L787-M838 HydrophobicContact CG-CG 4.17Å; L787-M838 HydrophobicContact CG-SD 4.14Å
788	W	97.8	Very high	96	Very high	5 Å²	5	17.4 Å²	17.4	2%	0.019	8%	0.084	C	C	.	.	H	α-helix	trans	-67.4	-43	173.9	-172.6	90	0	0	0	112.1	A784 V785 T786 I790 L791 N792 E796 P798 L824 P825 P827 M838	A784-W788 PolarHBondContact O-N 3.3Å; A784-W788 VanDerWaalsContact O-N 3.08Å; V785-W788 WeakPolarHBondContact O-CA 3.35Å; V785-W788 VanDerWaalsContact O-CB 3.29Å; V785-W788 WeakPolarHBondContact O-CB 3.39Å; V785-W788 PolarHBondContact O-N 3.08Å; T786-W788 VanDerWaalsContact C-N 3.31Å; T786-W788 PolarHBondContact O-N 2.86Å; W788-I790 PolarHBondContact O-N 2.66Å; W788-L791 PolarHBondContact O-N 2.88Å; W788-N792 VanDerWaalsContact CD2-ND2 3.32Å; W788-N792 WeakPolarHBondContact CZ2-ND2 3.31Å; W788-N792 PolarHBondContact NE1-ND2 2.6Å; W788-N792 PolarHBondContact O-N 2.73Å; W788-N792 PolarHBondContact O-ND2 3.04Å; W788-E796 HydrophobicContact CH2-CB 4.19Å; W788-P798 HydrophobicContact CE3-CB 4.34Å; W788-P798 HydrophobicContact CE3-CG 4.05Å; W788-P798 HydrophobicContact CZ3-CB 4.3Å; W788-P798 HydrophobicContact CZ3-CG 4.09Å; W788-L824 HydrophobicContact CB-CD1 4.04Å; W788-L824 HydrophobicContact CD2-CB 4.29Å; W788-L824 HydrophobicContact CD2-CD1 3.93Å; W788-L824 HydrophobicContact CD2-CD2 4.41Å; W788-L824 HydrophobicContact CD2-CG 4.44Å; W788-L824 HydrophobicContact CE3-CD1 4.3Å; W788-L824 HydrophobicContact CG-CB 4.09Å; W788-L824 HydrophobicContact CG-CD1 3.8Å; W788-L824 HydrophobicContact CG-CG 4.48Å; W788-L824 HydrophobicContact CZ2-CD2 4.43Å; W788-P825 HydrophobicContact CZ2-CG 4.29Å; W788-P825 PolarHBondContact NE1-O 2.87Å; W788-P827 HydrophobicContact CG-CG 4.46Å; W788-M838 HydrophobicContact CB-CE 3.47Å; W788-M838 VanDerWaalsContact CB-CE 3.47Å; W788-M838 HydrophobicContact CG-CE 4.11Å
789	E	97.6	Very high	96.1	Very high	4 Å²	4	17.6 Å²	17.6	2%	0.019	8%	0.084	C	C	.	.	H	α-helix	trans	-57.3	-48.8	173.5	-65.7	174.5	83.2	0	0	111.1	T723 W763 V785 T786 L791 N792 F793 C794 P798	T723-E789 WeakPolarHBondContact CB-OE1 3.48Å; T723-E789 HydrophobicContact CG2-CB 3.52Å; T723-E789 HydrophobicContact CG2-CG 4.23Å; T723-E789 PolarHBondContact N-OE1 2.98Å; T723-E789 PolarHBondContact N-OE2 3.13Å; T723-E789 PolarHBondContact OG1-OE1 3.41Å; W763-E789 HydrophobicContact CZ2-CG 4.31Å; W763-E789 VanDerWaalsContact NE1-CD 3.34Å; W763-E789 PolarHBondContact NE1-OE2 3.31Å; V785-E789 PolarHBondContact O-N 2.96Å; T786-E789 WeakPolarHBondContact CA-OE2 3.49Å; T786-E789 WeakPolarHBondContact O-CB 3.31Å; T786-E789 PolarHBondContact O-N 3.17Å; E789-L791 PolarHBondContact O-N 2.85Å; E789-N792 CarbonylContact O-C 3.57Å; E789-N792 PolarHBondContact O-N 3.5Å; E789-F793 PolarHBondContact O-N 3.47Å; E789-C794 PolarHBondContact O-N 3.08Å; E789-P798 HydrophobicContact CG-CG 4.07Å
790	I	96.4	Very high	95.9	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.005	10%	0.104	C	C	.	.	H	α-helix	trans	-58.2	-47.6	-179	-70.1	166.1	0	0	0	111.1	L670 L674 L697 I704 T723 T786 W788 N792 F793	L670-I790 HydrophobicContact CD2-CD1 4.03Å; L670-I790 HydrophobicContact CD2-CG1 4.1Å; L674-I790 HydrophobicContact CD1-CB 4.14Å; L674-I790 HydrophobicContact CD1-CG1 3.97Å; L674-I790 HydrophobicContact CD1-CG2 4.12Å; L697-I790 HydrophobicContact CB-CG2 3.98Å; L697-I790 HydrophobicContact CD2-CG2 3.85Å; L697-I790 HydrophobicContact CG-CG2 4.45Å; I704-I790 HydrophobicContact CD1-CD1 3.75Å; T723-I790 HydrophobicContact CG2-CG1 3.85Å; T786-I790 HydrophobicContact CG2-CD1 4.29Å; T786-I790 VanDerWaalsContact O-CG1 3.28Å; T786-I790 WeakPolarHBondContact O-CG1 3.45Å; T786-I790 PolarHBondContact O-N 3.23Å; T786-I790 VanDerWaalsContact O-N 3.08Å; W788-I790 PolarHBondContact O-N 2.66Å; I790-N792 PolarHBondContact O-N 2.67Å; I790-F793 PolarHBondContact O-N 2.72Å; I790-F793 VanDerWaalsContact O-N 3.09Å
791	L	94.8	Very high	95.6	Very high	3 Å²	3	25.6 Å²	25.6	2%	0.016	13%	0.128	C	C	.	.	H	α-helix	trans	-73.4	-13.1	-177.4	-67	168.2	0	0	0	114	F694 L787 W788 E789 P827 C830 L834 M838	F694-L791 HydrophobicContact CD2-CD2 4.39Å; F694-L791 HydrophobicContact CE2-CD2 3.85Å; L787-L791 HydrophobicContact CD1-CD1 3.79Å; L787-L791 HydrophobicContact CD1-CG 4.12Å; L787-L791 HydrophobicContact CG-CD1 3.95Å; L787-L791 WeakPolarHBondContact O-CB 3.39Å; L787-L791 WeakPolarHBondContact O-CD1 3.24Å; L787-L791 VanDerWaalsContact O-CG 3.26Å; L787-L791 WeakPolarHBondContact O-CG 3.33Å; L787-L791 PolarHBondContact O-N 2.78Å; L787-L791 VanDerWaalsContact O-N 3.12Å; W788-L791 PolarHBondContact O-N 2.88Å; E789-L791 PolarHBondContact O-N 2.85Å; L791-P827 HydrophobicContact CB-CB 3.75Å; L791-P827 HydrophobicContact CB-CG 3.73Å; L791-P827 HydrophobicContact CD1-CG 4.32Å; L791-C830 HydrophobicContact CD1-CB 3.99Å; L791-L834 HydrophobicContact CD1-CD2 3.75Å; L791-L834 HydrophobicContact CD1-CG 4.29Å; L791-L834 HydrophobicContact CD2-CD2 4.14Å; L791-M838 HydrophobicContact CD1-SD 4.22Å
792	N	93.9	Very high	95.3	Very high	35 Å²	35	26.5 Å²	26.5	19%	0.187	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	16.5	169.9	-65.8	-72	0	0	0	112.8	W788 E789 I790 C794 K795 P827	W788-N792 VanDerWaalsContact CD2-ND2 3.32Å; W788-N792 WeakPolarHBondContact CZ2-ND2 3.31Å; W788-N792 PolarHBondContact NE1-ND2 2.6Å; W788-N792 PolarHBondContact O-N 2.73Å; W788-N792 PolarHBondContact O-ND2 3.04Å; E789-N792 CarbonylContact O-C 3.57Å; E789-N792 PolarHBondContact O-N 3.5Å; I790-N792 PolarHBondContact O-N 2.67Å; N792-C794 PolarHBondContact O-N 2.74Å; N792-C794 VanDerWaalsContact O-N 3.07Å; N792-K795 WeakPolarHBondContact O-CB 3.42Å; N792-K795 PolarHBondContact O-N 3.35Å; N792-P827 WeakPolarHBondContact ND2-CG 3.47Å
793	F	94.3	Very high	95	Very high	4 Å²	4	29.4 Å²	29.4	2%	0.018	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	26.8	179.8	-77.1	-109.7	0	0	0	113.8	L674 S675 H677 E678 P679 V692 L697 E789 I790 K795 L829	L674-F793 CarbonylContact C-O 3.59Å; S675-F793 VanDerWaalsContact CA-O 3.29Å; S675-F793 WeakPolarHBondContact CA-O 3.37Å; S675-F793 PolarHBondContact N-O 3.11Å; H677-F793 HydrophobicContact CB-CD1 4.19Å; H677-F793 HydrophobicContact CB-CE1 4.17Å; H677-F793 WeakPolarHBondContact O-CD1 3.45Å; E678-F793 WeakPolarHBondContact O-CE1 3.21Å; P679-F793 HydrophobicContact CB-CE2 4.14Å; P679-F793 HydrophobicContact CB-CZ 4.1Å; P679-F793 HydrophobicContact CG-CD2 4.12Å; P679-F793 HydrophobicContact CG-CE2 3.7Å; P679-F793 HydrophobicContact CG-CZ 3.94Å; V692-F793 HydrophobicContact CB-CE1 3.96Å; V692-F793 HydrophobicContact CB-CZ 4.24Å; L697-F793 HydrophobicContact CD1-CD2 4.49Å; L697-F793 HydrophobicContact CD1-CE2 3.6Å; L697-F793 HydrophobicContact CD1-CZ 3.9Å; L697-F793 HydrophobicContact CD2-CE2 4.34Å; L697-F793 HydrophobicContact CD2-CZ 4.19Å; L697-F793 HydrophobicContact CG-CZ 4.45Å; E789-F793 PolarHBondContact O-N 3.47Å; I790-F793 PolarHBondContact O-N 2.72Å; I790-F793 VanDerWaalsContact O-N 3.09Å; F793-K795 HydrophobicContact CB-CD 4.19Å; F793-K795 HydrophobicContact CB-CG 4.03Å; F793-K795 PolarHBondContact O-N 3.49Å; F793-K795 VanDerWaalsContact O-N 3.1Å; F793-L829 HydrophobicContact CD2-CD1 4.27Å; F793-L829 HydrophobicContact CE2-CD1 3.67Å
794	C	94.3	Very high	94.6	Very high	14 Å²	14	31 Å²	31	10%	0.095	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	55	22.5	-174.7	-56.1	0	0	0	0	114.5	L674 T723 E789 N792	L674-C794 HydrophobicContact CB-CB 4.4Å; T723-C794 PolarHBondContact OG1-SG 3.26Å; E789-C794 PolarHBondContact O-N 3.08Å; N792-C794 PolarHBondContact O-N 2.74Å; N792-C794 VanDerWaalsContact O-N 3.07Å
795	K	90.8	Very high	94	Very high	104 Å²	104	35.4 Å²	35.4	45%	0.452	18%	0.18	S	C	.	.			trans	-79	-18.8	-176.4	-66.5	-175.9	169.4	-168.8	0	114.2	E678 N792 F793	E678-K795 IonicContact OE1-NZ 2.8Å; E678-K795 PolarHBondContact OE1-NZ 3.29Å; E678-K795 IonicContact OE2-NZ 3.97Å; E678-K795 PolarHBondContact OE2-NZ 3.12Å; N792-K795 WeakPolarHBondContact O-CB 3.42Å; N792-K795 PolarHBondContact O-N 3.35Å; F793-K795 HydrophobicContact CB-CD 4.19Å; F793-K795 HydrophobicContact CB-CG 4.03Å; F793-K795 PolarHBondContact O-N 3.49Å; F793-K795 VanDerWaalsContact O-N 3.1Å
796	E	90.6	Very high	93.6	Very high	113 Å²	113	39.1 Å²	39.1	53%	0.528	20%	0.197	S	C	.	.	S	Bend	trans	-131.8	144.1	177.5	-66.2	-173.6	-154.5	0	0	110.3	W788 S800	W788-E796 HydrophobicContact CH2-CB 4.19Å; E796-S800 PolarHBondContact OE2-OG 3.27Å
797	Q	93.3	Very high	93.3	Very high	57 Å²	57	39.3 Å²	39.3	27%	0.266	20%	0.198	S	C	.	.			trans	-72.1	143.1	172.3	-166.6	-175.3	52.6	0	0	110	G748 D749 W763 Y799 S800	G748-Q797 PolarHBondContact O-NE2 2.9Å; D749-Q797 PolarHBondContact OD1-NE2 3.46Å; W763-Q797 HydrophobicContact CH2-CG 4.4Å; Q797-Y799 PolarHBondContact O-N 2.76Å; Q797-S800 VanDerWaalsContact O-CB 3.29Å; Q797-S800 WeakPolarHBondContact O-CB 3.5Å; Q797-S800 PolarHBondContact O-N 2.82Å
798	P	96.7	Very high	92.8	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.013	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	128.8	171.3	-24.9	34.3	0	0	0	111.7	R762 W763 V785 W788 E789 S800 L824	R762-P798 HydrophobicContact CB-CB 4.36Å; R762-P798 WeakPolarHBondContact CD-O 3.25Å; R762-P798 PolarHBondContact NH1-O 3.32Å; W763-P798 HydrophobicContact CH2-CG 4.07Å; W763-P798 HydrophobicContact CZ2-CG 3.67Å; V785-P798 HydrophobicContact CG1-CB 3.71Å; V785-P798 HydrophobicContact CG1-CG 3.5Å; V785-P798 VanDerWaalsContact CG1-CG 3.5Å; W788-P798 HydrophobicContact CE3-CB 4.34Å; W788-P798 HydrophobicContact CE3-CG 4.05Å; W788-P798 HydrophobicContact CZ3-CB 4.3Å; W788-P798 HydrophobicContact CZ3-CG 4.09Å; E789-P798 HydrophobicContact CG-CG 4.07Å; P798-S800 VanDerWaalsContact C-N 3.32Å; P798-S800 PolarHBondContact O-N 2.74Å; P798-L824 HydrophobicContact CB-CD1 4.11Å; P798-L824 HydrophobicContact CB-CD2 4Å
799	Y	95.6	Very high	92.2	Very high	8 Å²	8	42.4 Å²	42.4	3%	0.031	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	36.2	-172.5	-51.1	-83.3	0	0	0	114.1	R762 Q797 Q801 L802 V807 I822 L824	R762-Y799 VanDerWaalsContact NH1-C 3.26Å; R762-Y799 PolarHBondContact NH1-O 3.1Å; Q797-Y799 PolarHBondContact O-N 2.76Å; Y799-Q801 VanDerWaalsContact C-OE1 3.24Å; Y799-Q801 PolarHBondContact O-N 3.32Å; Y799-L802 HydrophobicContact CD1-CD1 3.98Å; Y799-L802 HydrophobicContact CG-CD1 4.4Å; Y799-L802 PolarHBondContact O-N 2.7Å; Y799-V807 HydrophobicContact CD2-CG2 4.4Å; Y799-V807 HydrophobicContact CG-CG2 4.19Å; Y799-I822 HydrophobicContact CE1-CG2 4.48Å; Y799-L824 HydrophobicContact CD1-CD2 3.74Å; Y799-L824 HydrophobicContact CD1-CG 4.43Å; Y799-L824 HydrophobicContact CD2-CD2 3.68Å; Y799-L824 HydrophobicContact CD2-CG 4.33Å; Y799-L824 HydrophobicContact CE1-CD2 3.78Å; Y799-L824 HydrophobicContact CE1-CG 3.95Å; Y799-L824 HydrophobicContact CE2-CD1 4.27Å; Y799-L824 HydrophobicContact CE2-CD2 3.72Å; Y799-L824 HydrophobicContact CE2-CG 3.84Å; Y799-L824 HydrophobicContact CG-CD2 3.69Å; Y799-L824 VanDerWaalsContact N-CD2 3.26Å
800	S	92.4	Very high	91.8	Very high	63 Å²	63	42.8 Å²	42.8	44%	0.441	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.9	-27	177.3	54.9	0	0	0	0	114.9	E796 Q797 P798	E796-S800 PolarHBondContact OE2-OG 3.27Å; Q797-S800 VanDerWaalsContact O-CB 3.29Å; Q797-S800 WeakPolarHBondContact O-CB 3.5Å; Q797-S800 PolarHBondContact O-N 2.82Å; P798-S800 VanDerWaalsContact C-N 3.32Å; P798-S800 PolarHBondContact O-N 2.74Å
801	Q	92.1	Very high	91.4	Very high	108 Å²	108	43 Å²	43	51%	0.505	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-3	177.8	80.9	-71.9	0.6	0	0	115.3	Y799	Y799-Q801 VanDerWaalsContact C-OE1 3.24Å; Y799-Q801 PolarHBondContact O-N 3.32Å
802	L	92.6	Very high	90.6	Very high	26 Å²	26	43.1 Å²	43.1	14%	0.136	22%	0.218	C	C	.	.	S	Bend	trans	-118.1	143.2	-179	-59.4	-175.3	0	0	0	110.7	R762 Y799 Q806 V807 I822	R762-L802 PolarHBondContact NH1-O 2.89Å; R762-L802 PolarHBondContact NH2-O 3.02Å; Y799-L802 HydrophobicContact CD1-CD1 3.98Å; Y799-L802 HydrophobicContact CG-CD1 4.4Å; Y799-L802 PolarHBondContact O-N 2.7Å; L802-Q806 HydrophobicContact CB-CB 3.93Å; L802-Q806 HydrophobicContact CD2-CB 4.3Å; L802-V807 HydrophobicContact CB-CG2 3.94Å; L802-V807 HydrophobicContact CD1-CG2 4.32Å; L802-I822 HydrophobicContact CD1-CD1 4.39Å; L802-I822 HydrophobicContact CD2-CD1 4.45Å
803	T	92.6	Very high	90.3	Very high	66 Å²	66	42.8 Å²	42.8	41%	0.405	22%	0.215	S	C	.	.			trans	-67.4	167.3	165.9	78.6	0	0	0	0	110.9	E805 Q806 V807	T803-E805 VanDerWaalsContact C-N 3.28Å; T803-E805 WeakPolarHBondContact CB-OE2 3.49Å; T803-E805 PolarHBondContact O-N 3.29Å; T803-E805 PolarHBondContact OG1-N 2.95Å; T803-E805 PolarHBondContact OG1-OE2 3.5Å; T803-Q806 PolarHBondContact O-N 3.28Å; T803-Q806 PolarHBondContact OG1-N 3.16Å; T803-V807 WeakPolarHBondContact O-CG2 3.39Å; T803-V807 PolarHBondContact O-N 2.82Å
804	D	88.3	Confident	90	Very high	36 Å²	36	42.7 Å²	42.7	19%	0.193	22%	0.215	C	C	.	.	H	α-helix	trans	-61.4	-41.1	177.7	-78.5	-5.4	0	0	0	110.9	Y751 I761 R762 Q806 V807 I808	Y751-D804 HydrophobicContact CD2-CB 3.64Å; Y751-D804 WeakPolarHBondContact CD2-OD2 3.16Å; Y751-D804 HydrophobicContact CE2-CB 3.96Å; Y751-D804 HydrophobicContact CG-CB 4.45Å; I761-D804 HydrophobicContact CD1-CB 3.69Å; R762-D804 IonicContact CZ-OD1 2.89Å; R762-D804 VanDerWaalsContact CZ-OD1 3.23Å; R762-D804 IonicContact NE-OD1 3.84Å; R762-D804 PolarHBondContact NE-OD1 2.93Å; R762-D804 IonicContact NH2-OD1 3.02Å; R762-D804 PolarHBondContact NH2-OD1 2.86Å; D804-Q806 VanDerWaalsContact C-N 3.34Å; D804-Q806 PolarHBondContact O-N 2.95Å; D804-V807 WeakPolarHBondContact O-CB 3.43Å; D804-V807 PolarHBondContact O-N 3.19Å; D804-V807 VanDerWaalsContact O-N 3.12Å; D804-I808 VanDerWaalsContact O-CD1 3.29Å; D804-I808 WeakPolarHBondContact O-CD1 3.38Å; D804-I808 WeakPolarHBondContact O-CG1 3.39Å; D804-I808 PolarHBondContact O-N 3.2Å
805	E	87	Confident	89.3	Confident	92 Å²	92	47.2 Å²	47.2	43%	0.43	23%	0.233	S	C	.	.	H	α-helix	trans	-58.8	-43.6	174.6	-56.1	70.7	-152.4	0	0	111.2	T803 V807 I808 E809	T803-E805 VanDerWaalsContact C-N 3.28Å; T803-E805 WeakPolarHBondContact CB-OE2 3.49Å; T803-E805 PolarHBondContact O-N 3.29Å; T803-E805 PolarHBondContact OG1-N 2.95Å; T803-E805 PolarHBondContact OG1-OE2 3.5Å; E805-V807 VanDerWaalsContact C-N 3.33Å; E805-V807 PolarHBondContact O-N 3.34Å; E805-I808 CarbonylContact O-C 3.6Å; E805-I808 WeakPolarHBondContact O-CA 3.34Å; E805-I808 WeakPolarHBondContact O-CB 3.1Å; E805-I808 PolarHBondContact O-N 3.22Å; E805-I808 VanDerWaalsContact O-N 3.09Å; E805-E809 WeakPolarHBondContact O-CG 3.39Å; E805-E809 PolarHBondContact O-N 2.86Å
806	Q	89.4	Confident	88.7	Confident	77 Å²	77	47.5 Å²	47.5	36%	0.36	23%	0.231	S	C	.	.	H	α-helix	trans	-68.6	-29.9	176.7	-70.6	174	-23.7	0	0	113	L802 T803 D804 I808 N810	L802-Q806 HydrophobicContact CB-CB 3.93Å; L802-Q806 HydrophobicContact CD2-CB 4.3Å; T803-Q806 PolarHBondContact O-N 3.28Å; T803-Q806 PolarHBondContact OG1-N 3.16Å; D804-Q806 VanDerWaalsContact C-N 3.34Å; D804-Q806 PolarHBondContact O-N 2.95Å; Q806-I808 VanDerWaalsContact C-N 3.34Å; Q806-N810 VanDerWaalsContact O-CB 3.32Å; Q806-N810 WeakPolarHBondContact O-CB 3.39Å; Q806-N810 PolarHBondContact O-N 3.25Å
807	V	90.9	Very high	88.5	Confident	5 Å²	5	45.9 Å²	45.9	3%	0.03	23%	0.226	C	C	.	.	H	α-helix	trans	-67.1	-38.3	169.7	171.5	0	0	0	0	110.4	I761 R762 Y799 L802 T803 D804 E805 T811	I761-V807 HydrophobicContact CD1-CB 4.39Å; I761-V807 HydrophobicContact CD1-CG1 4.3Å; I761-V807 HydrophobicContact CG1-CG1 4.46Å; R762-V807 HydrophobicContact CG-CG1 4.15Å; R762-V807 HydrophobicContact CG-CG2 4.19Å; Y799-V807 HydrophobicContact CD2-CG2 4.4Å; Y799-V807 HydrophobicContact CG-CG2 4.19Å; L802-V807 HydrophobicContact CB-CG2 3.94Å; L802-V807 HydrophobicContact CD1-CG2 4.32Å; T803-V807 WeakPolarHBondContact O-CG2 3.39Å; T803-V807 PolarHBondContact O-N 2.82Å; D804-V807 WeakPolarHBondContact O-CB 3.43Å; D804-V807 PolarHBondContact O-N 3.19Å; D804-V807 VanDerWaalsContact O-N 3.12Å; E805-V807 VanDerWaalsContact C-N 3.33Å; E805-V807 PolarHBondContact O-N 3.34Å; V807-T811 PolarHBondContact O-N 2.91Å
808	I	88.1	Confident	87.9	Confident	8 Å²	8	48.2 Å²	48.2	4%	0.041	24%	0.237	C	C	.	.	H	α-helix	trans	-66.6	-49.5	174.2	-67.5	147.9	0	0	0	110.8	A532 I534 Y751 I761 D804 E805 Q806 N810 T811 G812	A532-I808 HydrophobicContact CB-CG2 4.31Å; I534-I808 HydrophobicContact CD1-CD1 3.38Å; I534-I808 HydrophobicContact CD1-CG1 3.86Å; I534-I808 HydrophobicContact CD1-CG2 4.05Å; I534-I808 HydrophobicContact CG1-CD1 4.25Å; I534-I808 HydrophobicContact CG1-CG1 4.22Å; I534-I808 HydrophobicContact CG1-CG2 3.66Å; Y751-I808 HydrophobicContact CD1-CD1 4.09Å; Y751-I808 HydrophobicContact CE1-CD1 3.75Å; I761-I808 HydrophobicContact CD1-CD1 3.94Å; I761-I808 HydrophobicContact CD1-CG1 3.99Å; D804-I808 VanDerWaalsContact O-CD1 3.29Å; D804-I808 WeakPolarHBondContact O-CD1 3.38Å; D804-I808 WeakPolarHBondContact O-CG1 3.39Å; D804-I808 PolarHBondContact O-N 3.2Å; E805-I808 CarbonylContact O-C 3.6Å; E805-I808 WeakPolarHBondContact O-CA 3.34Å; E805-I808 WeakPolarHBondContact O-CB 3.1Å; E805-I808 PolarHBondContact O-N 3.22Å; E805-I808 VanDerWaalsContact O-N 3.09Å; Q806-I808 VanDerWaalsContact C-N 3.34Å; I808-N810 VanDerWaalsContact C-N 3.26Å; I808-N810 PolarHBondContact O-N 3.2Å; I808-T811 WeakPolarHBondContact O-CB 3.29Å; I808-T811 PolarHBondContact O-N 3.06Å; I808-T811 PolarHBondContact O-OG1 3.23Å; I808-G812 PolarHBondContact O-N 3.42Å
809	E	84.9	Confident	87.4	Confident	64 Å²	64	57 Å²	57	30%	0.299	28%	0.275	S	S	.	.	H	α-helix	trans	-51.9	-43.7	174.1	-74.9	171.7	-127.4	0	0	112.2	A530 E805 T811 G812 E813	A530-E809 HydrophobicContact CB-CG 4.17Å; A530-E809 WeakPolarHBondContact O-CG 3.37Å; E805-E809 WeakPolarHBondContact O-CG 3.39Å; E805-E809 PolarHBondContact O-N 2.86Å; E809-T811 VanDerWaalsContact C-N 3.27Å; E809-T811 PolarHBondContact O-N 3.33Å; E809-G812 VanDerWaalsContact O-CA 3.27Å; E809-G812 WeakPolarHBondContact O-CA 3.26Å; E809-G812 PolarHBondContact O-N 2.8Å; E809-E813 PolarHBondContact O-N 2.88Å
810	N	89.7	Confident	86.9	Confident	12 Å²	12	64.5 Å²	64.5	6%	0.064	30%	0.303	C	S	.	.	H	α-helix	trans	-59.5	-35.8	178.4	-174.1	29.5	0	0	0	112.1	Q806 I808 G812 E813 F814 Q821 I822	Q806-N810 VanDerWaalsContact O-CB 3.32Å; Q806-N810 WeakPolarHBondContact O-CB 3.39Å; Q806-N810 PolarHBondContact O-N 3.25Å; I808-N810 VanDerWaalsContact C-N 3.26Å; I808-N810 PolarHBondContact O-N 3.2Å; N810-G812 PolarHBondContact O-N 3.31Å; N810-E813 PolarHBondContact O-N 3.3Å; N810-E813 VanDerWaalsContact O-N 3.11Å; N810-F814 WeakPolarHBondContact O-CD2 3.4Å; N810-F814 PolarHBondContact O-N 3.18Å; N810-Q821 WeakPolarHBondContact OD1-CA 3.31Å; N810-I822 PolarHBondContact ND2-O 3.24Å; N810-I822 PolarHBondContact OD1-N 3.41Å
811	T	87.4	Confident	86.8	Confident	7 Å²	7	62.8 Å²	62.8	4%	0.043	29%	0.289	C	S	.	.	H	α-helix	trans	-63.6	-31.2	171.9	72.3	0	0	0	0	112.6	W766 I769 L770 V807 I808 E809 F814 F815	W766-T811 HydrophobicContact CB-CG2 4.3Å; I769-T811 HydrophobicContact CB-CG2 4.26Å; I769-T811 HydrophobicContact CD1-CG2 3.66Å; I769-T811 HydrophobicContact CG2-CG2 4.34Å; L770-T811 WeakPolarHBondContact CD1-O 3.37Å; L770-T811 WeakPolarHBondContact CG-OG1 3.32Å; V807-T811 PolarHBondContact O-N 2.91Å; I808-T811 WeakPolarHBondContact O-CB 3.29Å; I808-T811 PolarHBondContact O-N 3.06Å; I808-T811 PolarHBondContact O-OG1 3.23Å; E809-T811 VanDerWaalsContact C-N 3.27Å; E809-T811 PolarHBondContact O-N 3.33Å; T811-F814 WeakPolarHBondContact O-CB 3.45Å; T811-F814 PolarHBondContact O-N 2.81Å; T811-F815 PolarHBondContact O-N 3.44Å
812	G	78.8	Confident	86.9	Confident	4 Å²	4	61.3 Å²	61.3	4%	0.041	28%	0.283	C	S	.	.	H	α-helix	trans	-61.7	-40.1	171.1	0	0	0	0	0	112.3	I808 E809 N810 F815 R816	I808-G812 PolarHBondContact O-N 3.42Å; E809-G812 VanDerWaalsContact O-CA 3.27Å; E809-G812 WeakPolarHBondContact O-CA 3.26Å; E809-G812 PolarHBondContact O-N 2.8Å; N810-G812 PolarHBondContact O-N 3.31Å; G812-F815 WeakPolarHBondContact O-CB 3.39Å; G812-F815 PolarHBondContact O-N 3.18Å; G812-R816 WeakPolarHBondContact O-CB 3.35Å; G812-R816 WeakPolarHBondContact O-CD 3.28Å; G812-R816 WeakPolarHBondContact O-CG 3.35Å; G812-R816 PolarHBondContact O-N 2.91Å
813	E	87.6	Confident	87	Confident	28 Å²	28	63.6 Å²	63.6	13%	0.131	29%	0.291	C	S	.	.	H	α-helix	trans	-70.6	-35.5	174.3	-67.8	-54.3	133.2	0	0	112.9	E809 N810 F815 R816 D817 R820 Q821	E809-E813 PolarHBondContact O-N 2.88Å; N810-E813 PolarHBondContact O-N 3.3Å; N810-E813 VanDerWaalsContact O-N 3.11Å; E813-F815 VanDerWaalsContact C-N 3.3Å; E813-F815 PolarHBondContact O-N 2.76Å; E813-R816 PolarHBondContact O-N 2.88Å; E813-R816 WeakPolarHBondContact OE1-CD 3.33Å; E813-R816 IonicContact OE1-CZ 3.57Å; E813-R816 IonicContact OE1-NE 3.53Å; E813-R816 IonicContact OE1-NH1 2.77Å; E813-R816 PolarHBondContact OE1-NH1 3.35Å; E813-D817 PolarHBondContact O-N 2.98Å; E813-R820 HydrophobicContact CB-CB 4.33Å; E813-R820 HydrophobicContact CG-CB 4.03Å; E813-R820 WeakPolarHBondContact OE2-CB 3.47Å; E813-R820 WeakPolarHBondContact OE2-CD 3.37Å; E813-Q821 HydrophobicContact CB-CB 3.99Å
814	F	86.8	Confident	87.1	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.009	27%	0.271	C	S	.	.	H	α-helix	trans	-59.9	-39.3	167.4	-84.5	-79.5	0	0	0	112	W766 W781 N810 T811 Q821 Y823 R844	W766-F814 HydrophobicContact CB-CB 3.75Å; W766-F814 HydrophobicContact CB-CG 4.48Å; W766-F814 HydrophobicContact CG-CB 3.86Å; W781-F814 AromaticContact CH2-CD1 3.67Å; W781-F814 HydrophobicContact CH2-CD1 3.67Å; W781-F814 HydrophobicContact CH2-CD2 4.1Å; W781-F814 AromaticContact CH2-CE1 3.5Å; W781-F814 HydrophobicContact CH2-CE1 3.5Å; W781-F814 VanDerWaalsContact CH2-CE1 3.5Å; W781-F814 AromaticContact CH2-CE2 3.98Å; W781-F814 HydrophobicContact CH2-CE2 3.98Å; W781-F814 AromaticContact CH2-CG 3.97Å; W781-F814 HydrophobicContact CH2-CG 3.97Å; W781-F814 AromaticContact CH2-CZ 3.68Å; W781-F814 HydrophobicContact CH2-CZ 3.68Å; W781-F814 HydrophobicContact CZ2-CD2 4.48Å; W781-F814 HydrophobicContact CZ2-CE1 4.38Å; W781-F814 HydrophobicContact CZ2-CE2 4.17Å; W781-F814 HydrophobicContact CZ2-CZ 4.12Å; W781-F814 HydrophobicContact CZ3-CD1 4.32Å; W781-F814 HydrophobicContact CZ3-CE1 4.19Å; N810-F814 WeakPolarHBondContact O-CD2 3.4Å; N810-F814 PolarHBondContact O-N 3.18Å; T811-F814 WeakPolarHBondContact O-CB 3.45Å; T811-F814 PolarHBondContact O-N 2.81Å; F814-Q821 HydrophobicContact CD1-CB 4.17Å; F814-Q821 HydrophobicContact CD1-CG 3.78Å; F814-Q821 HydrophobicContact CD2-CB 3.67Å; F814-Q821 HydrophobicContact CD2-CG 4.16Å; F814-Q821 HydrophobicContact CE1-CB 4.28Å; F814-Q821 HydrophobicContact CE1-CG 3.69Å; F814-Q821 HydrophobicContact CE2-CB 3.77Å; F814-Q821 HydrophobicContact CE2-CG 4.05Å; F814-Q821 HydrophobicContact CG-CB 3.88Å; F814-Q821 HydrophobicContact CG-CG 4.03Å; F814-Q821 HydrophobicContact CZ-CB 4.08Å; F814-Q821 HydrophobicContact CZ-CG 3.81Å; F814-Y823 HydrophobicContact CE1-CD1 4.27Å; F814-Y823 AromaticContact CE1-CE1 3.5Å; F814-Y823 HydrophobicContact CE1-CE1 3.5Å; F814-Y823 AromaticContact CE1-CZ 3.64Å; F814-Y823 AromaticContact CZ-CD1 3.87Å; F814-Y823 HydrophobicContact CZ-CD1 3.87Å; F814-Y823 AromaticContact CZ-CE1 3.57Å; F814-Y823 HydrophobicContact CZ-CE1 3.57Å; F814-Y823 HydrophobicContact CZ-CE2 4.48Å; F814-Y823 HydrophobicContact CZ-CG 4.46Å; F814-Y823 AromaticContact CZ-CZ 3.89Å; F814-R844 WeakPolarHBondContact O-CD 3.14Å; F814-R844 VanDerWaalsContact O-CG 3.29Å; F814-R844 WeakPolarHBondContact O-CG 3.39Å; F814-R844 PolarHBondContact O-NE 3.08Å
815	F	80.1	Confident	87.5	Confident	109 Å²	109	62.1 Å²	62.1	48%	0.478	28%	0.284	S	S	.	.	H	α-helix	trans	-67.8	-43.7	174.3	175.4	-114.2	0	0	0	112.3	W766 L770 T811 G812 E813 D817 R844	W766-F815 HydrophobicContact CE3-CB 3.99Å; W766-F815 HydrophobicContact CE3-CD2 4.18Å; W766-F815 AromaticContact CH2-CD2 3.94Å; W766-F815 HydrophobicContact CH2-CD2 3.94Å; W766-F815 HydrophobicContact CZ3-CB 4.18Å; W766-F815 AromaticContact CZ3-CD2 3.49Å; W766-F815 HydrophobicContact CZ3-CD2 3.49Å; W766-F815 VanDerWaalsContact CZ3-CD2 3.49Å; W766-F815 HydrophobicContact CZ3-CE2 4.33Å; W766-F815 HydrophobicContact CZ3-CG 4.25Å; L770-F815 HydrophobicContact CD1-CB 3.88Å; T811-F815 PolarHBondContact O-N 3.44Å; G812-F815 WeakPolarHBondContact O-CB 3.39Å; G812-F815 PolarHBondContact O-N 3.18Å; E813-F815 VanDerWaalsContact C-N 3.3Å; E813-F815 PolarHBondContact O-N 2.76Å; F815-D817 PolarHBondContact O-N 3.01Å; F815-R844 PolarHBondContact O-NE 3Å; F815-R844 PolarHBondContact O-NH2 3.47Å
816	R	79	Confident	87.9	Confident	110 Å²	110	61.4 Å²	61.4	42%	0.415	28%	0.281	S	S	.	.	H	α-helix	trans	-70.4	-22.9	-177.7	-69.5	160.6	-174.1	156.1	7	114.3	G812 E813 Q818	G812-R816 WeakPolarHBondContact O-CB 3.35Å; G812-R816 WeakPolarHBondContact O-CD 3.28Å; G812-R816 WeakPolarHBondContact O-CG 3.35Å; G812-R816 PolarHBondContact O-N 2.91Å; E813-R816 PolarHBondContact O-N 2.88Å; E813-R816 WeakPolarHBondContact OE1-CD 3.33Å; E813-R816 IonicContact OE1-CZ 3.57Å; E813-R816 IonicContact OE1-NE 3.53Å; E813-R816 IonicContact OE1-NH1 2.77Å; E813-R816 PolarHBondContact OE1-NH1 3.35Å; R816-Q818 HydrophobicContact CB-CG 4.15Å; R816-Q818 PolarHBondContact O-N 2.83Å
817	D	84.4	Confident	88.1	Confident	79 Å²	79	58 Å²	58	42%	0.422	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.6	25.8	177.4	-142.6	-8.2	0	0	0	114.7	E813 F815 K819 R844	E813-D817 PolarHBondContact O-N 2.98Å; F815-D817 PolarHBondContact O-N 3.01Å; D817-K819 PolarHBondContact O-N 2.86Å; D817-R844 WeakPolarHBondContact OD2-CD 3.38Å; D817-R844 IonicContact OD2-CZ 3.89Å; D817-R844 IonicContact OD2-NE 3.51Å; D817-R844 IonicContact OD2-NH1 2.69Å; D817-R844 PolarHBondContact OD2-NH1 3.25Å
818	Q	82.4	Confident	87.9	Confident	106 Å²	106	64.8 Å²	64.8	50%	0.495	31%	0.306	S	S	.	.	S	Bend	trans	-82.5	7.8	-176.5	-66.2	-174.3	25.5	0	0	114	R816 R820	R816-Q818 HydrophobicContact CB-CG 4.15Å; R816-Q818 PolarHBondContact O-N 2.83Å; Q818-R820 VanDerWaalsContact C-N 3.27Å; Q818-R820 HydrophobicContact CB-CG 4.26Å; Q818-R820 PolarHBondContact O-N 3.43Å
819	K	85.4	Confident	87.6	Confident	186 Å²	186	67.7 Å²	67.7	81%	0.809	32%	0.322	S	S	*	.	S	Bend	trans	59.5	34.1	-175.2	-54.5	-176.7	-179.8	-179.1	0	113.7	D817	D817-K819 PolarHBondContact O-N 2.86Å
820	R	85.6	Confident	87.9	Confident	166 Å²	166	65 Å²	65	63%	0.626	31%	0.31	S	S	*	.			trans	-107.4	-12.2	176	-65.2	174.7	174.4	-174.6	-1.4	113	E813 Q818	E813-R820 HydrophobicContact CB-CB 4.33Å; E813-R820 HydrophobicContact CG-CB 4.03Å; E813-R820 WeakPolarHBondContact OE2-CB 3.47Å; E813-R820 WeakPolarHBondContact OE2-CD 3.37Å; Q818-R820 VanDerWaalsContact C-N 3.27Å; Q818-R820 HydrophobicContact CB-CG 4.26Å; Q818-R820 PolarHBondContact O-N 3.43Å
821	Q	90.2	Very high	88	Confident	28 Å²	28	67 Å²	67	13%	0.131	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-62.6	139.8	-178.9	68.8	-82	12.1	0	0	112.1	N810 E813 F814 Y823	N810-Q821 WeakPolarHBondContact OD1-CA 3.31Å; E813-Q821 HydrophobicContact CB-CB 3.99Å; F814-Q821 HydrophobicContact CD1-CB 4.17Å; F814-Q821 HydrophobicContact CD1-CG 3.78Å; F814-Q821 HydrophobicContact CD2-CB 3.67Å; F814-Q821 HydrophobicContact CD2-CG 4.16Å; F814-Q821 HydrophobicContact CE1-CB 4.28Å; F814-Q821 HydrophobicContact CE1-CG 3.69Å; F814-Q821 HydrophobicContact CE2-CB 3.77Å; F814-Q821 HydrophobicContact CE2-CG 4.05Å; F814-Q821 HydrophobicContact CG-CB 3.88Å; F814-Q821 HydrophobicContact CG-CG 4.03Å; F814-Q821 HydrophobicContact CZ-CB 4.08Å; F814-Q821 HydrophobicContact CZ-CG 3.81Å; Q821-Y823 HydrophobicContact CG-CE2 3.71Å; Q821-Y823 PolarHBondContact NE2-OH 2.88Å; Q821-Y823 VanDerWaalsContact NE2-OH 3.15Å
822	I	92.9	Very high	88.2	Confident	76 Å²	76	72.5 Å²	72.5	39%	0.39	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-95	126.2	-179.5	-59.9	172.5	0	0	0	108.3	Y799 L802 N810	Y799-I822 HydrophobicContact CE1-CG2 4.48Å; L802-I822 HydrophobicContact CD1-CD1 4.39Å; L802-I822 HydrophobicContact CD2-CD1 4.45Å; N810-I822 PolarHBondContact ND2-O 3.24Å; N810-I822 PolarHBondContact OD1-N 3.41Å
823	Y	94.8	Very high	88.8	Confident	74 Å²	74	75.1 Å²	75.1	29%	0.29	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-97.2	155.9	170.5	-63	-92	0	0	0	109.6	F814 Q821 L839 W842	F814-Y823 HydrophobicContact CE1-CD1 4.27Å; F814-Y823 AromaticContact CE1-CE1 3.5Å; F814-Y823 HydrophobicContact CE1-CE1 3.5Å; F814-Y823 AromaticContact CE1-CZ 3.64Å; F814-Y823 AromaticContact CZ-CD1 3.87Å; F814-Y823 HydrophobicContact CZ-CD1 3.87Å; F814-Y823 AromaticContact CZ-CE1 3.57Å; F814-Y823 HydrophobicContact CZ-CE1 3.57Å; F814-Y823 HydrophobicContact CZ-CE2 4.48Å; F814-Y823 HydrophobicContact CZ-CG 4.46Å; F814-Y823 AromaticContact CZ-CZ 3.89Å; Q821-Y823 HydrophobicContact CG-CE2 3.71Å; Q821-Y823 PolarHBondContact NE2-OH 2.88Å; Q821-Y823 VanDerWaalsContact NE2-OH 3.15Å; Y823-L839 HydrophobicContact CD1-CD2 3.97Å; Y823-L839 HydrophobicContact CE1-CD2 4.47Å; Y823-L839 HydrophobicContact CG-CD2 4.14Å; Y823-W842 HydrophobicContact CD1-CB 3.95Å; Y823-W842 HydrophobicContact CD1-CE3 4.01Å; Y823-W842 HydrophobicContact CE1-CB 3.86Å
824	L	96.4	Very high	89	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-61	137.4	169.1	-67.4	170.8	0	0	0	110	V785 W788 P798 Y799 Y835 W842	V785-L824 HydrophobicContact CB-CD1 4.42Å; V785-L824 HydrophobicContact CG1-CD1 4.04Å; V785-L824 HydrophobicContact CG2-CD1 4.09Å; W788-L824 HydrophobicContact CB-CD1 4.04Å; W788-L824 HydrophobicContact CD2-CB 4.29Å; W788-L824 HydrophobicContact CD2-CD1 3.93Å; W788-L824 HydrophobicContact CD2-CD2 4.41Å; W788-L824 HydrophobicContact CD2-CG 4.44Å; W788-L824 HydrophobicContact CE3-CD1 4.3Å; W788-L824 HydrophobicContact CG-CB 4.09Å; W788-L824 HydrophobicContact CG-CD1 3.8Å; W788-L824 HydrophobicContact CG-CG 4.48Å; W788-L824 HydrophobicContact CZ2-CD2 4.43Å; P798-L824 HydrophobicContact CB-CD1 4.11Å; P798-L824 HydrophobicContact CB-CD2 4Å; Y799-L824 HydrophobicContact CD1-CD2 3.74Å; Y799-L824 HydrophobicContact CD1-CG 4.43Å; Y799-L824 HydrophobicContact CD2-CD2 3.68Å; Y799-L824 HydrophobicContact CD2-CG 4.33Å; Y799-L824 HydrophobicContact CE1-CD2 3.78Å; Y799-L824 HydrophobicContact CE1-CG 3.95Å; Y799-L824 HydrophobicContact CE2-CD1 4.27Å; Y799-L824 HydrophobicContact CE2-CD2 3.72Å; Y799-L824 HydrophobicContact CE2-CG 3.84Å; Y799-L824 HydrophobicContact CG-CD2 3.69Å; Y799-L824 VanDerWaalsContact N-CD2 3.26Å; L824-Y835 PolarHBondContact O-OH 2.7Å; L824-Y835 VanDerWaalsContact O-OH 3.08Å; L824-W842 HydrophobicContact CB-CH2 3.78Å; L824-W842 HydrophobicContact CB-CZ2 4.42Å; L824-W842 HydrophobicContact CB-CZ3 4.22Å; L824-W842 HydrophobicContact CD1-CH2 3.98Å; L824-W842 HydrophobicContact CD1-CZ2 3.81Å; L824-W842 HydrophobicContact CG-CH2 4.33Å
825	P	94.9	Very high	89.4	Confident	72 Å²	72	75.6 Å²	75.6	47%	0.468	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-67.4	153.9	-177	29	-35.6	0	0	0	111.8	W788 P827	W788-P825 HydrophobicContact CZ2-CG 4.29Å; W788-P825 PolarHBondContact NE1-O 2.87Å; P825-P827 VanDerWaalsContact O-CD 3.32Å; P825-P827 WeakPolarHBondContact O-CD 3.44Å
826	Q	95.9	Very high	90.2	Very high	77 Å²	77	77.1 Å²	77.1	36%	0.36	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-60.9	120.6	174.6	-175.7	166.6	-10.5	0	0	110.2	C830 D832 Y835	Q826-C830 HydrophobicContact CG-CB 4.25Å; Q826-C830 PolarHBondContact NE2-O 2.92Å; Q826-D832 PolarHBondContact NE2-OD1 2.89Å; Q826-Y835 HydrophobicContact CB-CD1 3.79Å; Q826-Y835 HydrophobicContact CB-CD2 3.96Å; Q826-Y835 HydrophobicContact CB-CE1 3.83Å; Q826-Y835 HydrophobicContact CB-CE2 4.01Å; Q826-Y835 HydrophobicContact CB-CG 3.87Å; Q826-Y835 HydrophobicContact CG-CD1 3.87Å; Q826-Y835 HydrophobicContact CG-CD2 4.12Å; Q826-Y835 HydrophobicContact CG-CE1 4.43Å; Q826-Y835 HydrophobicContact CG-CG 3.71Å; Q826-Y835 VanDerWaalsContact OE1-CD1 3.28Å
827	P	93.3	Very high	91	Very high	5 Å²	5	73 Å²	73	3%	0.032	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-60	146.1	176.1	-20	29.2	0	0	0	111.3	W788 L791 N792 P825 L829 C830	W788-P827 HydrophobicContact CG-CG 4.46Å; L791-P827 HydrophobicContact CB-CB 3.75Å; L791-P827 HydrophobicContact CB-CG 3.73Å; L791-P827 HydrophobicContact CD1-CG 4.32Å; N792-P827 WeakPolarHBondContact ND2-CG 3.47Å; P825-P827 VanDerWaalsContact O-CD 3.32Å; P825-P827 WeakPolarHBondContact O-CD 3.44Å; P827-L829 PolarHBondContact O-N 3.29Å; P827-L829 VanDerWaalsContact O-N 3.08Å; P827-C830 HydrophobicContact CB-CB 3.83Å; P827-C830 HydrophobicContact CG-CB 3.88Å; P827-C830 VanDerWaalsContact O-CB 3.29Å; P827-C830 WeakPolarHBondContact O-CB 3.33Å; P827-C830 PolarHBondContact O-N 2.92Å
828	V	87.8	Confident	91.6	Very high	147 Å²	147	69.3 Å²	69.3	89%	0.891	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-30.1	-176.3	179.6	0	0	0	0	112.9
829	L	81.9	Confident	92.3	Very high	70 Å²	70	67.1 Å²	67.1	37%	0.366	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	1.3	179.8	-59.6	172.1	0	0	0	113.6	P679 F694 F793 P827 P831	P679-L829 HydrophobicContact CB-CD1 3.84Å; P679-L829 HydrophobicContact CG-CD1 3.75Å; F694-L829 WeakPolarHBondContact CE2-O 3.29Å; F793-L829 HydrophobicContact CD2-CD1 4.27Å; F793-L829 HydrophobicContact CE2-CD1 3.67Å; P827-L829 PolarHBondContact O-N 3.29Å; P827-L829 VanDerWaalsContact O-N 3.08Å; L829-P831 WeakPolarHBondContact O-CD 3.32Å
830	C	90.4	Very high	92.8	Very high	8 Å²	8	60.4 Å²	60.4	5%	0.054	31%	0.308	C	S	.	.			trans	-92.9	117.9	-172.9	-175.1	0	0	0	0	112.2	L791 Q826 P827 Y835	L791-C830 HydrophobicContact CD1-CB 3.99Å; Q826-C830 HydrophobicContact CG-CB 4.25Å; Q826-C830 PolarHBondContact NE2-O 2.92Å; P827-C830 HydrophobicContact CB-CB 3.83Å; P827-C830 HydrophobicContact CG-CB 3.88Å; P827-C830 VanDerWaalsContact O-CB 3.29Å; P827-C830 WeakPolarHBondContact O-CB 3.33Å; P827-C830 PolarHBondContact O-N 2.92Å; C830-Y835 PolarHBondContact SG-N 3.48Å; C830-Y835 VanDerWaalsContact SG-N 3.4Å
831	P	91.3	Very high	93.4	Very high	54 Å²	54	52.5 Å²	52.5	35%	0.351	28%	0.279	S	S	.	.			trans	-62.8	150.5	170.7	-21.4	33.9	0	0	0	112.3	F694 L829 S833 L834 Y835	F694-P831 HydrophobicContact CE1-CG 4.32Å; F694-P831 HydrophobicContact CE2-CG 4.42Å; F694-P831 VanDerWaalsContact CZ-CD 3.5Å; F694-P831 HydrophobicContact CZ-CG 3.75Å; L829-P831 WeakPolarHBondContact O-CD 3.32Å; P831-S833 PolarHBondContact O-N 3.36Å; P831-S833 VanDerWaalsContact O-N 3.15Å; P831-L834 PolarHBondContact O-N 2.92Å; P831-Y835 PolarHBondContact O-N 3.31Å
832	D	92.3	Very high	93.8	Very high	121 Å²	121	51.2 Å²	51.2	65%	0.647	27%	0.273	S	S	*	.	H	α-helix	trans	-56.5	-32.5	178.8	-62.7	-6.9	0	0	0	113.1	Q826 K836	Q826-D832 PolarHBondContact NE2-OD1 2.89Å; D832-K836 WeakPolarHBondContact O-CB 3.28Å; D832-K836 PolarHBondContact O-N 3.43Å
833	S	90.8	Very high	93.9	Very high	59 Å²	59	52.2 Å²	52.2	41%	0.413	27%	0.271	S	S	.	.	H	α-helix	trans	-62.2	-43	174.9	49	0	0	0	0	112.1	P831 I837	P831-S833 PolarHBondContact O-N 3.36Å; P831-S833 VanDerWaalsContact O-N 3.15Å; S833-I837 WeakPolarHBondContact O-CG1 3.45Å; S833-I837 PolarHBondContact O-N 3.27Å
834	L	92.3	Very high	93.8	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-75.4	-41.9	-179.8	-172.2	59.2	0	0	0	111.1	F694 L787 L791 P831 K836 I837 M838 L859 L862	F694-L834 HydrophobicContact CE2-CD2 4.36Å; F694-L834 HydrophobicContact CZ-CD2 4.07Å; L787-L834 HydrophobicContact CD2-CD1 3.88Å; L787-L834 HydrophobicContact CD2-CG 4.34Å; L791-L834 HydrophobicContact CD1-CD2 3.75Å; L791-L834 HydrophobicContact CD1-CG 4.29Å; L791-L834 HydrophobicContact CD2-CD2 4.14Å; P831-L834 PolarHBondContact O-N 2.92Å; L834-K836 VanDerWaalsContact C-N 3.28Å; L834-K836 PolarHBondContact O-N 2.83Å; L834-I837 HydrophobicContact CD1-CD1 4.38Å; L834-I837 WeakPolarHBondContact O-CA 3.38Å; L834-I837 WeakPolarHBondContact O-CB 3.41Å; L834-I837 PolarHBondContact O-N 2.8Å; L834-M838 PolarHBondContact O-N 3.31Å; L834-L859 HydrophobicContact CD1-CD2 3.54Å; L834-L862 HydrophobicContact CD1-CD1 4.19Å
835	Y	96.3	Very high	93.5	Very high	38 Å²	38	56.1 Å²	56.1	15%	0.149	29%	0.291	C	S	.	.	H	α-helix	trans	-63.6	-35.3	174.7	-174.8	-124.2	0	0	0	112	L824 Q826 C830 P831 I837 M838 L839 W842	L824-Y835 PolarHBondContact O-OH 2.7Å; L824-Y835 VanDerWaalsContact O-OH 3.08Å; Q826-Y835 HydrophobicContact CB-CD1 3.79Å; Q826-Y835 HydrophobicContact CB-CD2 3.96Å; Q826-Y835 HydrophobicContact CB-CE1 3.83Å; Q826-Y835 HydrophobicContact CB-CE2 4.01Å; Q826-Y835 HydrophobicContact CB-CG 3.87Å; Q826-Y835 HydrophobicContact CG-CD1 3.87Å; Q826-Y835 HydrophobicContact CG-CD2 4.12Å; Q826-Y835 HydrophobicContact CG-CE1 4.43Å; Q826-Y835 HydrophobicContact CG-CG 3.71Å; Q826-Y835 VanDerWaalsContact OE1-CD1 3.28Å; C830-Y835 PolarHBondContact SG-N 3.48Å; C830-Y835 VanDerWaalsContact SG-N 3.4Å; P831-Y835 PolarHBondContact O-N 3.31Å; Y835-I837 VanDerWaalsContact C-N 3.28Å; Y835-I837 PolarHBondContact O-N 3.39Å; Y835-M838 HydrophobicContact CD2-SD 4.11Å; Y835-M838 WeakPolarHBondContact O-CB 3.42Å; Y835-M838 PolarHBondContact O-N 2.91Å; Y835-M838 VanDerWaalsContact O-N 3.15Å; Y835-L839 HydrophobicContact CD1-CD1 3.94Å; Y835-L839 HydrophobicContact CD1-CG 4.43Å; Y835-L839 HydrophobicContact CE1-CD1 3.68Å; Y835-L839 HydrophobicContact CE1-CD2 4.42Å; Y835-L839 HydrophobicContact CE1-CG 4.12Å; Y835-L839 HydrophobicContact CE2-CG 4.41Å; Y835-L839 WeakPolarHBondContact O-CG 3.33Å; Y835-L839 PolarHBondContact O-N 2.96Å; Y835-W842 HydrophobicContact CE2-CZ3 4.26Å
836	K	95.6	Very high	93.4	Very high	141 Å²	141	54.3 Å²	54.3	61%	0.613	28%	0.282	S	S	*	.	H	α-helix	trans	-64.4	-28.6	171.7	-175.4	177.2	179.9	-177.8	0	113	D832 L834 N840	D832-K836 WeakPolarHBondContact O-CB 3.28Å; D832-K836 PolarHBondContact O-N 3.43Å; L834-K836 VanDerWaalsContact C-N 3.28Å; L834-K836 PolarHBondContact O-N 2.83Å; K836-N840 PolarHBondContact O-N 3.47Å; K836-N840 PolarHBondContact O-ND2 3.36Å
837	I	95.4	Very high	93.1	Very high	25 Å²	25	60 Å²	60	13%	0.128	31%	0.306	C	S	.	.	H	α-helix	trans	-67.8	-45.2	170.9	-66.7	167.5	0	0	0	109.8	S833 L834 Y835 L839 N840 C841 L855 A858 L862	S833-I837 WeakPolarHBondContact O-CG1 3.45Å; S833-I837 PolarHBondContact O-N 3.27Å; L834-I837 HydrophobicContact CD1-CD1 4.38Å; L834-I837 WeakPolarHBondContact O-CA 3.38Å; L834-I837 WeakPolarHBondContact O-CB 3.41Å; L834-I837 PolarHBondContact O-N 2.8Å; Y835-I837 VanDerWaalsContact C-N 3.28Å; Y835-I837 PolarHBondContact O-N 3.39Å; I837-L839 PolarHBondContact O-N 3.39Å; I837-N840 PolarHBondContact O-N 2.86Å; I837-N840 VanDerWaalsContact O-N 3.11Å; I837-C841 PolarHBondContact O-N 3.38Å; I837-C841 VanDerWaalsContact O-N 3.12Å; I837-C841 PolarHBondContact O-SG 2.96Å; I837-L855 HydrophobicContact CG2-CD2 3.31Å; I837-A858 HydrophobicContact CD1-CB 3.88Å; I837-L862 HydrophobicContact CD1-CD1 3.73Å
838	M	97.5	Very high	93.2	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-59.6	-47.3	178	-57.8	160.7	80.1	0	0	111.6	A784 L787 W788 L791 L834 Y835 N840 C841 W842	A784-M838 HydrophobicContact CB-CB 4.2Å; A784-M838 HydrophobicContact CB-CG 4.48Å; L787-M838 HydrophobicContact CB-CE 4.5Å; L787-M838 HydrophobicContact CD2-CG 3.67Å; L787-M838 HydrophobicContact CD2-SD 4.16Å; L787-M838 HydrophobicContact CG-CE 4.3Å; L787-M838 HydrophobicContact CG-CG 4.17Å; L787-M838 HydrophobicContact CG-SD 4.14Å; W788-M838 HydrophobicContact CB-CE 3.47Å; W788-M838 VanDerWaalsContact CB-CE 3.47Å; W788-M838 HydrophobicContact CG-CE 4.11Å; L791-M838 HydrophobicContact CD1-SD 4.22Å; L834-M838 PolarHBondContact O-N 3.31Å; Y835-M838 HydrophobicContact CD2-SD 4.11Å; Y835-M838 WeakPolarHBondContact O-CB 3.42Å; Y835-M838 PolarHBondContact O-N 2.91Å; Y835-M838 VanDerWaalsContact O-N 3.15Å; M838-N840 VanDerWaalsContact C-N 3.28Å; M838-N840 PolarHBondContact O-N 3.24Å; M838-C841 WeakPolarHBondContact O-CA 3.33Å; M838-C841 WeakPolarHBondContact O-CB 3.35Å; M838-C841 PolarHBondContact O-N 3.47Å; M838-W842 HydrophobicContact CB-CE3 4.35Å; M838-W842 HydrophobicContact CB-CH2 3.95Å; M838-W842 HydrophobicContact CB-CZ2 4.39Å; M838-W842 HydrophobicContact CB-CZ3 3.92Å; M838-W842 HydrophobicContact CE-CH2 3.92Å; M838-W842 HydrophobicContact CE-CZ2 4.49Å; M838-W842 PolarHBondContact O-N 2.91Å
839	L	97	Very high	93.7	Very high	60 Å²	60	58.2 Å²	58.2	31%	0.314	29%	0.286	S	S	.	.	H	α-helix	trans	-60.6	-31.3	174.8	-69.9	172.6	0	0	0	113.7	Y823 Y835 I837 W842	Y823-L839 HydrophobicContact CD1-CD2 3.97Å; Y823-L839 HydrophobicContact CE1-CD2 4.47Å; Y823-L839 HydrophobicContact CG-CD2 4.14Å; Y835-L839 HydrophobicContact CD1-CD1 3.94Å; Y835-L839 HydrophobicContact CD1-CG 4.43Å; Y835-L839 HydrophobicContact CE1-CD1 3.68Å; Y835-L839 HydrophobicContact CE1-CD2 4.42Å; Y835-L839 HydrophobicContact CE1-CG 4.12Å; Y835-L839 HydrophobicContact CE2-CG 4.41Å; Y835-L839 WeakPolarHBondContact O-CG 3.33Å; Y835-L839 PolarHBondContact O-N 2.96Å; I837-L839 PolarHBondContact O-N 3.39Å; L839-W842 HydrophobicContact CD2-CE3 4.26Å; L839-W842 PolarHBondContact O-N 3.3Å
840	N	97.2	Very high	94.4	Very high	45 Å²	45	56.2 Å²	56.2	24%	0.241	28%	0.277	C	S	.	.	H	α-helix	trans	-73.2	-28.8	173.6	-79.9	-60.9	0	0	0	112.6	K836 I837 M838 R843 P850	K836-N840 PolarHBondContact O-N 3.47Å; K836-N840 PolarHBondContact O-ND2 3.36Å; I837-N840 PolarHBondContact O-N 2.86Å; I837-N840 VanDerWaalsContact O-N 3.11Å; M838-N840 VanDerWaalsContact C-N 3.28Å; M838-N840 PolarHBondContact O-N 3.24Å; N840-R843 WeakPolarHBondContact O-CG 3.48Å; N840-R843 PolarHBondContact OD1-NE 3.48Å; N840-R843 PolarHBondContact OD1-NH2 3.02Å; N840-P850 WeakPolarHBondContact O-CD 3.29Å
841	C	98.1	Very high	94.7	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.007	29%	0.291	C	S	.	.	H	α-helix	trans	-71.6	-35.1	172.5	-57.3	0	0	0	0	111.7	V780 A784 I837 M838 R843 R849	V780-C841 HydrophobicContact CG1-CB 3.82Å; V780-C841 WeakPolarHBondContact O-CB 3.36Å; A784-C841 HydrophobicContact CB-CB 3.42Å; A784-C841 VanDerWaalsContact CB-CB 3.42Å; I837-C841 PolarHBondContact O-N 3.38Å; I837-C841 VanDerWaalsContact O-N 3.12Å; I837-C841 PolarHBondContact O-SG 2.96Å; M838-C841 WeakPolarHBondContact O-CA 3.33Å; M838-C841 WeakPolarHBondContact O-CB 3.35Å; M838-C841 PolarHBondContact O-N 3.47Å; C841-R843 PolarHBondContact O-N 3.3Å; C841-R849 WeakPolarHBondContact O-CD 3.36Å; C841-R849 WeakPolarHBondContact O-CG 3.42Å; C841-R849 PolarHBondContact O-NE 3.26Å
842	W	97.6	Very high	95	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	23.9	176.1	-55.2	-39.7	0	0	0	114.4	W781 A784 V785 Y823 L824 Y835 M838 L839	W781-W842 AromaticContact CD1-CD1 3.95Å; W781-W842 AromaticContact CD2-CD1 3.59Å; W781-W842 HydrophobicContact CD2-CG 4.44Å; W781-W842 AromaticContact CE2-CD1 3.75Å; W781-W842 HydrophobicContact CE3-CB 4.28Å; W781-W842 AromaticContact CG-CD1 3.74Å; W781-W842 HydrophobicContact CH2-CB 4.43Å; W781-W842 HydrophobicContact CZ3-CB 4.2Å; W781-W842 AromaticContact NE1-CD1 3.94Å; W781-W842 PolarHBondContact O-NE1 2.56Å; A784-W842 HydrophobicContact CB-CD2 4.41Å; A784-W842 HydrophobicContact CB-CZ2 3.87Å; A784-W842 WeakPolarHBondContact O-CZ2 3.17Å; V785-W842 HydrophobicContact CG2-CZ2 4.18Å; Y823-W842 HydrophobicContact CD1-CB 3.95Å; Y823-W842 HydrophobicContact CD1-CE3 4.01Å; Y823-W842 HydrophobicContact CE1-CB 3.86Å; L824-W842 HydrophobicContact CB-CH2 3.78Å; L824-W842 HydrophobicContact CB-CZ2 4.42Å; L824-W842 HydrophobicContact CB-CZ3 4.22Å; L824-W842 HydrophobicContact CD1-CH2 3.98Å; L824-W842 HydrophobicContact CD1-CZ2 3.81Å; L824-W842 HydrophobicContact CG-CH2 4.33Å; Y835-W842 HydrophobicContact CE2-CZ3 4.26Å; M838-W842 HydrophobicContact CB-CE3 4.35Å; M838-W842 HydrophobicContact CB-CH2 3.95Å; M838-W842 HydrophobicContact CB-CZ2 4.39Å; M838-W842 HydrophobicContact CB-CZ3 3.92Å; M838-W842 HydrophobicContact CE-CH2 3.92Å; M838-W842 HydrophobicContact CE-CZ2 4.49Å; M838-W842 PolarHBondContact O-N 2.91Å; L839-W842 HydrophobicContact CD2-CE3 4.26Å; L839-W842 PolarHBondContact O-N 3.3Å
843	R	95.9	Very high	95.2	Very high	97 Å²	97	53.7 Å²	53.7	37%	0.366	26%	0.261	S	S	.	.			trans	-66.5	137.7	170.6	-77.5	-177.1	-176.2	-129.4	7.6	111	N840 C841 N845 E848 R849	N840-R843 WeakPolarHBondContact O-CG 3.48Å; N840-R843 PolarHBondContact OD1-NE 3.48Å; N840-R843 PolarHBondContact OD1-NH2 3.02Å; C841-R843 PolarHBondContact O-N 3.3Å; R843-N845 PolarHBondContact O-N 3.39Å; R843-E848 HydrophobicContact CB-CB 4.43Å; R843-E848 VanDerWaalsContact CD-CB 3.43Å; R843-E848 WeakPolarHBondContact CD-O 3.35Å; R843-E848 IonicContact CZ-OE2 2.68Å; R843-E848 IonicContact NH1-OE2 2.7Å; R843-E848 PolarHBondContact NH1-OE2 3.39Å; R843-R849 HydrophobicContact CB-CG 4.2Å; R843-R849 PolarHBondContact O-NE 3.44Å; R843-R849 PolarHBondContact O-NH2 3.42Å
844	R	91.6	Very high	95.5	Very high	87 Å²	87	55.8 Å²	55.8	33%	0.328	27%	0.265	S	S	.	.	S	Bend	trans	-54.6	-52.1	175.4	-178.4	-178.7	178.9	-107.6	-9.9	111.5	W766 F814 F815 D817 A846 R849	W766-R844 HydrophobicContact CZ2-CG 4.36Å; W766-R844 PolarHBondContact NE1-O 2.96Å; F814-R844 WeakPolarHBondContact O-CD 3.14Å; F814-R844 VanDerWaalsContact O-CG 3.29Å; F814-R844 WeakPolarHBondContact O-CG 3.39Å; F814-R844 PolarHBondContact O-NE 3.08Å; F815-R844 PolarHBondContact O-NE 3Å; F815-R844 PolarHBondContact O-NH2 3.47Å; D817-R844 WeakPolarHBondContact OD2-CD 3.38Å; D817-R844 IonicContact OD2-CZ 3.89Å; D817-R844 IonicContact OD2-NE 3.51Å; D817-R844 IonicContact OD2-NH1 2.69Å; D817-R844 PolarHBondContact OD2-NH1 3.25Å; R844-A846 PolarHBondContact O-N 3.2Å; R844-R849 PolarHBondContact O-NH2 3.07Å
845	N	91.6	Very high	95.7	Very high	70 Å²	70	55.8 Å²	55.8	37%	0.374	27%	0.265	S	S	.	.	S	Bend	trans	-75.8	112.3	177.2	-178.8	4.4	0	0	0	111	R843 K847 E848	R843-N845 PolarHBondContact O-N 3.39Å; N845-K847 PolarHBondContact O-N 2.92Å; N845-K847 VanDerWaalsContact O-N 3.09Å; N845-K847 PolarHBondContact OD1-N 3.01Å; N845-K847 VanDerWaalsContact OD1-N 3.09Å; N845-E848 HydrophobicContact CB-CB 4.5Å; N845-E848 HydrophobicContact CB-CG 4.12Å; N845-E848 VanDerWaalsContact CB-OE1 3.26Å; N845-E848 WeakPolarHBondContact CB-OE1 3.36Å; N845-E848 PolarHBondContact ND2-OE1 3.47Å; N845-E848 PolarHBondContact O-N 3.47Å
846	A	91.1	Very high	95.7	Very high	33 Å²	33	55.4 Å²	55.4	27%	0.273	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-57	-24.3	179	0	0	0	0	0	114.2	A777 R844 E848	A777-A846 HydrophobicContact CB-CB 3.91Å; R844-A846 PolarHBondContact O-N 3.2Å; A846-E848 VanDerWaalsContact C-N 3.31Å; A846-E848 PolarHBondContact O-N 2.96Å
847	K	91.3	Very high	95.6	Very high	198 Å²	198	55.2 Å²	55.2	86%	0.861	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-77.3	-11.4	176.9	-65.3	-175.1	178	-179.5	0	114.5	N845	N845-K847 PolarHBondContact O-N 2.92Å; N845-K847 VanDerWaalsContact O-N 3.09Å; N845-K847 PolarHBondContact OD1-N 3.01Å; N845-K847 VanDerWaalsContact OD1-N 3.09Å
848	E	94.3	Very high	95.4	Very high	96 Å²	96	55.5 Å²	55.5	45%	0.449	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-100.9	-5	178.6	-65.1	170.5	-138.2	0	0	113	R843 N845 A846	R843-E848 HydrophobicContact CB-CB 4.43Å; R843-E848 VanDerWaalsContact CD-CB 3.43Å; R843-E848 WeakPolarHBondContact CD-O 3.35Å; R843-E848 IonicContact CZ-OE2 2.68Å; R843-E848 IonicContact NH1-OE2 2.7Å; R843-E848 PolarHBondContact NH1-OE2 3.39Å; N845-E848 HydrophobicContact CB-CB 4.5Å; N845-E848 HydrophobicContact CB-CG 4.12Å; N845-E848 VanDerWaalsContact CB-OE1 3.26Å; N845-E848 WeakPolarHBondContact CB-OE1 3.36Å; N845-E848 PolarHBondContact ND2-OE1 3.47Å; N845-E848 PolarHBondContact O-N 3.47Å; A846-E848 VanDerWaalsContact C-N 3.31Å; A846-E848 PolarHBondContact O-N 2.96Å
849	R	97.6	Very high	95.1	Very high	18 Å²	18	55.6 Å²	55.6	7%	0.068	27%	0.266	C	S	.	.	S	Bend	trans	-73	139.5	175.4	-59	179.4	-171.7	152.9	10.1	108.9	E767 A777 V780 C841 R843 R844	E767-R849 IonicContact OE1-CZ 3.99Å; E767-R849 IonicContact OE1-NH1 3.73Å; E767-R849 PolarHBondContact OE1-NH1 3.27Å; E767-R849 IonicContact OE1-NH2 2.96Å; E767-R849 IonicContact OE2-CZ 2.87Å; E767-R849 IonicContact OE2-NH1 2.98Å; E767-R849 PolarHBondContact OE2-NH1 3Å; E767-R849 IonicContact OE2-NH2 3.56Å; E767-R849 PolarHBondContact OE2-NH2 2.76Å; A777-R849 VanDerWaalsContact O-CD 3.23Å; A777-R849 WeakPolarHBondContact O-CD 3.45Å; A777-R849 PolarHBondContact O-NH1 3.46Å; V780-R849 HydrophobicContact CG1-CB 3.95Å; C841-R849 WeakPolarHBondContact O-CD 3.36Å; C841-R849 WeakPolarHBondContact O-CG 3.42Å; C841-R849 PolarHBondContact O-NE 3.26Å; R843-R849 HydrophobicContact CB-CG 4.2Å; R843-R849 PolarHBondContact O-NE 3.44Å; R843-R849 PolarHBondContact O-NH2 3.42Å; R844-R849 PolarHBondContact O-NH2 3.07Å
850	P	97.5	Very high	94.7	Very high	27 Å²	27	56.5 Å²	56.5	18%	0.175	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-65.3	146.1	178.7	29.2	-35.9	0	0	0	110.8	V780 N840 E854 L855	V780-P850 HydrophobicContact CG1-CG 4.49Å; V780-P850 WeakPolarHBondContact CG1-O 3.41Å; V780-P850 WeakPolarHBondContact CG2-O 3.32Å; N840-P850 WeakPolarHBondContact O-CD 3.29Å; P850-E854 HydrophobicContact CB-CB 4.37Å; P850-L855 HydrophobicContact CB-CD2 4.17Å; P850-L855 HydrophobicContact CB-CG 4.17Å; P850-L855 HydrophobicContact CG-CD1 4.4Å; P850-L855 HydrophobicContact CG-CD2 3.61Å; P850-L855 HydrophobicContact CG-CG 3.94Å
851	S	97.4	Very high	94.1	Very high	49 Å²	49	60.9 Å²	60.9	34%	0.343	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-70.7	156.6	170.8	67.2	0	0	0	0	111.3	Q853 E854 L855	S851-Q853 PolarHBondContact O-N 3.29Å; S851-Q853 VanDerWaalsContact O-N 3.15Å; S851-E854 VanDerWaalsContact CB-OE2 3.27Å; S851-E854 WeakPolarHBondContact CB-OE2 3.46Å; S851-E854 PolarHBondContact N-OE2 2.87Å; S851-E854 PolarHBondContact O-N 3.16Å; S851-E854 WeakPolarHBondContact OG-CG 3.49Å; S851-E854 PolarHBondContact OG-N 3Å; S851-E854 PolarHBondContact OG-OE2 2.94Å; S851-L855 PolarHBondContact O-N 3.41Å
852	F	97.7	Very high	92.9	Very high	1 Å²	1	63.6 Å²	63.6	0%	0.004	31%	0.309	C	S	.	.	H	α-helix	trans	-58.3	-26.9	172.2	-74.9	-66.9	0	0	0	113.3	M708 K709 T776 D779 V780 Y783 E854 L855 H856	M708-F852 HydrophobicContact CB-CD1 3.44Å; M708-F852 VanDerWaalsContact CB-CD1 3.44Å; M708-F852 HydrophobicContact CB-CD2 3.87Å; M708-F852 HydrophobicContact CB-CE1 3.37Å; M708-F852 HydrophobicContact CB-CE2 3.8Å; M708-F852 HydrophobicContact CB-CG 3.69Å; M708-F852 HydrophobicContact CB-CZ 3.56Å; M708-F852 HydrophobicContact CE-CE2 3.84Å; M708-F852 HydrophobicContact CE-CZ 3.82Å; M708-F852 HydrophobicContact CG-CD1 4.39Å; M708-F852 HydrophobicContact CG-CE1 3.87Å; M708-F852 HydrophobicContact CG-CE2 4.5Å; M708-F852 HydrophobicContact CG-CZ 3.93Å; K709-F852 HydrophobicContact CB-CB 3.86Å; T776-F852 HydrophobicContact CG2-CD2 3.77Å; T776-F852 HydrophobicContact CG2-CE2 3.9Å; D779-F852 HydrophobicContact CB-CE2 3.95Å; D779-F852 HydrophobicContact CB-CZ 4.01Å; V780-F852 HydrophobicContact CB-CZ 4.36Å; V780-F852 HydrophobicContact CG2-CD1 4.37Å; V780-F852 HydrophobicContact CG2-CD2 3.86Å; V780-F852 HydrophobicContact CG2-CE1 4.11Å; V780-F852 HydrophobicContact CG2-CE2 3.56Å; V780-F852 HydrophobicContact CG2-CG 4.25Å; V780-F852 HydrophobicContact CG2-CZ 3.7Å; Y783-F852 HydrophobicContact CD1-CE1 4.39Å; Y783-F852 HydrophobicContact CD2-CE1 4Å; Y783-F852 AromaticContact CG-CE1 3.72Å; Y783-F852 HydrophobicContact CG-CE1 3.72Å; F852-E854 VanDerWaalsContact C-N 3.33Å; F852-L855 HydrophobicContact CD1-CD1 3.87Å; F852-L855 HydrophobicContact CE1-CD1 4.16Å; F852-H856 WeakPolarHBondContact O-CB 3.26Å; F852-H856 PolarHBondContact O-N 3.13Å
853	Q	96.3	Very high	91.6	Very high	80 Å²	80	66.8 Å²	66.8	37%	0.374	32%	0.323	S	S	.	.	H	α-helix	trans	-68.2	-30.3	173.5	-179.4	58.8	89.4	0	0	112.8	S851 R857	S851-Q853 PolarHBondContact O-N 3.29Å; S851-Q853 VanDerWaalsContact O-N 3.15Å; Q853-R857 WeakPolarHBondContact O-CD 3.37Å; Q853-R857 WeakPolarHBondContact O-CG 3.47Å
854	E	96.1	Very high	89.5	Confident	104 Å²	104	70.7 Å²	70.7	49%	0.486	36%	0.361	S	S	.	.	H	α-helix	trans	-83.5	-42.6	174.6	-69.2	157.8	123.3	0	0	111.2	P850 S851 F852 H856 R857 A858	P850-E854 HydrophobicContact CB-CB 4.37Å; S851-E854 VanDerWaalsContact CB-OE2 3.27Å; S851-E854 WeakPolarHBondContact CB-OE2 3.46Å; S851-E854 PolarHBondContact N-OE2 2.87Å; S851-E854 PolarHBondContact O-N 3.16Å; S851-E854 WeakPolarHBondContact OG-CG 3.49Å; S851-E854 PolarHBondContact OG-N 3Å; S851-E854 PolarHBondContact OG-OE2 2.94Å; F852-E854 VanDerWaalsContact C-N 3.33Å; E854-H856 PolarHBondContact O-N 3.01Å; E854-R857 PolarHBondContact O-N 2.99Å; E854-R857 VanDerWaalsContact O-N 3.15Å; E854-A858 WeakPolarHBondContact O-CB 3.49Å; E854-A858 PolarHBondContact O-N 2.86Å
855	L	96.6	Very high	89.4	Confident	2 Å²	2	69.9 Å²	69.9	1%	0.01	36%	0.363	C	S	.	.	H	α-helix	trans	-55.6	-49.9	174.4	-70.1	173.5	0	0	0	111.9	V780 Y783 I837 P850 S851 F852 R857 A858 L859	V780-L855 HydrophobicContact CG1-CD1 4.21Å; V780-L855 HydrophobicContact CG2-CD1 4.26Å; Y783-L855 HydrophobicContact CD1-CD1 3.86Å; Y783-L855 HydrophobicContact CE1-CD1 4.23Å; I837-L855 HydrophobicContact CG2-CD2 3.31Å; P850-L855 HydrophobicContact CB-CD2 4.17Å; P850-L855 HydrophobicContact CB-CG 4.17Å; P850-L855 HydrophobicContact CG-CD1 4.4Å; P850-L855 HydrophobicContact CG-CD2 3.61Å; P850-L855 HydrophobicContact CG-CG 3.94Å; S851-L855 PolarHBondContact O-N 3.41Å; F852-L855 HydrophobicContact CD1-CD1 3.87Å; F852-L855 HydrophobicContact CE1-CD1 4.16Å; L855-R857 VanDerWaalsContact C-N 3.27Å; L855-R857 PolarHBondContact O-N 2.96Å; L855-A858 PolarHBondContact O-N 2.98Å; L855-L859 WeakPolarHBondContact O-CB 3.25Å; L855-L859 WeakPolarHBondContact O-CD1 3.48Å; L855-L859 VanDerWaalsContact O-CG 3.27Å; L855-L859 WeakPolarHBondContact O-CG 3.14Å; L855-L859 PolarHBondContact O-N 3.38Å
856	H	96.1	Very high	89.3	Confident	29 Å²	29	69.8 Å²	69.8	13%	0.134	36%	0.362	C	S	.	.	H	α-helix	trans	-60.1	-33.9	177.9	179.1	-82.3	0	0	0	113.1	A705 S706 K709 F852 E854 L860	A705-H856 HydrophobicContact CB-CB 4.12Å; S706-H856 VanDerWaalsContact CA-CD2 3.46Å; S706-H856 WeakPolarHBondContact CA-CD2 3.45Å; K709-H856 HydrophobicContact CD-CB 4.46Å; K709-H856 PolarHBondContact NZ-CD2 3.19Å; K709-H856 PolarHBondContact NZ-NE2 2.84Å; F852-H856 WeakPolarHBondContact O-CB 3.26Å; F852-H856 PolarHBondContact O-N 3.13Å; E854-H856 PolarHBondContact O-N 3.01Å; H856-L860 WeakPolarHBondContact O-CG 3.47Å; H856-L860 PolarHBondContact O-N 3Å
857	R	93.9	Very high	89.2	Confident	137 Å²	137	71.9 Å²	71.9	52%	0.517	37%	0.367	S	S	.	.	H	α-helix	trans	-72.1	-51.2	174.7	-72.8	171.2	-176.3	153.1	2	110.7	Q853 E854 L855 L859 L860 D861	Q853-R857 WeakPolarHBondContact O-CD 3.37Å; Q853-R857 WeakPolarHBondContact O-CG 3.47Å; E854-R857 PolarHBondContact O-N 2.99Å; E854-R857 VanDerWaalsContact O-N 3.15Å; L855-R857 VanDerWaalsContact C-N 3.27Å; L855-R857 PolarHBondContact O-N 2.96Å; R857-L859 PolarHBondContact O-N 2.66Å; R857-L859 VanDerWaalsContact O-N 3.12Å; R857-L860 WeakPolarHBondContact O-CB 3.28Å; R857-L860 PolarHBondContact O-N 3.04Å; R857-D861 VanDerWaalsContact O-CG 3.24Å; R857-D861 PolarHBondContact O-N 3.41Å
858	A	91.9	Very high	89.1	Confident	31 Å²	31	64.5 Å²	64.5	26%	0.256	34%	0.338	S	S	.	.	H	α-helix	trans	-59.8	-26.6	-179.1	0	0	0	0	0	113.5	I837 E854 L855 L862	I837-A858 HydrophobicContact CD1-CB 3.88Å; E854-A858 WeakPolarHBondContact O-CB 3.49Å; E854-A858 PolarHBondContact O-N 2.86Å; L855-A858 PolarHBondContact O-N 2.98Å; A858-L862 WeakPolarHBondContact O-CD1 3.17Å; A858-L862 WeakPolarHBondContact O-CG 3.44Å; A858-L862 PolarHBondContact O-N 3.37Å
859	L	90.1	Very high	88.7	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-81.3	-35.7	174.4	-68	162.4	0	0	0	113.1	T702 A705 Y783 L834 L855 R857 D861 L862 Q863	T702-L859 WeakPolarHBondContact OG1-CB 3.23Å; A705-L859 HydrophobicContact CB-CD1 3.93Å; Y783-L859 HydrophobicContact CE1-CD1 4.38Å; Y783-L859 WeakPolarHBondContact OH-CD1 3.34Å; L834-L859 HydrophobicContact CD1-CD2 3.54Å; L855-L859 WeakPolarHBondContact O-CB 3.25Å; L855-L859 WeakPolarHBondContact O-CD1 3.48Å; L855-L859 VanDerWaalsContact O-CG 3.27Å; L855-L859 WeakPolarHBondContact O-CG 3.14Å; L855-L859 PolarHBondContact O-N 3.38Å; R857-L859 PolarHBondContact O-N 2.66Å; R857-L859 VanDerWaalsContact O-N 3.12Å; L859-D861 VanDerWaalsContact C-N 3.34Å; L859-L862 PolarHBondContact O-N 3.19Å; L859-Q863 PolarHBondContact O-N 3.49Å
860	L	89	Confident	88.2	Confident	79 Å²	79	65.5 Å²	65.5	41%	0.414	35%	0.349	S	S	.	.	H	α-helix	trans	-63.6	-41.2	168.8	-72.7	169.9	0	0	0	111.1	T702 H856 R857 L862 Q863	T702-L860 HydrophobicContact CG2-CD2 3.9Å; T702-L860 HydrophobicContact CG2-CG 4.01Å; H856-L860 WeakPolarHBondContact O-CG 3.47Å; H856-L860 PolarHBondContact O-N 3Å; R857-L860 WeakPolarHBondContact O-CB 3.28Å; R857-L860 PolarHBondContact O-N 3.04Å; L860-L862 PolarHBondContact O-N 3.24Å; L860-L862 VanDerWaalsContact O-N 3.13Å; L860-Q863 PolarHBondContact O-N 2.83Å; L860-Q863 VanDerWaalsContact O-N 3.15Å
861	D	83.6	Confident	87.5	Confident	137 Å²	137	68.2 Å²	68.2	73%	0.733	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-7.5	175.4	-59.8	-32.9	0	0	0	113.2	R857 L859	R857-D861 VanDerWaalsContact O-CG 3.24Å; R857-D861 PolarHBondContact O-N 3.41Å; L859-D861 VanDerWaalsContact C-N 3.34Å
862	L	74.4	Confident	86.7	Confident	59 Å²	59	69.7 Å²	69.7	31%	0.309	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	0.3	176.1	-74.8	172.6	0	0	0	113.5	L834 I837 A858 L859 L860	L834-L862 HydrophobicContact CD1-CD1 4.19Å; I837-L862 HydrophobicContact CD1-CD1 3.73Å; A858-L862 WeakPolarHBondContact O-CD1 3.17Å; A858-L862 WeakPolarHBondContact O-CG 3.44Å; A858-L862 PolarHBondContact O-N 3.37Å; L859-L862 PolarHBondContact O-N 3.19Å; L860-L862 PolarHBondContact O-N 3.24Å; L860-L862 VanDerWaalsContact O-N 3.13Å
863	Q	69.2	Low	85.8	Confident	66 Å²	66	75.4 Å²	75.4	31%	0.308	39%	0.393	S	S	.	.			trans	-79.7	137.7	171.2	-75.3	174.5	-2.5	0	0	110.2	T702 L859 L860	T702-Q863 PolarHBondContact OG1-NE2 3.39Å; L859-Q863 PolarHBondContact O-N 3.49Å; L860-Q863 PolarHBondContact O-N 2.83Å; L860-Q863 VanDerWaalsContact O-N 3.15Å
864	P	52.5	Low	84.9	Confident	179 Å²	179	75 Å²	75	100%	1.162	40%	0.395	S	S	*	.			trans	-79.4	0	-174.5	33.4	-36.8	0	0	0	114.5

Retrieved 864 of 864 residues in 625.5 ms (Link to these results)

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