A0A5K4F1U8_SCHMA Loading...

Calpain catalytic domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F1U8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,662 aa.

						>A0A5K4F1U8_SCHMA|A0A5K4F1U8
MMKRNEKLLKMEQMEMIEKIEHHGVISSVEKNKETNKEKKDQTDHNTTKLMNPKIPETIIFASCKNTVSSLASLVPSATKEEITMKLKQFGFSYTDSYPICIAKRRTIPIIPPSPIQPTPQWKLIRPRPPDFPFDSSNDSDLHSNKEKEPIRSLLLWTPVQEHIFYEPEKVILSPPTSTVESVYVSSSSPDTGKQNSGIMKTRSNSQTSPTRRRRESSSNNPSPSKTQKRGSREDILKKEKSTSGITNKSKEVKGQNKTPETSGSSQLNSSSRTTNSLHMKSSGEDIMPEIPIKSISVTNPKETWIDIKDFCEIFKTVDIYHKPNTYSIVKTYSNIKPSYQSKVHYLFCDSIQPCEIIIQLSVIYQWPIPIAKRLTPTTYSRGLTCMPETDDVVTMPTNERSSIHFLPVTTTSASFVRDDNSHSQNNSPDDLQSTTCGINPSVQTSSSTSSSSSSSTPPSSLLIETYHWNKSIQGDPIKYVETTGSSSISLLLPFSRYCYKLLITAPLGYVITILGRIRSSIINTKYNSFMKGIHQSSMNVMLDDYDYILLNGITTYPLLIRYYANQLISCMVSIGQALEVLVHLTETYEQHIHESLVTTTTTHSNNNNNGTIINNSELNELEFKEKLTSAIKNFNDKHEELKQFLSIWPNQKIIKPTLLSILQRLTENSGTSDMNYAWCILQKDFITINPFRVTYGHETVSNPPPVSITKQKSKVLSSRGEKANQSVKINPIEETIISRWNQPIDPDILVAIVRIQSLFRGYRIRNAIRLNQPNYMIETLLSIIHSHNKSNINQHTTTNTTTIDNRFLHKVSLLRIKRLSIGWMNCLNLLQQGQIQFEAGNQIIEKLILTNNDDSDLQSKFYKDLNSYLSIKEYSGNYSEIPSPYLMHHTGESQFTNMDESFHKDWIHLLFRDCIYSSTMLKNEVMINEEEVKYSFRLKTTVSNSYILLINNDNGEIIQPSIEYPYSWLNLKVNHHGYSLLGIVNNPLAPIPSGKWNLQLLGPGIIGNENLPKPIGTTLNLCSNFYTIELEDYYEPNLKNLLFRRRIIASNDSLITIHLRLSVPNVYTRLCIKMGNKEMIFAEGYGGACIYAYIILADTIIEEKKRQTPNSGRLLEVNKTDGIKLSLKDVVSSKVTLNKLNTSKISPRRSASVKKNMKPGSSSSSSTGGSTTGSGRGSSSTNSANIERTHHYEQSNTSSPHSHMLNSQRLEQEQEQEEEEERYYWIEAYVDGKNWPLSISNWSFLEEQRCNKLEECQVNNTTSRSTSADKSSDSRTIKSATKSPGNKTIGVTGQKSGSTRGTSAKIDYNQAHWKMRIICNNSNDIKIMNMDNKMSEIKALKRAWEEMEPGRAIRAELSRARYLEEYGLMNEPDHKTYVDDSGSEITMKSDDNPISTLDPSKIYCLTLPSQLNHTIKPIKLMSFNKFYLKFNEMKLKQIEQIKNLFYPYNTTYNTTTNNNTTNSNTNNNTTNYTTYNTTNITTNDTTNDTTNNTTNNTTYNTTHNDTTNNTTYNITNSIMINMNQWLIINQYLKQIELLSNQNMNQLMKIKYELFNELMENFKFNLMNSKNKFNQFKQNYIEILKTIQFLNDEAHYKYYELCNNYKNNIIKQYENDKEFNQLINNESVTMPTMLSPIETLQKRERTKSSKSSKSGSNKKIKI
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.9	Very low	46.2	Very low	132 Å²	132	117 Å²	117	65%	0.65	54%	0.54	S	S	*	.				0	-104.8	0	-70.8	-57.7	100.7	0	0	112.2	K3 R4 W157 P159	M1-K3 PolarHBondContact O-N 3.32Å; M1-R4 WeakPolarHBondContact O-CB 3.38Å; M1-R4 PolarHBondContact O-N 3.17Å; M1-W157 HydrophobicContact CE-CH2 3.44Å; M1-W157 VanDerWaalsContact CE-CH2 3.44Å; M1-W157 HydrophobicContact CE-CZ2 4.32Å; M1-W157 HydrophobicContact CE-CZ3 4.12Å; M1-W157 HydrophobicContact SD-CH2 3.58Å; M1-W157 VanDerWaalsContact SD-CH2 3.58Å; M1-W157 HydrophobicContact SD-CZ3 3.66Å; M1-P159 HydrophobicContact SD-CG 4.43Å
2	M	36.1	Very low	46.1	Very low	101 Å²	101	114.3 Å²	114.3	50%	0.498	53%	0.528	S	S	.	.	H	α-helix	trans	-41.6	-47.5	-163.1	-76.3	-178.3	170.4	0	0	117.1	R4 N5 E6 I59	M2-R4 PolarHBondContact O-N 3.47Å; M2-N5 PolarHBondContact O-N 3.06Å; M2-N5 VanDerWaalsContact O-N 3.09Å; M2-E6 PolarHBondContact O-N 3.37Å; M2-I59 HydrophobicContact CE-CD1 3.98Å; M2-I59 HydrophobicContact CG-CD1 4.24Å
3	K	44	Very low	46.1	Very low	179 Å²	179	113.5 Å²	113.5	78%	0.778	53%	0.525	S	S	*	.	H	α-helix	trans	-55	-22.2	178	-72	-173.7	176.2	-178.8	0	115	M1 K7	M1-K3 PolarHBondContact O-N 3.32Å; K3-K7 PolarHBondContact O-N 3.21Å
4	R	45.7	Very low	46.2	Very low	180 Å²	180	114.7 Å²	114.7	68%	0.679	53%	0.533	S	S	*	.	H	α-helix	trans	-80.7	-43.7	177.1	-155.6	169.7	-173.4	152	-1.2	111.2	M1 M2 E6 K7 L8	M1-R4 WeakPolarHBondContact O-CB 3.38Å; M1-R4 PolarHBondContact O-N 3.17Å; M2-R4 PolarHBondContact O-N 3.47Å; R4-E6 VanDerWaalsContact C-N 3.33Å; R4-K7 PolarHBondContact O-N 3.19Å; R4-K7 VanDerWaalsContact O-N 3.17Å; R4-L8 PolarHBondContact O-N 3.37Å; R4-L8 VanDerWaalsContact O-N 3.09Å
5	N	48.2	Very low	46.3	Very low	81 Å²	81	113.5 Å²	113.5	43%	0.433	53%	0.528	S	S	.	.	H	α-helix	trans	-64.1	-39	171.7	-68.8	21.6	0	0	0	111.2	M2 K7 L8 L9	M2-N5 PolarHBondContact O-N 3.06Å; M2-N5 VanDerWaalsContact O-N 3.09Å; N5-K7 PolarHBondContact O-N 3.34Å; N5-L8 PolarHBondContact O-N 2.84Å; N5-L9 WeakPolarHBondContact O-CB 3.33Å; N5-L9 PolarHBondContact O-N 2.93Å
6	E	48.2	Very low	46.1	Very low	86 Å²	86	113.8 Å²	113.8	40%	0.402	53%	0.531	S	S	.	.	H	α-helix	trans	-59.9	-29.8	175.1	-158.3	-159.8	146.2	0	0	112.4	M2 R4 K10	M2-E6 PolarHBondContact O-N 3.37Å; R4-E6 VanDerWaalsContact C-N 3.33Å; E6-K10 WeakPolarHBondContact O-CD 3.45Å; E6-K10 VanDerWaalsContact O-CG 3.23Å; E6-K10 WeakPolarHBondContact O-CG 3.47Å; E6-K10 PolarHBondContact O-N 2.99Å; E6-K10 WeakPolarHBondContact OE1-CE 3.4Å; E6-K10 IonicContact OE1-NZ 3.67Å; E6-K10 PolarHBondContact OE1-NZ 3.1Å
7	K	51.5	Low	46.1	Very low	154 Å²	154	112.4 Å²	112.4	67%	0.67	53%	0.527	S	S	*	.	H	α-helix	trans	-82.1	-34.2	176.7	-153.9	177.7	-174.8	-173.9	0	112.4	K3 R4 N5 M11	K3-K7 PolarHBondContact O-N 3.21Å; R4-K7 PolarHBondContact O-N 3.19Å; R4-K7 VanDerWaalsContact O-N 3.17Å; N5-K7 PolarHBondContact O-N 3.34Å; K7-M11 WeakPolarHBondContact O-CE 3.39Å; K7-M11 PolarHBondContact O-N 2.94Å
8	L	47.3	Very low	46	Very low	73 Å²	73	112.6 Å²	112.6	38%	0.382	53%	0.528	S	S	.	.	H	α-helix	trans	-68.2	-45	172.3	-86	159.8	0	0	0	112.3	R4 N5 K10 M11 E12	R4-L8 PolarHBondContact O-N 3.37Å; R4-L8 VanDerWaalsContact O-N 3.09Å; N5-L8 PolarHBondContact O-N 2.84Å; L8-K10 VanDerWaalsContact C-N 3.26Å; L8-K10 PolarHBondContact O-N 2.83Å; L8-M11 WeakPolarHBondContact O-CA 3.08Å; L8-M11 VanDerWaalsContact O-CB 3.32Å; L8-M11 WeakPolarHBondContact O-CB 3.37Å; L8-M11 PolarHBondContact O-N 3.37Å; L8-E12 PolarHBondContact O-N 3.1Å; L8-E12 VanDerWaalsContact O-N 3.09Å
9	L	47.8	Very low	45.7	Very low	81 Å²	81	113.4 Å²	113.4	42%	0.424	53%	0.529	S	S	.	.	H	α-helix	trans	-64.1	-32.2	179.1	-163	74.8	0	0	0	112	N5 M11 Q13	N5-L9 WeakPolarHBondContact O-CB 3.33Å; N5-L9 PolarHBondContact O-N 2.93Å; L9-M11 VanDerWaalsContact C-N 3.34Å; L9-Q13 WeakPolarHBondContact O-CB 3.34Å; L9-Q13 VanDerWaalsContact O-CG 3.25Å; L9-Q13 WeakPolarHBondContact O-CG 3.31Å; L9-Q13 PolarHBondContact O-N 2.68Å
10	K	50	Low	45.5	Very low	107 Å²	107	113.9 Å²	113.9	47%	0.465	53%	0.534	S	S	.	.	H	α-helix	trans	-69.1	-29.9	171.9	-74.2	170.5	-169	172.5	0	112.9	E6 L8 M14	E6-K10 WeakPolarHBondContact O-CD 3.45Å; E6-K10 VanDerWaalsContact O-CG 3.23Å; E6-K10 WeakPolarHBondContact O-CG 3.47Å; E6-K10 PolarHBondContact O-N 2.99Å; E6-K10 WeakPolarHBondContact OE1-CE 3.4Å; E6-K10 IonicContact OE1-NZ 3.67Å; E6-K10 PolarHBondContact OE1-NZ 3.1Å; L8-K10 VanDerWaalsContact C-N 3.26Å; L8-K10 PolarHBondContact O-N 2.83Å; K10-M14 PolarHBondContact O-N 2.71Å; K10-M14 VanDerWaalsContact O-N 3.09Å
11	M	54.2	Low	45.2	Very low	113 Å²	113	114.8 Å²	114.8	56%	0.557	54%	0.538	S	S	*	.	H	α-helix	trans	-69	-49.1	172.2	-106.3	172.6	-73.8	0	0	111.4	K7 L8 L9 Q13 M14 E15	K7-M11 WeakPolarHBondContact O-CE 3.39Å; K7-M11 PolarHBondContact O-N 2.94Å; L8-M11 WeakPolarHBondContact O-CA 3.08Å; L8-M11 VanDerWaalsContact O-CB 3.32Å; L8-M11 WeakPolarHBondContact O-CB 3.37Å; L8-M11 PolarHBondContact O-N 3.37Å; L9-M11 VanDerWaalsContact C-N 3.34Å; M11-Q13 PolarHBondContact O-N 3.07Å; M11-M14 PolarHBondContact O-N 3.14Å; M11-M14 VanDerWaalsContact O-N 3.1Å; M11-E15 PolarHBondContact O-N 2.87Å
12	E	45.8	Very low	45.3	Very low	85 Å²	85	116.4 Å²	116.4	40%	0.397	54%	0.544	S	S	.	.	H	α-helix	trans	-60.4	-31.7	174.7	-73.7	-175.6	159	0	0	112.5	L8 M16	L8-E12 PolarHBondContact O-N 3.1Å; L8-E12 VanDerWaalsContact O-N 3.09Å; E12-M16 WeakPolarHBondContact O-CB 3.43Å; E12-M16 PolarHBondContact O-N 3.07Å; E12-M16 VanDerWaalsContact O-N 3.07Å
13	Q	45.7	Very low	45.1	Very low	104 Å²	104	120.2 Å²	120.2	49%	0.486	56%	0.56	S	S	.	*	H	α-helix	trans	-69.3	-39	173.7	-76.4	171.9	10.5	0	0	112.9	L9 M11 I17	L9-Q13 WeakPolarHBondContact O-CB 3.34Å; L9-Q13 VanDerWaalsContact O-CG 3.25Å; L9-Q13 WeakPolarHBondContact O-CG 3.31Å; L9-Q13 PolarHBondContact O-N 2.68Å; M11-Q13 PolarHBondContact O-N 3.07Å; Q13-I17 WeakPolarHBondContact O-CD1 3.37Å; Q13-I17 VanDerWaalsContact O-CG1 3.26Å; Q13-I17 WeakPolarHBondContact O-CG1 3.31Å; Q13-I17 PolarHBondContact O-N 3.33Å
14	M	48.3	Very low	44.3	Very low	130 Å²	130	114.8 Å²	114.8	64%	0.64	56%	0.555	S	S	*	*	H	α-helix	trans	-68.7	-43	173.1	-72.1	-170.2	70.3	0	0	111.8	K10 M11 M16 I17 E18	K10-M14 PolarHBondContact O-N 2.71Å; K10-M14 VanDerWaalsContact O-N 3.09Å; M11-M14 PolarHBondContact O-N 3.14Å; M11-M14 VanDerWaalsContact O-N 3.1Å; M14-M16 VanDerWaalsContact C-N 3.26Å; M14-M16 PolarHBondContact O-N 2.85Å; M14-I17 WeakPolarHBondContact O-CA 3.18Å; M14-I17 WeakPolarHBondContact O-CB 3.4Å; M14-I17 PolarHBondContact O-N 2.8Å; M14-E18 PolarHBondContact O-N 3.32Å
15	E	46.4	Very low	43.4	Very low	97 Å²	97	112.2 Å²	112.2	45%	0.453	56%	0.559	S	S	.	*	H	α-helix	trans	-64.6	-29.5	179.9	-156.2	-164.7	143.8	0	0	112.4	M11 K19	M11-E15 PolarHBondContact O-N 2.87Å; E15-K19 WeakPolarHBondContact O-CD 3.27Å; E15-K19 VanDerWaalsContact O-CG 3.31Å; E15-K19 WeakPolarHBondContact O-CG 3.42Å; E15-K19 PolarHBondContact O-N 2.8Å; E15-K19 IonicContact OE1-NZ 2.69Å; E15-K19 PolarHBondContact OE1-NZ 2.82Å
16	M	43.4	Very low	42.4	Very low	117 Å²	117	116.4 Å²	116.4	58%	0.576	58%	0.58	S	S	*	*	H	α-helix	trans	-76.3	-25.7	169.3	-89.6	-171.9	-81.9	0	0	113.9	E12 M14 I20	E12-M16 WeakPolarHBondContact O-CB 3.43Å; E12-M16 PolarHBondContact O-N 3.07Å; E12-M16 VanDerWaalsContact O-N 3.07Å; M14-M16 VanDerWaalsContact C-N 3.26Å; M14-M16 PolarHBondContact O-N 2.85Å; M16-I20 WeakPolarHBondContact O-CD1 3.41Å; M16-I20 VanDerWaalsContact O-CG1 3.28Å; M16-I20 WeakPolarHBondContact O-CG1 3.2Å; M16-I20 PolarHBondContact O-N 3.1Å
17	I	46.4	Very low	41.5	Very low	91 Å²	91	118 Å²	118	47%	0.467	60%	0.6	S	S	.	*	H	α-helix	trans	-74.1	-47.3	175.6	-71.9	163.7	0	0	0	110.2	Q13 M14 K19 I20 E21	Q13-I17 WeakPolarHBondContact O-CD1 3.37Å; Q13-I17 VanDerWaalsContact O-CG1 3.26Å; Q13-I17 WeakPolarHBondContact O-CG1 3.31Å; Q13-I17 PolarHBondContact O-N 3.33Å; M14-I17 WeakPolarHBondContact O-CA 3.18Å; M14-I17 WeakPolarHBondContact O-CB 3.4Å; M14-I17 PolarHBondContact O-N 2.8Å; I17-K19 PolarHBondContact O-N 3.47Å; I17-I20 WeakPolarHBondContact O-CA 3.5Å; I17-I20 PolarHBondContact O-N 3.43Å; I17-E21 HydrophobicContact CG2-CG 4.36Å; I17-E21 PolarHBondContact O-N 3.34Å
18	E	44	Very low	40.3	Very low	116 Å²	116	116.2 Å²	116.2	54%	0.542	61%	0.608	S	S	.	*	H	α-helix	trans	-56.3	-39.3	175.4	-69.6	179.2	132.3	0	0	111.9	M14 I20 E21 H22	M14-E18 PolarHBondContact O-N 3.32Å; E18-I20 VanDerWaalsContact C-N 3.26Å; E18-I20 PolarHBondContact O-N 3.05Å; E18-E21 PolarHBondContact O-N 3.49Å; E18-H22 PolarHBondContact O-CD2 3.42Å; E18-H22 PolarHBondContact O-N 3.08Å; E18-H22 VanDerWaalsContact O-N 3.11Å
19	K	40.6	Very low	39.5	Very low	127 Å²	127	119.1 Å²	119.1	55%	0.552	63%	0.628	S	S	*	*	H	α-helix	trans	-71.9	-13.8	176.9	-73.7	170.5	-178.1	166.8	0	114.5	E15 I17	E15-K19 WeakPolarHBondContact O-CD 3.27Å; E15-K19 VanDerWaalsContact O-CG 3.31Å; E15-K19 WeakPolarHBondContact O-CG 3.42Å; E15-K19 PolarHBondContact O-N 2.8Å; E15-K19 IonicContact OE1-NZ 2.69Å; E15-K19 PolarHBondContact OE1-NZ 2.82Å; I17-K19 PolarHBondContact O-N 3.47Å
20	I	42.5	Very low	38.7	Very low	123 Å²	123	124 Å²	124	63%	0.631	65%	0.649	S	S	*	*	H	α-helix	trans	-92.5	-41.3	172.1	-71	167.1	0	0	0	110.3	M16 I17 E18 H22 H23	M16-I20 WeakPolarHBondContact O-CD1 3.41Å; M16-I20 VanDerWaalsContact O-CG1 3.28Å; M16-I20 WeakPolarHBondContact O-CG1 3.2Å; M16-I20 PolarHBondContact O-N 3.1Å; I17-I20 WeakPolarHBondContact O-CA 3.5Å; I17-I20 PolarHBondContact O-N 3.43Å; E18-I20 VanDerWaalsContact C-N 3.26Å; E18-I20 PolarHBondContact O-N 3.05Å; I20-H22 VanDerWaalsContact C-N 3.29Å; I20-H22 PolarHBondContact O-N 2.72Å; I20-H23 PolarHBondContact O-N 2.7Å
21	E	37.5	Very low	37.6	Very low	133 Å²	133	127.9 Å²	127.9	62%	0.621	67%	0.665	S	S	*	*	H	α-helix	trans	-62.5	-35	177.7	-69.4	179.3	171.4	0	0	112.1	I17 E18 H23 G24	I17-E21 HydrophobicContact CG2-CG 4.36Å; I17-E21 PolarHBondContact O-N 3.34Å; E18-E21 PolarHBondContact O-N 3.49Å; E21-H23 PolarHBondContact O-N 3.11Å; E21-H23 VanDerWaalsContact O-N 3.12Å; E21-G24 PolarHBondContact O-N 2.78Å
22	H	37.6	Very low	36.5	Very low	167 Å²	167	130.3 Å²	130.3	77%	0.773	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-7.5	176.5	-94.2	-66	0	0	0	116.2	E18 I20	E18-H22 PolarHBondContact O-CD2 3.42Å; E18-H22 PolarHBondContact O-N 3.08Å; E18-H22 VanDerWaalsContact O-N 3.11Å; I20-H22 VanDerWaalsContact C-N 3.29Å; I20-H22 PolarHBondContact O-N 2.72Å
23	H	33	Very low	35.6	Very low	180 Å²	180	135.5 Å²	135.5	83%	0.833	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	10.6	175.3	-97	-52.6	0	0	0	114.3	I20 E21	I20-H23 PolarHBondContact O-N 2.7Å; E21-H23 PolarHBondContact O-N 3.11Å; E21-H23 VanDerWaalsContact O-N 3.12Å
24	G	27.5	Very low	34.9	Very low	65 Å²	65	139.5 Å²	139.5	67%	0.67	72%	0.721	S	S	*	*			trans	-112.2	30.6	-173	0	0	0	0	0	117.3	E21	E21-G24 PolarHBondContact O-N 2.78Å
25	V	25.6	Very low	33.9	Very low	126 Å²	126	138.8 Å²	138.8	76%	0.764	72%	0.724	S	S	*	*			trans	-133.2	76.5	-172.1	-167.4	0	0	0	0	114.2
26	I	27.4	Very low	33.1	Very low	169 Å²	169	141.9 Å²	141.9	87%	0.867	74%	0.744	S	S	*	*			trans	-143.3	105.3	150.8	-57.5	-176.2	0	0	0	110.1
27	S	28.6	Very low	32.3	Very low	120 Å²	120	145.8 Å²	145.8	84%	0.839	76%	0.757	S	S	*	*			trans	173.7	132.8	142.6	35.8	0	0	0	0	109.1
28	S	26.4	Very low	31.6	Very low	117 Å²	117	150.6 Å²	150.6	82%	0.818	78%	0.778	S	S	*	*			trans	-155.2	73.2	-170	60.3	0	0	0	0	113.7
29	V	31.7	Very low	30.7	Very low	133 Å²	133	154.3 Å²	154.3	81%	0.806	79%	0.792	S	S	*	*			trans	-150.3	131.2	171.2	173.3	0	0	0	0	105.5
30	E	30.7	Very low	30	Very low	185 Å²	185	156.7 Å²	156.7	86%	0.864	80%	0.802	S	S	*	*			cis	-147.1	-172.5	-5.5	-131.8	175.7	169.4	0	0	111.3
31	K	26.8	Very low	29.3	Very low	187 Å²	187	156 Å²	156	81%	0.813	80%	0.8	S	S	*	*			trans	-80.6	143.1	177.8	-60	161.5	-173.8	159.8	0	111
32	N	30.8	Very low	28.8	Very low	165 Å²	165	158.1 Å²	158.1	88%	0.882	81%	0.81	S	S	*	*				-165.4	154.7	114.9	-95.4	-27	0	0	0	112.1
33	K	26.3	Very low	28.3	Very low	193 Å²	193	156.2 Å²	156.2	84%	0.839	81%	0.81	S	S	*	*			trans	-106.6	142.7	166.5	-61.4	172.8	179.6	174.7	0	107
34	E	31.2	Very low	28	Very low	189 Å²	189	155 Å²	155	88%	0.883	81%	0.81	S	S	*	*				-166.7	176	106.8	-110.8	175.8	176.2	0	0	113.8
35	T	27.1	Very low	27.9	Very low	115 Å²	115	159.8 Å²	159.8	71%	0.706	81%	0.814	S	S	*	*			trans	-73.1	145.1	-167	48.1	0	0	0	0	114.1
36	N	31.1	Very low	28	Very low	162 Å²	162	161.1 Å²	161.1	87%	0.866	82%	0.817	S	S	*	*				-155.8	153.1	113.2	-100.9	-32.2	0	0	0	112.7
37	K	25.7	Very low	27.9	Very low	199 Å²	199	158.1 Å²	158.1	87%	0.865	81%	0.807	S	S	*	*			trans	-110.1	133	168.7	-71.7	174.3	176.7	172.8	0	107.8
38	E	31.1	Very low	27.9	Very low	192 Å²	192	158.4 Å²	158.4	90%	0.897	80%	0.804	S	S	*	*				-157.7	-179.1	126.2	-118.5	172	-170.9	0	0	112.5
39	K	25.8	Very low	28	Very low	193 Å²	193	162.7 Å²	162.7	84%	0.839	81%	0.808	S	S	*	*			trans	-106.2	141.8	-155.8	-53	160.9	-174.6	163.2	0	111.7
40	K	26.2	Very low	27.8	Very low	178 Å²	178	163.5 Å²	163.5	77%	0.774	81%	0.806	S	S	*	*				-172.2	143.6	115.6	-106.3	-179.6	158.8	-112.2	0	115
41	D	27.3	Very low	27.8	Very low	108 Å²	108	163 Å²	163	58%	0.578	81%	0.806	S	S	*	*			trans	52.6	112.6	141.3	-51.6	-19.5	0	0	0	122.1
42	Q	26	Very low	28.3	Very low	177 Å²	177	159.7 Å²	159.7	83%	0.827	80%	0.797	S	S	*	*			trans	64.1	97.5	138.4	-57.5	178.6	12.3	0	0	120.8
43	T	28.1	Very low	29.2	Very low	127 Å²	127	155.7 Å²	155.7	78%	0.779	78%	0.781	S	S	*	*				-176.5	143.8	111.7	22.1	0	0	0	0	112.3	H45	T43-H45 PolarHBondContact O-N 3.41Å
44	D	25.9	Very low	30.4	Very low	154 Å²	154	155.2 Å²	155.2	82%	0.824	78%	0.779	S	S	*	*			trans	-81.3	93.5	-178.1	-78.1	-55.2	0	0	0	113.3	N46	D44-N46 VanDerWaalsContact C-N 3.33Å; D44-N46 PolarHBondContact O-N 2.81Å
45	H	25.6	Very low	31.9	Very low	167 Å²	167	152.7 Å²	152.7	77%	0.773	77%	0.77	S	S	*	*			trans	-75.9	80.2	168.8	-83.2	-53.4	0	0	0	112.5	T43 T47	T43-H45 PolarHBondContact O-N 3.41Å; H45-T47 PolarHBondContact O-N 2.87Å; H45-T47 PolarHBondContact O-OG1 2.81Å
46	N	27.8	Very low	33.7	Very low	153 Å²	153	147.7 Å²	147.7	82%	0.818	74%	0.739	S	S	*	*			trans	-74.9	73.8	165.6	-97.4	-64.5	0	0	0	111.2	D44 T48	D44-N46 VanDerWaalsContact C-N 3.33Å; D44-N46 PolarHBondContact O-N 2.81Å; N46-T48 PolarHBondContact O-N 2.72Å
47	T	26.5	Very low	35.6	Very low	107 Å²	107	143.2 Å²	143.2	66%	0.656	71%	0.713	S	S	*	*			trans	-72.3	115.4	-174.3	-40.4	0	0	0	0	112.4	H45	H45-T47 PolarHBondContact O-N 2.87Å; H45-T47 PolarHBondContact O-OG1 2.81Å
48	T	27.1	Very low	37.8	Very low	125 Å²	125	136.6 Å²	136.6	77%	0.767	69%	0.689	S	S	*	*			trans	45.6	78.6	158.5	56.4	0	0	0	0	118.3	N46 L50	N46-T48 PolarHBondContact O-N 2.72Å; T48-L50 PolarHBondContact O-N 3.19Å
49	K	28.2	Very low	39.7	Very low	208 Å²	208	129.1 Å²	129.1	90%	0.904	66%	0.655	S	S	*	*			trans	-79.8	100.5	142.6	-92.7	-178.5	177.4	169.8	0	109	M51	K49-M51 PolarHBondContact O-N 2.83Å
50	L	29.3	Very low	42	Very low	149 Å²	149	122.4 Å²	122.4	78%	0.78	63%	0.628	S	S	*	*			trans	-63.2	104.9	178.2	-172.8	72.3	0	0	0	110.2	T48 N52	T48-L50 PolarHBondContact O-N 3.19Å; L50-N52 VanDerWaalsContact C-N 3.32Å; L50-N52 PolarHBondContact O-N 3.25Å
51	M	29.1	Very low	44.2	Very low	175 Å²	175	116 Å²	116	86%	0.862	60%	0.6	S	S	*	*			trans	-72	87.9	170.3	-89.8	-164.6	163.4	0	0	110	K49	K49-M51 PolarHBondContact O-N 2.83Å
52	N	39.1	Very low	46.4	Very low	117 Å²	117	110.9 Å²	110.9	63%	0.626	57%	0.573	S	S	*	*			trans	-54	131.4	158	-83	-21.7	0	0	0	108.5	L50 K54	L50-N52 VanDerWaalsContact C-N 3.32Å; L50-N52 PolarHBondContact O-N 3.25Å; N52-K54 PolarHBondContact O-N 3.39Å
53	P	47.8	Very low	48.5	Very low	82 Å²	82	102.7 Å²	102.7	53%	0.532	54%	0.535	S	S	.	.			trans	-62.1	114.4	-177.8	24.4	-32.7	0	0	0	108.9	I55	P53-I55 PolarHBondContact O-N 2.79Å
54	K	53.6	Low	50.1	Low	183 Å²	183	98.7 Å²	98.7	80%	0.796	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-59.4	116.7	-179.7	-71.9	-176.8	178.6	178.5	0	108.8	N52	N52-K54 PolarHBondContact O-N 3.39Å
55	I	60.8	Low	51.6	Low	136 Å²	136	95.5 Å²	95.5	70%	0.697	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-59.2	125	167	-59.5	172.8	0	0	0	106.1	P53	P53-I55 PolarHBondContact O-N 2.79Å
56	P	65.5	Low	52.7	Low	9 Å²	9	91.1 Å²	91.1	6%	0.058	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-61.6	143.9	-177.8	22.9	-32.5	0	0	0	110.6	T58 T326 Y327	P56-T58 PolarHBondContact O-N 2.88Å; P56-T58 VanDerWaalsContact O-N 3.15Å; P56-T326 WeakPolarHBondContact CA-OG1 3.33Å; P56-T326 WeakPolarHBondContact CB-OG1 3.34Å; P56-Y327 HydrophobicContact CB-CD2 3.68Å; P56-Y327 HydrophobicContact CB-CE1 4.47Å; P56-Y327 HydrophobicContact CB-CE2 3.38Å; P56-Y327 HydrophobicContact CB-CG 4.3Å; P56-Y327 HydrophobicContact CG-CD2 4.38Å; P56-Y327 HydrophobicContact CG-CE1 4.17Å; P56-Y327 HydrophobicContact CG-CE2 3.87Å
57	E	72.1	Confident	53.6	Low	69 Å²	69	87.9 Å²	87.9	32%	0.322	46%	0.458	S	S	.	.			trans	-72.3	109.8	179.6	-70.4	172.4	-121.5	0	0	109.1	K323 T326	E57-K323 HydrophobicContact CB-CB 4.02Å; E57-K323 HydrophobicContact CB-CD 3.87Å; E57-K323 HydrophobicContact CG-CD 4.3Å; E57-K323 WeakPolarHBondContact O-CB 3.24Å; E57-K323 PolarHBondContact O-N 2.99Å; E57-K323 IonicContact OE1-NZ 2.73Å; E57-K323 PolarHBondContact OE1-NZ 2.96Å; E57-K323 VanDerWaalsContact OE2-CD 3.24Å; E57-K323 WeakPolarHBondContact OE2-CD 3.42Å; E57-K323 IonicContact OE2-NZ 3.4Å; E57-K323 PolarHBondContact OE2-NZ 2.76Å; E57-T326 HydrophobicContact CB-CG2 4.1Å; E57-T326 HydrophobicContact CG-CG2 4.03Å; E57-T326 PolarHBondContact N-OG1 3.29Å; E57-T326 WeakPolarHBondContact OE1-CG2 3.44Å
58	T	70.1	Confident	54.5	Low	59 Å²	59	88.8 Å²	88.8	36%	0.362	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	136.6	176.1	57.1	0	0	0	0	110.5	P56 Y321 H322	P56-T58 PolarHBondContact O-N 2.88Å; P56-T58 VanDerWaalsContact O-N 3.15Å; T58-Y321 CarbonylContact C-O 3.6Å; T58-Y321 WeakPolarHBondContact CA-O 3.4Å; T58-H322 WeakPolarHBondContact CG2-ND1 3.33Å
59	I	71.3	Confident	55.2	Low	35 Å²	35	85.6 Å²	85.6	18%	0.179	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	130.7	168.6	-54.8	177.1	0	0	0	107.2	M2 F61 Y321	M2-I59 HydrophobicContact CE-CD1 3.98Å; M2-I59 HydrophobicContact CG-CD1 4.24Å; I59-F61 HydrophobicContact CB-CE2 4.4Å; I59-F61 HydrophobicContact CG2-CD2 4.01Å; I59-F61 HydrophobicContact CG2-CE2 3.44Å; I59-F61 VanDerWaalsContact CG2-CE2 3.44Å; I59-F61 HydrophobicContact CG2-CZ 3.86Å; I59-Y321 PolarHBondContact N-O 3.42Å; I59-Y321 PolarHBondContact O-N 2.97Å
60	I	74.4	Confident	55.5	Low	53 Å²	53	81.3 Å²	81.3	27%	0.272	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	123.6	-178	-54.9	173.3	0	0	0	108.2	C101 I102 V318 I320	I60-C101 WeakPolarHBondContact O-CA 3.42Å; I60-I102 HydrophobicContact CB-CB 4.35Å; I60-I102 HydrophobicContact CB-CD1 4.31Å; I60-I102 HydrophobicContact CB-CG1 4.38Å; I60-I102 HydrophobicContact CG2-CD1 3.65Å; I60-I102 HydrophobicContact CG2-CG1 4.1Å; I60-I102 PolarHBondContact O-N 3.44Å; I60-V318 HydrophobicContact CG2-CG1 3.35Å; I60-I320 HydrophobicContact CG1-CG1 4.47Å; I60-I320 HydrophobicContact CG1-CG2 4.3Å; I60-I320 HydrophobicContact CG2-CG1 4.44Å
61	F	72.9	Confident	55.7	Low	44 Å²	44	82.6 Å²	82.6	19%	0.193	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	149.6	171.1	-68.5	-84.3	0	0	0	110.4	I59 P99 I100 C101 V318 D319 Y321	I59-F61 HydrophobicContact CB-CE2 4.4Å; I59-F61 HydrophobicContact CG2-CD2 4.01Å; I59-F61 HydrophobicContact CG2-CE2 3.44Å; I59-F61 VanDerWaalsContact CG2-CE2 3.44Å; I59-F61 HydrophobicContact CG2-CZ 3.86Å; F61-P99 HydrophobicContact CB-CB 3.84Å; F61-P99 HydrophobicContact CD1-CB 3.79Å; F61-P99 HydrophobicContact CD1-CG 4.47Å; F61-P99 HydrophobicContact CG-CB 4Å; F61-I100 CarbonylContact C-O 3.53Å; F61-I100 VanDerWaalsContact CA-O 3.3Å; F61-I100 WeakPolarHBondContact CA-O 3.44Å; F61-C101 HydrophobicContact CD1-CB 3.87Å; F61-C101 HydrophobicContact CE1-CB 3.71Å; F61-V318 CarbonylContact O-C 3.52Å; F61-V318 VanDerWaalsContact O-CA 3.29Å; F61-V318 WeakPolarHBondContact O-CA 3.48Å; F61-V318 WeakPolarHBondContact O-CG1 3.45Å; F61-D319 PolarHBondContact N-O 2.95Å; F61-D319 PolarHBondContact O-N 3.14Å; F61-Y321 AromaticContact CD2-CD2 3.66Å; F61-Y321 HydrophobicContact CD2-CD2 3.66Å; F61-Y321 AromaticContact CD2-CE2 3.7Å; F61-Y321 HydrophobicContact CD2-CE2 3.7Å; F61-Y321 HydrophobicContact CE2-CD2 4.14Å; F61-Y321 HydrophobicContact CE2-CE2 4.34Å
62	A	74.1	Confident	56	Low	0 Å²	0	77.9 Å²	77.9	0%	0	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	138.2	178.4	0	0	0	0	0	110.1	I100 F311 F315 T317 V318	A62-I100 PolarHBondContact N-O 3.36Å; A62-I100 PolarHBondContact O-N 2.92Å; A62-F311 HydrophobicContact CB-CE2 3.75Å; A62-F311 HydrophobicContact CB-CZ 3.76Å; A62-F315 HydrophobicContact CB-CB 3.99Å; A62-F315 HydrophobicContact CB-CD1 3.44Å; A62-F315 VanDerWaalsContact CB-CD1 3.44Å; A62-F315 HydrophobicContact CB-CE1 4.02Å; A62-F315 HydrophobicContact CB-CG 3.73Å; A62-T317 WeakPolarHBondContact CA-O 3.25Å; A62-V318 HydrophobicContact CB-CG2 4.36Å
63	S	68.8	Low	55.7	Low	4 Å²	4	77.8 Å²	77.8	3%	0.028	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	138.3	178.8	171.7	0	0	0	0	110.5	K65 K316 T317	S63-K65 VanDerWaalsContact C-N 3.29Å; S63-K65 PolarHBondContact OG-N 3.38Å; S63-K65 VanDerWaalsContact OG-N 3.11Å; S63-K65 PolarHBondContact OG-O 2.93Å; S63-K316 PolarHBondContact O-N 3.47Å; S63-T317 PolarHBondContact N-O 3.38Å; S63-T317 PolarHBondContact O-N 3.4Å; S63-T317 VanDerWaalsContact O-N 3.11Å; S63-T317 PolarHBondContact O-OG1 2.75Å
64	C	62.7	Low	55.1	Low	43 Å²	43	79.5 Å²	79.5	29%	0.291	45%	0.451	S	S	.	.	S	Bend	trans	-79.8	-10.1	174.8	-49.1	0	0	0	0	112.9	F315	C64-F315 VanDerWaalsContact SG-CE1 3.59Å
65	K	57.1	Low	54.6	Low	88 Å²	88	75.7 Å²	75.7	38%	0.383	44%	0.443	S	S	.	.	S	Bend	trans	-118.4	130.9	174.2	-81.7	-163.8	177.6	-177.9	0	111.2	S63 T67 D96 T317	S63-K65 VanDerWaalsContact C-N 3.29Å; S63-K65 PolarHBondContact OG-N 3.38Å; S63-K65 VanDerWaalsContact OG-N 3.11Å; S63-K65 PolarHBondContact OG-O 2.93Å; K65-T67 PolarHBondContact O-N 3.26Å; K65-T67 VanDerWaalsContact O-N 3.15Å; K65-D96 HydrophobicContact CD-CB 4.12Å; K65-D96 VanDerWaalsContact CE-OD2 3.24Å; K65-D96 WeakPolarHBondContact CE-OD2 3.22Å; K65-D96 IonicContact NZ-OD1 3.06Å; K65-D96 IonicContact NZ-OD2 2.7Å; K65-D96 PolarHBondContact NZ-OD2 2.69Å; K65-T317 PolarHBondContact O-OG1 3.27Å; K65-T317 VanDerWaalsContact O-OG1 3.1Å
66	N	49.3	Very low	53.7	Low	74 Å²	74	73 Å²	73	40%	0.396	43%	0.434	S	S	.	.			trans	-69.6	106.1	171.1	179.1	3.3	0	0	0	110.5	V68 S69 T317	N66-V68 PolarHBondContact O-N 2.83Å; N66-V68 WeakPolarHBondContact OD1-CB 3.34Å; N66-V68 PolarHBondContact OD1-N 3.13Å; N66-S69 PolarHBondContact ND2-OG 3.28Å; N66-T317 HydrophobicContact CB-CG2 3.92Å
67	T	46.6	Very low	52.8	Low	85 Å²	85	77.3 Å²	77.3	52%	0.521	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-19.3	179.8	46	0	0	0	0	113.6	K65	K65-T67 PolarHBondContact O-N 3.26Å; K65-T67 VanDerWaalsContact O-N 3.15Å
68	V	44.1	Very low	51.6	Low	126 Å²	126	77.4 Å²	77.4	76%	0.764	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-15.8	-175.8	-168.5	0	0	0	0	112.3	N66	N66-V68 PolarHBondContact O-N 2.83Å; N66-V68 WeakPolarHBondContact OD1-CB 3.34Å; N66-V68 PolarHBondContact OD1-N 3.13Å
69	S	41.4	Very low	51	Low	59 Å²	59	77.3 Å²	77.3	41%	0.413	48%	0.476	S	S	.	.			trans	-117.4	41.4	-171.7	-57.2	0	0	0	0	114.2	N66 L71 A72	N66-S69 PolarHBondContact ND2-OG 3.28Å; S69-L71 PolarHBondContact O-N 2.86Å; S69-A72 PolarHBondContact O-N 3.16Å; S69-A72 VanDerWaalsContact O-N 3.15Å
70	S	36.2	Very low	50.5	Low	118 Å²	118	80.2 Å²	80.2	83%	0.825	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	21.4	-178.4	-165.6	0	0	0	0	115.9
71	L	33.8	Very low	50	Low	175 Å²	175	84 Å²	84	92%	0.916	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.8	-3	173.7	-82.4	165	0	0	0	113.4	S69	S69-L71 PolarHBondContact O-N 2.86Å
72	A	33.9	Very low	49.7	Very low	77 Å²	77	88.2 Å²	88.2	64%	0.636	53%	0.525	S	S	*	.			trans	-106	69.2	-176.3	0	0	0	0	0	112.3	S69 L74	S69-A72 PolarHBondContact O-N 3.16Å; S69-A72 VanDerWaalsContact O-N 3.15Å; A72-L74 PolarHBondContact O-N 3.29Å; A72-L74 VanDerWaalsContact O-N 3.11Å
73	S	34	Very low	49.3	Very low	114 Å²	114	89.5 Å²	89.5	80%	0.797	53%	0.531	S	S	*	.			trans	-82.7	74.8	177.5	59.4	0	0	0	0	112.6
74	L	33.9	Very low	49.1	Very low	119 Å²	119	90.1 Å²	90.1	62%	0.623	54%	0.535	S	S	*	.			trans	-154.7	88	164	-138	72.7	0	0	0	111.6	A72 T410	A72-L74 PolarHBondContact O-N 3.29Å; A72-L74 VanDerWaalsContact O-N 3.11Å; L74-T410 HydrophobicContact CB-CG2 4.18Å; L74-T410 HydrophobicContact CD2-CG2 3.95Å; L74-T410 HydrophobicContact CG-CG2 4.4Å
75	V	43.3	Very low	49.3	Very low	103 Å²	103	92.8 Å²	92.8	62%	0.624	54%	0.544	S	S	*	.			trans	-135.9	131.7	170.1	178.3	0	0	0	0	107.9	S77	V75-S77 PolarHBondContact O-N 3.45Å
76	P	43	Very low	49.9	Very low	80 Å²	80	91.4 Å²	91.4	52%	0.519	54%	0.538	S	S	.	.			trans	-61	128	-176.9	-25.6	35.2	0	0	0	113.8	A78 T79	P76-A78 PolarHBondContact O-N 3.44Å; P76-A78 VanDerWaalsContact O-N 3.12Å; P76-T79 PolarHBondContact O-N 3.4Å; P76-T79 PolarHBondContact O-OG1 3.27Å
77	S	47	Very low	50.8	Low	99 Å²	99	88.6 Å²	88.6	69%	0.692	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-30	-173.9	-56.6	0	0	0	0	114.7	V75 T79 K80	V75-S77 PolarHBondContact O-N 3.45Å; S77-T79 PolarHBondContact O-N 2.74Å; S77-T79 VanDerWaalsContact O-N 3.15Å; S77-K80 VanDerWaalsContact O-CB 3.3Å; S77-K80 WeakPolarHBondContact O-CB 3.48Å; S77-K80 PolarHBondContact O-N 2.87Å
78	A	46.3	Very low	51.9	Low	71 Å²	71	89.8 Å²	89.8	59%	0.587	52%	0.521	S	S	*	.	H	α-helix	trans	-52.1	-38.6	-179.1	0	0	0	0	0	113	P76 K80 E81	P76-A78 PolarHBondContact O-N 3.44Å; P76-A78 VanDerWaalsContact O-N 3.12Å; A78-K80 VanDerWaalsContact C-N 3.25Å; A78-K80 PolarHBondContact O-N 3.15Å; A78-E81 PolarHBondContact O-N 3.41Å
79	T	57.9	Low	53	Low	56 Å²	56	90.9 Å²	90.9	34%	0.344	52%	0.518	S	S	.	.	H	α-helix	trans	-68.6	-21.2	178.9	61	0	0	0	0	113.8	P76 S77 I83	P76-T79 PolarHBondContact O-N 3.4Å; P76-T79 PolarHBondContact O-OG1 3.27Å; S77-T79 PolarHBondContact O-N 2.74Å; S77-T79 VanDerWaalsContact O-N 3.15Å; T79-I83 WeakPolarHBondContact O-CB 3.36Å; T79-I83 WeakPolarHBondContact O-CD1 3.34Å; T79-I83 VanDerWaalsContact O-CG1 3.23Å; T79-I83 WeakPolarHBondContact O-CG1 3.31Å; T79-I83 PolarHBondContact O-N 3.1Å
80	K	59.4	Low	54.1	Low	96 Å²	96	90.2 Å²	90.2	42%	0.417	51%	0.507	S	S	.	.	H	α-helix	trans	-72.3	-33.3	-179.2	-166.7	177	-175.1	-179.8	0	111.6	S77 A78 T84 D96	S77-K80 VanDerWaalsContact O-CB 3.3Å; S77-K80 WeakPolarHBondContact O-CB 3.48Å; S77-K80 PolarHBondContact O-N 2.87Å; A78-K80 VanDerWaalsContact C-N 3.25Å; A78-K80 PolarHBondContact O-N 3.15Å; K80-T84 WeakPolarHBondContact O-CB 3.32Å; K80-T84 PolarHBondContact O-N 3.49Å; K80-T84 PolarHBondContact O-OG1 2.75Å; K80-D96 WeakPolarHBondContact CE-OD1 3.49Å; K80-D96 IonicContact NZ-OD1 2.66Å; K80-D96 PolarHBondContact NZ-OD1 2.75Å; K80-D96 IonicContact NZ-OD2 3.82Å; K80-D96 PolarHBondContact NZ-OD2 3.21Å
81	E	63.9	Low	55.5	Low	133 Å²	133	85.3 Å²	85.3	62%	0.621	48%	0.475	S	S	*	.	H	α-helix	trans	-75.6	-45	-175.6	-67.5	179.4	164.2	0	0	111.5	A78 T84 M85	A78-E81 PolarHBondContact O-N 3.41Å; E81-T84 PolarHBondContact O-N 3.41Å; E81-M85 WeakPolarHBondContact O-CB 3.4Å; E81-M85 VanDerWaalsContact O-CG 3.28Å; E81-M85 WeakPolarHBondContact O-CG 3.5Å; E81-M85 PolarHBondContact O-N 3.25Å
82	E	66.4	Low	57	Low	133 Å²	133	77.9 Å²	77.9	62%	0.621	44%	0.436	S	S	*	.	H	α-helix	trans	-61.7	-50.8	174.9	-65.5	-171.9	128.8	0	0	112.7	T84 M85 K86	E82-T84 PolarHBondContact O-N 3.02Å; E82-M85 PolarHBondContact O-N 3.28Å; E82-K86 PolarHBondContact O-N 2.81Å
83	I	66.1	Low	58	Low	27 Å²	27	78.1 Å²	78.1	14%	0.138	43%	0.433	C	S	.	.	H	α-helix	trans	-55.4	-41.8	178.5	-71.4	173	0	0	0	110.3	T79 K86 L87 I314	T79-I83 WeakPolarHBondContact O-CB 3.36Å; T79-I83 WeakPolarHBondContact O-CD1 3.34Å; T79-I83 VanDerWaalsContact O-CG1 3.23Å; T79-I83 WeakPolarHBondContact O-CG1 3.31Å; T79-I83 PolarHBondContact O-N 3.1Å; I83-K86 PolarHBondContact O-N 3.42Å; I83-L87 HydrophobicContact CG2-CD1 4.16Å; I83-L87 WeakPolarHBondContact O-CG 3.4Å; I83-L87 PolarHBondContact O-N 2.79Å; I83-I314 HydrophobicContact CG2-CG2 4.18Å
84	T	65.6	Low	58.8	Low	16 Å²	16	77.3 Å²	77.3	10%	0.098	41%	0.413	C	S	.	.	H	α-helix	trans	-88.4	-16.3	-174.9	-29.9	0	0	0	0	113.1	K80 E81 E82 L87 K88 Y94	K80-T84 WeakPolarHBondContact O-CB 3.32Å; K80-T84 PolarHBondContact O-N 3.49Å; K80-T84 PolarHBondContact O-OG1 2.75Å; E81-T84 PolarHBondContact O-N 3.41Å; E82-T84 PolarHBondContact O-N 3.02Å; T84-L87 HydrophobicContact CG2-CB 4.36Å; T84-L87 HydrophobicContact CG2-CD1 4.09Å; T84-K88 PolarHBondContact O-N 2.76Å; T84-Y94 VanDerWaalsContact CB-CZ 3.42Å; T84-Y94 HydrophobicContact CG2-CD1 3.76Å; T84-Y94 HydrophobicContact CG2-CD2 3.3Å; T84-Y94 HydrophobicContact CG2-CE1 3.79Å; T84-Y94 HydrophobicContact CG2-CE2 3.3Å; T84-Y94 HydrophobicContact CG2-CG 3.54Å; T84-Y94 VanDerWaalsContact O-CE2 3.3Å; T84-Y94 WeakPolarHBondContact O-CE2 3.39Å
85	M	66.7	Low	59.5	Low	99 Å²	99	76.3 Å²	76.3	49%	0.488	41%	0.412	S	S	.	.	H	α-helix	trans	-67.8	-44	159.4	-79.3	-121.2	59.3	0	0	111.7	E81 E82 L87 K88 Q89	E81-M85 WeakPolarHBondContact O-CB 3.4Å; E81-M85 VanDerWaalsContact O-CG 3.28Å; E81-M85 WeakPolarHBondContact O-CG 3.5Å; E81-M85 PolarHBondContact O-N 3.25Å; E82-M85 PolarHBondContact O-N 3.28Å; M85-L87 PolarHBondContact O-N 2.91Å; M85-K88 WeakPolarHBondContact O-CB 3.42Å; M85-K88 PolarHBondContact O-N 2.87Å; M85-Q89 WeakPolarHBondContact O-CG 3.31Å; M85-Q89 PolarHBondContact O-N 3.38Å
86	K	69.7	Low	59.6	Low	59 Å²	59	75 Å²	75	26%	0.257	40%	0.402	S	S	.	.	H	α-helix	trans	-60.2	-43.9	172.2	-71	179.4	174.6	177.7	0	111.2	E82 I83 K88 Q89 F90 E313 I314	E82-K86 PolarHBondContact O-N 2.81Å; I83-K86 PolarHBondContact O-N 3.42Å; K86-K88 PolarHBondContact O-N 3.49Å; K86-Q89 WeakPolarHBondContact O-CB 3.36Å; K86-Q89 PolarHBondContact O-N 3.42Å; K86-Q89 VanDerWaalsContact O-N 3.17Å; K86-F90 HydrophobicContact CB-CE2 4.44Å; K86-F90 WeakPolarHBondContact O-CD2 3.45Å; K86-F90 PolarHBondContact O-N 2.77Å; K86-E313 IonicContact NZ-OE1 2.67Å; K86-E313 PolarHBondContact NZ-OE1 2.92Å; K86-E313 IonicContact NZ-OE2 3.81Å; K86-E313 PolarHBondContact NZ-OE2 3.47Å; K86-I314 HydrophobicContact CB-CD1 3.66Å; K86-I314 HydrophobicContact CB-CG1 4.35Å; K86-I314 HydrophobicContact CD-CD1 4.15Å; K86-I314 HydrophobicContact CD-CG1 4.33Å
87	L	68.5	Low	59.9	Low	15 Å²	15	74.2 Å²	74.2	8%	0.079	40%	0.398	C	S	.	.	H	α-helix	trans	-60.4	-42.5	173.4	-71.6	163.4	0	0	0	112.8	I83 T84 M85 Q89 F90 G91 F92 I100 I314 F315	I83-L87 HydrophobicContact CG2-CD1 4.16Å; I83-L87 WeakPolarHBondContact O-CG 3.4Å; I83-L87 PolarHBondContact O-N 2.79Å; T84-L87 HydrophobicContact CG2-CB 4.36Å; T84-L87 HydrophobicContact CG2-CD1 4.09Å; M85-L87 PolarHBondContact O-N 2.91Å; L87-Q89 PolarHBondContact O-N 3.23Å; L87-F90 CarbonylContact O-C 3.42Å; L87-F90 PolarHBondContact O-N 3Å; L87-G91 PolarHBondContact O-N 3.31Å; L87-G91 VanDerWaalsContact O-N 3.12Å; L87-F92 CarbonylContact C-O 3.46Å; L87-F92 VanDerWaalsContact C-O 3.24Å; L87-F92 HydrophobicContact CB-CB 4.27Å; L87-F92 HydrophobicContact CD2-CB 4.26Å; L87-F92 HydrophobicContact CD2-CD2 4.19Å; L87-F92 PolarHBondContact O-N 2.93Å; L87-I100 HydrophobicContact CD2-CD1 4.34Å; L87-I314 HydrophobicContact CD1-CG2 4.23Å; L87-I314 HydrophobicContact CD2-CG2 3.75Å; L87-I314 HydrophobicContact CG-CG2 3.91Å; L87-F315 HydrophobicContact CD2-CZ 3.96Å
88	K	68.7	Low	60.4	Low	111 Å²	111	74.4 Å²	74.4	48%	0.483	38%	0.384	S	S	.	.	H	α-helix	trans	-56.7	-45.2	171.6	-87.7	175.4	174.3	156	0	111.9	T84 M85 K86 F90 G91 F92 Y94	T84-K88 PolarHBondContact O-N 2.76Å; M85-K88 WeakPolarHBondContact O-CB 3.42Å; M85-K88 PolarHBondContact O-N 2.87Å; K86-K88 PolarHBondContact O-N 3.49Å; K88-F90 VanDerWaalsContact C-N 3.33Å; K88-F90 PolarHBondContact O-N 2.92Å; K88-G91 PolarHBondContact O-N 3.41Å; K88-F92 PolarHBondContact N-O 3.43Å; K88-Y94 HydrophobicContact CD-CD2 4.06Å; K88-Y94 HydrophobicContact CD-CE2 3.56Å; K88-Y94 VanDerWaalsContact CE-CD2 3.47Å; K88-Y94 HydrophobicContact CG-CD2 3.98Å; K88-Y94 HydrophobicContact CG-CE2 3.83Å; K88-Y94 VanDerWaalsContact NZ-CE2 3.31Å
89	Q	67.2	Low	61	Low	149 Å²	149	73.5 Å²	73.5	70%	0.696	37%	0.372	S	S	*	.	H	α-helix	trans	-59.9	-41.1	177.2	-71	171.9	-12.4	0	0	112	M85 K86 L87 G91	M85-Q89 WeakPolarHBondContact O-CG 3.31Å; M85-Q89 PolarHBondContact O-N 3.38Å; K86-Q89 WeakPolarHBondContact O-CB 3.36Å; K86-Q89 PolarHBondContact O-N 3.42Å; K86-Q89 VanDerWaalsContact O-N 3.17Å; L87-Q89 PolarHBondContact O-N 3.23Å; Q89-G91 PolarHBondContact O-N 2.93Å
90	F	65.6	Low	61.6	Low	44 Å²	44	71.4 Å²	71.4	19%	0.193	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-1.9	175.6	-64.2	-55.7	0	0	0	114.7	K86 L87 K88 F92 T304 I306 I314	K86-F90 HydrophobicContact CB-CE2 4.44Å; K86-F90 WeakPolarHBondContact O-CD2 3.45Å; K86-F90 PolarHBondContact O-N 2.77Å; L87-F90 CarbonylContact O-C 3.42Å; L87-F90 PolarHBondContact O-N 3Å; K88-F90 VanDerWaalsContact C-N 3.33Å; K88-F90 PolarHBondContact O-N 2.92Å; F90-F92 HydrophobicContact CB-CD2 3.92Å; F90-F92 HydrophobicContact CB-CE2 4.03Å; F90-T304 HydrophobicContact CB-CG2 3.92Å; F90-T304 HydrophobicContact CD1-CG2 3.66Å; F90-T304 HydrophobicContact CG-CG2 4.19Å; F90-T304 PolarHBondContact O-OG1 2.87Å; F90-I306 HydrophobicContact CD2-CD1 4.04Å; F90-I306 HydrophobicContact CE1-CG1 4.32Å; F90-I306 HydrophobicContact CE2-CD1 3.59Å; F90-I306 HydrophobicContact CE2-CG1 4.04Å; F90-I306 HydrophobicContact CZ-CD1 3.94Å; F90-I306 HydrophobicContact CZ-CG1 3.83Å; F90-I314 HydrophobicContact CD2-CD1 4.2Å; F90-I314 HydrophobicContact CE2-CD1 3.83Å
91	G	64.7	Low	62.1	Low	15 Å²	15	67.2 Å²	67.2	16%	0.155	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.2	3.4	175.2	0	0	0	0	0	116	L87 K88 Q89	L87-G91 PolarHBondContact O-N 3.31Å; L87-G91 VanDerWaalsContact O-N 3.12Å; K88-G91 PolarHBondContact O-N 3.41Å; Q89-G91 PolarHBondContact O-N 2.93Å
92	F	65.5	Low	62.7	Low	19 Å²	19	62.5 Å²	62.5	8%	0.083	32%	0.321	C	S	.	.			trans	-97.3	105	-179	-54.7	-71	0	0	0	110.8	L87 K88 F90 I100 L156 T158	L87-F92 CarbonylContact C-O 3.46Å; L87-F92 VanDerWaalsContact C-O 3.24Å; L87-F92 HydrophobicContact CB-CB 4.27Å; L87-F92 HydrophobicContact CD2-CB 4.26Å; L87-F92 HydrophobicContact CD2-CD2 4.19Å; L87-F92 PolarHBondContact O-N 2.93Å; K88-F92 PolarHBondContact N-O 3.43Å; F90-F92 HydrophobicContact CB-CD2 3.92Å; F90-F92 HydrophobicContact CB-CE2 4.03Å; F92-I100 HydrophobicContact CB-CD1 4.24Å; F92-I100 HydrophobicContact CD1-CD1 3.73Å; F92-I100 HydrophobicContact CD1-CG1 4.42Å; F92-I100 HydrophobicContact CD2-CD1 4Å; F92-I100 HydrophobicContact CE1-CD1 4.03Å; F92-I100 HydrophobicContact CE1-CG1 4.45Å; F92-I100 HydrophobicContact CE1-CG2 4.32Å; F92-I100 HydrophobicContact CE2-CD1 4.28Å; F92-I100 HydrophobicContact CG-CD1 3.72Å; F92-I100 HydrophobicContact CZ-CD1 4.3Å; F92-I100 HydrophobicContact CZ-CG2 4.14Å; F92-L156 HydrophobicContact CE2-CB 4.27Å; F92-L156 HydrophobicContact CE2-CD1 4.4Å; F92-L156 HydrophobicContact CZ-CB 3.98Å; F92-T158 HydrophobicContact CD1-CG2 4.03Å; F92-T158 HydrophobicContact CE1-CG2 3.9Å
93	S	55.2	Low	62.9	Low	83 Å²	83	58.7 Å²	58.7	58%	0.58	31%	0.312	S	S	*	.			trans	-87.8	114.5	-177.5	53.3	0	0	0	0	112.9
94	Y	49.9	Very low	63.3	Low	96 Å²	96	61.7 Å²	61.7	38%	0.376	32%	0.324	S	S	.	.			trans	5.9	107.3	162.8	-75.9	-117.8	0	0	0	117.3	T84 K88	T84-Y94 VanDerWaalsContact CB-CZ 3.42Å; T84-Y94 HydrophobicContact CG2-CD1 3.76Å; T84-Y94 HydrophobicContact CG2-CD2 3.3Å; T84-Y94 HydrophobicContact CG2-CE1 3.79Å; T84-Y94 HydrophobicContact CG2-CE2 3.3Å; T84-Y94 HydrophobicContact CG2-CG 3.54Å; T84-Y94 VanDerWaalsContact O-CE2 3.3Å; T84-Y94 WeakPolarHBondContact O-CE2 3.39Å; K88-Y94 HydrophobicContact CD-CD2 4.06Å; K88-Y94 HydrophobicContact CD-CE2 3.56Å; K88-Y94 VanDerWaalsContact CE-CD2 3.47Å; K88-Y94 HydrophobicContact CG-CD2 3.98Å; K88-Y94 HydrophobicContact CG-CE2 3.83Å; K88-Y94 VanDerWaalsContact NZ-CE2 3.31Å
95	T	48.1	Very low	63.7	Low	99 Å²	99	69.5 Å²	69.5	61%	0.607	35%	0.352	S	S	*	.				-158.1	165.4	113.7	4.1	0	0	0	0	109.8	S97 Y98	T95-S97 PolarHBondContact O-N 2.93Å; T95-Y98 WeakPolarHBondContact OG1-CE2 3.48Å
96	D	45.8	Very low	63.9	Low	74 Å²	74	69 Å²	69	40%	0.396	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	127.4	-167.9	-77	-18.5	0	0	0	113.1	K65 K80	K65-D96 HydrophobicContact CD-CB 4.12Å; K65-D96 VanDerWaalsContact CE-OD2 3.24Å; K65-D96 WeakPolarHBondContact CE-OD2 3.22Å; K65-D96 IonicContact NZ-OD1 3.06Å; K65-D96 IonicContact NZ-OD2 2.7Å; K65-D96 PolarHBondContact NZ-OD2 2.69Å; K80-D96 WeakPolarHBondContact CE-OD1 3.49Å; K80-D96 IonicContact NZ-OD1 2.66Å; K80-D96 PolarHBondContact NZ-OD1 2.75Å; K80-D96 IonicContact NZ-OD2 3.82Å; K80-D96 PolarHBondContact NZ-OD2 3.21Å
97	S	49	Very low	63.7	Low	64 Å²	64	68.6 Å²	68.6	45%	0.448	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	28.3	165	-10	0	0	0	0	119.1	T95	T95-S97 PolarHBondContact O-N 2.93Å
98	Y	57.3	Low	63.6	Low	103 Å²	103	73 Å²	73	40%	0.404	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-79.5	134.9	169.8	-65.8	-69.9	0	0	0	113.4	T95 I100 V160	T95-Y98 WeakPolarHBondContact OG1-CE2 3.48Å; Y98-I100 PolarHBondContact O-N 3.18Å; Y98-V160 HydrophobicContact CD1-CG1 4.1Å; Y98-V160 HydrophobicContact CE1-CG1 4.06Å
99	P	60.9	Low	62.9	Low	52 Å²	52	69.4 Å²	69.4	34%	0.338	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-79.4	117.5	176.4	30.5	-33.3	0	0	0	111.8	F61	F61-P99 HydrophobicContact CB-CB 3.84Å; F61-P99 HydrophobicContact CD1-CB 3.79Å; F61-P99 HydrophobicContact CD1-CG 4.47Å; F61-P99 HydrophobicContact CG-CB 4Å
100	I	70.3	Confident	62.6	Low	12 Å²	12	66 Å²	66	6%	0.062	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	125.2	176.8	-68.2	178.2	0	0	0	109.5	F61 A62 L87 F92 Y98 L156 F315	F61-I100 CarbonylContact C-O 3.53Å; F61-I100 VanDerWaalsContact CA-O 3.3Å; F61-I100 WeakPolarHBondContact CA-O 3.44Å; A62-I100 PolarHBondContact N-O 3.36Å; A62-I100 PolarHBondContact O-N 2.92Å; L87-I100 HydrophobicContact CD2-CD1 4.34Å; F92-I100 HydrophobicContact CB-CD1 4.24Å; F92-I100 HydrophobicContact CD1-CD1 3.73Å; F92-I100 HydrophobicContact CD1-CG1 4.42Å; F92-I100 HydrophobicContact CD2-CD1 4Å; F92-I100 HydrophobicContact CE1-CD1 4.03Å; F92-I100 HydrophobicContact CE1-CG1 4.45Å; F92-I100 HydrophobicContact CE1-CG2 4.32Å; F92-I100 HydrophobicContact CE2-CD1 4.28Å; F92-I100 HydrophobicContact CG-CD1 3.72Å; F92-I100 HydrophobicContact CZ-CD1 4.3Å; F92-I100 HydrophobicContact CZ-CG2 4.14Å; Y98-I100 PolarHBondContact O-N 3.18Å; I100-L156 HydrophobicContact CG2-CB 3.83Å; I100-L156 HydrophobicContact CG2-CD1 4.3Å; I100-L156 HydrophobicContact CG2-CD2 4.25Å; I100-L156 HydrophobicContact CG2-CG 4.35Å; I100-F315 HydrophobicContact CB-CE1 4.13Å; I100-F315 HydrophobicContact CB-CZ 4.35Å; I100-F315 HydrophobicContact CD1-CE1 3.93Å; I100-F315 HydrophobicContact CD1-CZ 3.85Å; I100-F315 HydrophobicContact CG1-CE1 4.41Å; I100-F315 HydrophobicContact CG2-CZ 4.43Å
101	C	69.2	Low	62.2	Low	9 Å²	9	70 Å²	70	6%	0.061	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	136.6	-176.3	-169.2	0	0	0	0	111.4	I60 F61 L156 W157	I60-C101 WeakPolarHBondContact O-CA 3.42Å; F61-C101 HydrophobicContact CD1-CB 3.87Å; F61-C101 HydrophobicContact CE1-CB 3.71Å; C101-L156 WeakPolarHBondContact O-CA 3.3Å; C101-W157 HydrophobicContact CB-CE3 4.04Å; C101-W157 WeakPolarHBondContact CB-O 3.27Å; C101-W157 PolarHBondContact N-O 3.39Å; C101-W157 PolarHBondContact O-N 2.84Å
102	I	75.9	Confident	61.6	Low	34 Å²	34	74.1 Å²	74.1	17%	0.174	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	122.9	167.8	-46.5	-177.4	0	0	0	108.5	I60 L154 L156 F311	I60-I102 HydrophobicContact CB-CB 4.35Å; I60-I102 HydrophobicContact CB-CD1 4.31Å; I60-I102 HydrophobicContact CB-CG1 4.38Å; I60-I102 HydrophobicContact CG2-CD1 3.65Å; I60-I102 HydrophobicContact CG2-CG1 4.1Å; I60-I102 PolarHBondContact O-N 3.44Å; I102-L154 HydrophobicContact CG2-CB 4.37Å; I102-L154 HydrophobicContact CG2-CD2 4.45Å; I102-L156 HydrophobicContact CG1-CD2 4.04Å; I102-F311 HydrophobicContact CD1-CE1 4.46Å; I102-F311 HydrophobicContact CD1-CE2 3.95Å; I102-F311 HydrophobicContact CD1-CZ 3.66Å; I102-F311 HydrophobicContact CG1-CE2 4.36Å; I102-F311 HydrophobicContact CG1-CZ 4.49Å
103	A	70.6	Confident	60.7	Low	53 Å²	53	79.2 Å²	79.2	44%	0.438	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-40.9	-174	0	0	0	0	0	113.8	L155	A103-L155 HydrophobicContact CB-CB 4.48Å; A103-L155 HydrophobicContact CB-CD2 4.32Å; A103-L155 HydrophobicContact CB-CG 4.32Å; A103-L155 PolarHBondContact N-O 2.98Å
104	K	74.1	Confident	60.2	Low	90 Å²	90	80 Å²	80	39%	0.391	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	171.1	-176.1	-63.4	-172.1	177.9	-176.8	0	112	L155 W305	K104-L155 HydrophobicContact CB-CB 3.84Å; K104-L155 HydrophobicContact CB-CD2 3.92Å; K104-L155 HydrophobicContact CD-CD2 3.99Å; K104-L155 HydrophobicContact CG-CD2 3.98Å; K104-L155 PolarHBondContact O-N 3.27Å; K104-W305 HydrophobicContact CB-CH2 3.92Å; K104-W305 HydrophobicContact CB-CZ2 4.42Å
105	R	75.2	Confident	60.2	Low	180 Å²	180	81.1 Å²	81.1	68%	0.679	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.6	155.9	177.6	65.1	178.1	-177.7	-175	-0.6	111.5	I151 S153 L154	R105-I151 HydrophobicContact CB-CG2 4.01Å; R105-S153 CarbonylContact C-O 3.44Å; R105-S153 WeakPolarHBondContact CA-O 3.41Å; R105-L154 HydrophobicContact CB-CD2 3.83Å
106	R	71.4	Confident	60.3	Low	89 Å²	89	84.2 Å²	84.2	34%	0.336	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	158	172	65.6	-173.1	-176	164.7	5.3	113.1	R152 S153 W305	R106-R152 PolarHBondContact O-N 3.13Å; R106-S153 WeakPolarHBondContact CG-OG 3.46Å; R106-S153 PolarHBondContact N-O 3.45Å; R106-S153 PolarHBondContact NE-OG 3.34Å; R106-S153 PolarHBondContact O-N 3.01Å; R106-W305 HydrophobicContact CB-CH2 4.27Å; R106-W305 HydrophobicContact CB-CZ3 4.27Å; R106-W305 HydrophobicContact CG-CE3 4.21Å; R106-W305 HydrophobicContact CG-CH2 4.01Å; R106-W305 HydrophobicContact CG-CZ3 3.67Å
107	T	64.5	Low	60.5	Low	49 Å²	49	88.8 Å²	88.8	30%	0.301	48%	0.479	S	S	.	.	S	Bend	trans	-86.1	-12.9	178.8	61.6	0	0	0	0	113.6	E149 P150 R152	T107-E149 WeakPolarHBondContact CB-OE2 3.46Å; T107-E149 HydrophobicContact CG2-CB 3.94Å; T107-E149 WeakPolarHBondContact CG2-O 3.24Å; T107-E149 PolarHBondContact OG1-OE2 3.47Å; T107-P150 WeakPolarHBondContact CA-O 3.34Å; T107-R152 WeakPolarHBondContact O-CD 3.3Å; T107-R152 WeakPolarHBondContact O-CG 3.45Å; T107-R152 PolarHBondContact O-NE 2.82Å
108	I	65.8	Low	60.6	Low	108 Å²	108	91.3 Å²	91.3	55%	0.554	49%	0.494	S	S	*	.	S	Bend	trans	-84.8	134.3	-178.8	-55.4	177	0	0	0	109.8	S153	I108-S153 PolarHBondContact O-OG 3Å
109	P	54.4	Low	60.5	Low	36 Å²	36	90.8 Å²	90.8	23%	0.234	50%	0.501	C	S	.	.			trans	-74.2	164.8	177.7	30.3	-31.8	0	0	0	112.4	I111 R152	P109-I111 HydrophobicContact CB-CG1 4.46Å; P109-I111 HydrophobicContact CG-CD1 3.88Å; P109-I111 HydrophobicContact CG-CG1 3.99Å; P109-I111 PolarHBondContact O-N 3.44Å; P109-R152 HydrophobicContact CB-CB 4.48Å
110	I	60.3	Low	59.8	Low	78 Å²	78	91.4 Å²	91.4	40%	0.4	51%	0.505	S	S	.	.			trans	-81.5	82.9	175	-51.6	178.2	0	0	0	109.3	W305	I110-W305 HydrophobicContact CD1-CB 4.21Å
111	I	58.4	Low	59.2	Low	127 Å²	127	98.8 Å²	98.8	65%	0.651	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-95.5	124.5	170.5	-58.3	172.2	0	0	0	107.8	P109	P109-I111 HydrophobicContact CB-CG1 4.46Å; P109-I111 HydrophobicContact CG-CD1 3.88Å; P109-I111 HydrophobicContact CG-CG1 3.99Å; P109-I111 PolarHBondContact O-N 3.44Å
112	P	51.1	Low	58.6	Low	102 Å²	102	107.2 Å²	107.2	66%	0.662	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-64.3	139.9	170.9	28.1	-33.5	0	0	0	109.3	S114	P112-S114 PolarHBondContact O-N 2.9Å
113	P	46.8	Very low	57.6	Low	126 Å²	126	112.1 Å²	112.1	82%	0.818	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-58.9	128.1	-177.7	25.2	-33.9	0	0	0	110.1
114	S	45	Very low	56.9	Low	99 Å²	99	116 Å²	116	69%	0.692	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-55.6	139.5	175.6	-50.3	0	0	0	0	109.8	P112 I116	P112-S114 PolarHBondContact O-N 2.9Å; S114-I116 PolarHBondContact O-N 3.46Å
115	P	51.1	Low	55.4	Low	120 Å²	120	117.8 Å²	117.8	78%	0.779	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-56.1	131.9	178.9	23.7	-33.6	0	0	0	109.5	Q117	P115-Q117 PolarHBondContact O-N 2.94Å
116	I	49.3	Very low	54	Low	163 Å²	163	120.6 Å²	120.6	84%	0.836	63%	0.626	S	S	*	*			trans	-64.7	102.9	-171.6	-58.2	172.9	0	0	0	108.6	S114	S114-I116 PolarHBondContact O-N 3.46Å
117	Q	49.2	Very low	52.3	Low	170 Å²	170	121.4 Å²	121.4	79%	0.794	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-63.9	126.9	165.7	-70.9	-169.7	-9.2	0	0	108	P115 T119	P115-Q117 PolarHBondContact O-N 2.94Å; Q117-T119 PolarHBondContact O-N 3.08Å; Q117-T119 VanDerWaalsContact O-N 3.11Å
118	P	51.7	Low	51.4	Low	118 Å²	118	131 Å²	131	77%	0.766	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-62.6	118.1	-177.7	24.9	-33.2	0	0	0	109.5	P120	P118-P120 WeakPolarHBondContact O-CD 3.28Å; P118-P120 VanDerWaalsContact O-N 3.17Å
119	T	55.8	Low	50	Low	91 Å²	91	131.2 Å²	131.2	56%	0.558	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-62.8	116.8	178.5	46.3	0	0	0	0	109.5	Q117 Q121	Q117-T119 PolarHBondContact O-N 3.08Å; Q117-T119 VanDerWaalsContact O-N 3.11Å; T119-Q121 PolarHBondContact O-N 2.74Å
120	P	45.8	Very low	49.3	Very low	65 Å²	65	135 Å²	135	42%	0.422	71%	0.707	S	S	.	*	P	Polyproline II helix	trans	-64.6	140.1	-177.6	27.4	-35.2	0	0	0	110	P118 W122 K123	P118-P120 WeakPolarHBondContact O-CD 3.28Å; P118-P120 VanDerWaalsContact O-N 3.17Å; P120-W122 HydrophobicContact CG-CZ2 4.44Å; P120-W122 PolarHBondContact O-N 3.01Å; P120-K123 PolarHBondContact O-N 3.16Å
121	Q	57.4	Low	47.8	Very low	168 Å²	168	139.1 Å²	139.1	79%	0.785	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-55.1	-27.6	-163.9	-71.3	175.7	-35.3	0	0	114.7	T119 K123 L124	T119-Q121 PolarHBondContact O-N 2.74Å; Q121-K123 PolarHBondContact O-N 2.8Å; Q121-L124 WeakPolarHBondContact O-CB 3.47Å; Q121-L124 PolarHBondContact O-N 2.79Å
122	W	57.7	Low	46.8	Very low	185 Å²	185	143 Å²	143	70%	0.701	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-62.9	-18.8	176	65.5	-98.2	0	0	0	114.3	P120	P120-W122 HydrophobicContact CG-CZ2 4.44Å; P120-W122 PolarHBondContact O-N 3.01Å
123	K	54.8	Low	46.2	Very low	138 Å²	138	142.7 Å²	142.7	60%	0.6	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-82.7	-9.9	171.3	-78.1	-171.7	174.1	178.2	0	114.3	P120 Q121	P120-K123 PolarHBondContact O-N 3.16Å; Q121-K123 PolarHBondContact O-N 2.8Å
124	L	54.2	Low	45.4	Very low	133 Å²	133	145.7 Å²	145.7	70%	0.696	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-88.7	-2.3	176.2	-68.2	169.2	0	0	0	113.2	Q121	Q121-L124 WeakPolarHBondContact O-CB 3.47Å; Q121-L124 PolarHBondContact O-N 2.79Å
125	I	43.4	Very low	44.9	Very low	129 Å²	129	147.9 Å²	147.9	66%	0.662	75%	0.745	S	S	*	*			trans	-122.6	121.4	176.8	-54.7	177.1	0	0	0	109
126	R	45.1	Very low	43.9	Very low	238 Å²	238	147.5 Å²	147.5	90%	0.898	75%	0.745	S	S	*	*			trans	-135.2	116.6	157.3	-92.2	-163.8	-79.9	-163.3	-2.8	110
127	P	36.6	Very low	42.9	Very low	107 Å²	107	144.5 Å²	144.5	70%	0.695	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-68.8	161	164.6	32	-34.3	0	0	0	110
128	R	45.1	Very low	42.1	Very low	251 Å²	251	143.8 Å²	143.8	95%	0.947	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-102.9	116.5	165.1	-67.5	-175.8	-175.6	174.6	0.9	109.5
129	P	36.6	Very low	41	Very low	111 Å²	111	146.7 Å²	146.7	72%	0.721	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-93.8	162.5	156.6	0.9	20.1	0	0	0	110.6
130	P	39.4	Very low	39.8	Very low	116 Å²	116	146.5 Å²	146.5	75%	0.753	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-103.2	131.6	-176	36.1	-27.9	0	0	0	113.1
131	D	30.2	Very low	39	Very low	165 Å²	165	150.7 Å²	150.7	88%	0.882	77%	0.77	S	S	*	*			trans	-172.3	116.4	148.8	-95.4	-31.9	0	0	0	109.9
132	F	36.2	Very low	37.7	Very low	207 Å²	207	149.4 Å²	149.4	91%	0.908	77%	0.768	S	S	*	*			trans	-176.4	129.4	176.3	-131.1	-93.7	0	0	0	105.6
133	P	39.1	Very low	36.5	Very low	97 Å²	97	148.9 Å²	148.9	63%	0.63	77%	0.773	S	S	*	*			cis	-111.6	-167.1	28	11.5	15.3	0	0	0	112
134	F	29.7	Very low	35.3	Very low	189 Å²	189	146 Å²	146	83%	0.829	77%	0.771	S	S	*	*			cis	-148.3	175.5	31.3	-107.1	-74.7	0	0	0	113.7
135	D	35.4	Very low	34.3	Very low	145 Å²	145	146.9 Å²	146.9	78%	0.775	78%	0.776	S	S	*	*			trans	-67.4	155.6	-172.6	-54.9	-81.8	0	0	0	116.9
136	S	30.1	Very low	34	Very low	111 Å²	111	150.2 Å²	150.2	78%	0.776	79%	0.785	S	S	*	*			trans	-149.6	117.7	139.5	47.7	0	0	0	0	112.5
137	S	28.3	Very low	33.5	Very low	101 Å²	101	147.4 Å²	147.4	71%	0.706	78%	0.782	S	S	*	*			trans	26.5	115.4	151.3	59.6	0	0	0	0	120.3
138	N	30.7	Very low	34.1	Very low	155 Å²	155	151 Å²	151	83%	0.829	79%	0.787	S	S	*	*			trans	-162.3	64.8	130.2	-105.9	-33.2	0	0	0	112.2	S140	N138-S140 PolarHBondContact O-N 2.86Å
139	D	28.5	Very low	34.4	Very low	178 Å²	178	145 Å²	145	95%	0.952	77%	0.77	S	S	*	*			trans	-64.9	97.4	167.2	-78.3	-44.4	0	0	0	110
140	S	31.5	Very low	35.3	Very low	88 Å²	88	144 Å²	144	62%	0.615	76%	0.763	S	S	*	*			trans	-125.1	99	170.4	48.1	0	0	0	0	108.2	N138 L142	N138-S140 PolarHBondContact O-N 2.86Å; S140-L142 PolarHBondContact O-N 2.77Å
141	D	28.6	Very low	36.5	Very low	153 Å²	153	141.3 Å²	141.3	82%	0.818	74%	0.742	S	S	*	*			trans	-73.2	65.8	-168	-140.1	-17	0	0	0	111.9	H143	D141-H143 PolarHBondContact O-N 3.04Å; D141-H143 VanDerWaalsContact O-N 3.13Å; D141-H143 IonicContact OD1-CD2 2.72Å
142	L	30	Very low	38.3	Very low	141 Å²	141	138.6 Å²	138.6	74%	0.738	72%	0.72	S	S	*	*			trans	-90.6	54.3	-176.5	-120.8	168.4	0	0	0	111	S140 S144	S140-L142 PolarHBondContact O-N 2.77Å; L142-S144 PolarHBondContact O-N 2.83Å; L142-S144 PolarHBondContact O-OG 3.21Å
143	H	32.5	Very low	40.2	Very low	174 Å²	174	128.8 Å²	128.8	81%	0.806	68%	0.676	S	S	*	*			trans	-67.8	61	167.5	-103.6	-57	0	0	0	111.4	D141	D141-H143 PolarHBondContact O-N 3.04Å; D141-H143 VanDerWaalsContact O-N 3.13Å; D141-H143 IonicContact OD1-CD2 2.72Å
144	S	30.9	Very low	42.1	Very low	78 Å²	78	125 Å²	125	55%	0.545	65%	0.651	S	S	.	*			trans	-64.8	152.7	168.8	53.7	0	0	0	0	110.8	L142 K146	L142-S144 PolarHBondContact O-N 2.83Å; L142-S144 PolarHBondContact O-OG 3.21Å; S144-K146 PolarHBondContact O-N 3.27Å
145	N	32	Very low	44.5	Very low	150 Å²	150	116.2 Å²	116.2	80%	0.802	61%	0.613	S	S	*	*			trans	-67.4	96.6	-175.7	-61.3	-60.5	0	0	0	111	E147	N145-E147 VanDerWaalsContact C-N 3.27Å; N145-E147 PolarHBondContact O-N 3.38Å
146	K	37.5	Very low	46.5	Very low	199 Å²	199	109.5 Å²	109.5	87%	0.865	58%	0.576	S	S	*	*			trans	-68.7	91.2	159.8	-75.7	-169.8	177.3	-178.8	0	108.6	S144 K148	S144-K146 PolarHBondContact O-N 3.27Å; K146-K148 PolarHBondContact O-N 2.86Å
147	E	34.5	Very low	48.5	Very low	179 Å²	179	106 Å²	106	84%	0.836	55%	0.546	S	S	*	.			trans	-50.8	137.4	163.9	-65.6	-165.6	128	0	0	109.2	N145 E149	N145-E147 VanDerWaalsContact C-N 3.27Å; N145-E147 PolarHBondContact O-N 3.38Å; E147-E149 PolarHBondContact O-N 3.35Å
148	K	49.1	Very low	50.3	Low	183 Å²	183	101.6 Å²	101.6	80%	0.796	52%	0.515	S	S	*	.			trans	-70.5	120	179	-69.2	-177.1	178	179.9	0	108.1	K146	K146-K148 PolarHBondContact O-N 2.86Å
149	E	52.1	Low	51.4	Low	125 Å²	125	96 Å²	96	58%	0.584	49%	0.487	S	S	*	.			trans	-46	136.7	-179.1	-61.3	-179.3	156.4	0	0	111.5	T107 E147	T107-E149 WeakPolarHBondContact CB-OE2 3.46Å; T107-E149 HydrophobicContact CG2-CB 3.94Å; T107-E149 WeakPolarHBondContact CG2-O 3.24Å; T107-E149 PolarHBondContact OG1-OE2 3.47Å; E147-E149 PolarHBondContact O-N 3.35Å
150	P	55.7	Low	52.6	Low	90 Å²	90	89.7 Å²	89.7	58%	0.584	46%	0.455	S	S	*	.			trans	-61.6	146.4	-180	25.2	-33.8	0	0	0	111	T107 R152	T107-P150 WeakPolarHBondContact CA-O 3.34Å; P150-R152 PolarHBondContact O-N 3.35Å
151	I	62.8	Low	53.5	Low	59 Å²	59	88 Å²	88	30%	0.303	44%	0.437	S	S	.	.			trans	-62.6	129.3	170.2	-59.6	160.2	0	0	0	107.5	R105 L154 I308	R105-I151 HydrophobicContact CB-CG2 4.01Å; I151-L154 HydrophobicContact CG2-CD2 4.02Å; I151-I308 HydrophobicContact CB-CD1 4.33Å; I151-I308 HydrophobicContact CG2-CD1 4.21Å
152	R	68.1	Low	54.2	Low	109 Å²	109	86.3 Å²	86.3	41%	0.411	43%	0.425	S	S	.	.			trans	-114.3	-26.5	-179.3	-63.3	-170	-160.6	-152.3	3	113.9	R106 T107 P109 P150 D307 I308	R106-R152 PolarHBondContact O-N 3.13Å; T107-R152 WeakPolarHBondContact O-CD 3.3Å; T107-R152 WeakPolarHBondContact O-CG 3.45Å; T107-R152 PolarHBondContact O-NE 2.82Å; P109-R152 HydrophobicContact CB-CB 4.48Å; P150-R152 PolarHBondContact O-N 3.35Å; R152-D307 CarbonylContact O-C 3.58Å; R152-D307 WeakPolarHBondContact O-CA 3.21Å; R152-D307 VanDerWaalsContact O-CG 3.27Å; R152-I308 PolarHBondContact O-N 3.06Å
153	S	76.1	Confident	54.9	Low	0 Å²	0	87.4 Å²	87.4	0%	0	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	151.4	175.7	46.2	0	0	0	0	113.6	R105 R106 I108 I306	R105-S153 CarbonylContact C-O 3.44Å; R105-S153 WeakPolarHBondContact CA-O 3.41Å; R106-S153 WeakPolarHBondContact CG-OG 3.46Å; R106-S153 PolarHBondContact N-O 3.45Å; R106-S153 PolarHBondContact NE-OG 3.34Å; R106-S153 PolarHBondContact O-N 3.01Å; I108-S153 PolarHBondContact O-OG 3Å; S153-I306 CarbonylContact C-O 3.59Å; S153-I306 WeakPolarHBondContact CA-O 3.5Å; S153-I306 WeakPolarHBondContact CB-O 3.38Å
154	L	79.4	Confident	55.4	Low	18 Å²	18	84 Å²	84	9%	0.094	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	148.3	-175.9	-60.6	175.8	0	0	0	109.6	I102 R105 I151 W305 I306 I308 F311	I102-L154 HydrophobicContact CG2-CB 4.37Å; I102-L154 HydrophobicContact CG2-CD2 4.45Å; R105-L154 HydrophobicContact CB-CD2 3.83Å; I151-L154 HydrophobicContact CG2-CD2 4.02Å; L154-W305 CarbonylContact O-C 3.59Å; L154-W305 WeakPolarHBondContact O-CA 3.38Å; L154-I306 HydrophobicContact CB-CG2 4.12Å; L154-I306 PolarHBondContact N-O 2.9Å; L154-I306 PolarHBondContact O-N 3.04Å; L154-I308 HydrophobicContact CD1-CG1 4.37Å; L154-F311 HydrophobicContact CD1-CB 4.26Å; L154-F311 HydrophobicContact CD1-CD1 3.81Å; L154-F311 HydrophobicContact CD1-CD2 4.08Å; L154-F311 HydrophobicContact CD1-CE1 4.2Å; L154-F311 HydrophobicContact CD1-CE2 4.45Å; L154-F311 HydrophobicContact CD1-CG 3.76Å
155	L	80.3	Confident	55.4	Low	5 Å²	5	87.8 Å²	87.8	3%	0.026	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	119.4	175.8	-173.4	59.6	0	0	0	109.4	A103 K104 E303 W305	A103-L155 HydrophobicContact CB-CB 4.48Å; A103-L155 HydrophobicContact CB-CD2 4.32Å; A103-L155 HydrophobicContact CB-CG 4.32Å; A103-L155 PolarHBondContact N-O 2.98Å; K104-L155 HydrophobicContact CB-CB 3.84Å; K104-L155 HydrophobicContact CB-CD2 3.92Å; K104-L155 HydrophobicContact CD-CD2 3.99Å; K104-L155 HydrophobicContact CG-CD2 3.98Å; K104-L155 PolarHBondContact O-N 3.27Å; L155-E303 HydrophobicContact CD1-CB 3.88Å; L155-E303 HydrophobicContact CD2-CB 4.39Å; L155-E303 HydrophobicContact CG-CB 4.27Å; L155-W305 HydrophobicContact CB-CD2 4.08Å; L155-W305 HydrophobicContact CB-CE3 4.02Å; L155-W305 HydrophobicContact CB-CH2 4.02Å; L155-W305 HydrophobicContact CB-CZ2 4.08Å; L155-W305 HydrophobicContact CB-CZ3 3.99Å; L155-W305 HydrophobicContact CD1-CD2 3.93Å; L155-W305 HydrophobicContact CD1-CG 3.89Å; L155-W305 HydrophobicContact CD1-CZ2 4.45Å; L155-W305 HydrophobicContact CD2-CZ2 4.16Å; L155-W305 HydrophobicContact CG-CZ2 4.48Å
156	L	77.2	Confident	55.4	Low	3 Å²	3	91 Å²	91	2%	0.016	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	146.1	-179.9	-60.1	-175.3	0	0	0	111.4	F92 I100 C101 I102 E303 T304 I306 F311 F315	F92-L156 HydrophobicContact CE2-CB 4.27Å; F92-L156 HydrophobicContact CE2-CD1 4.4Å; F92-L156 HydrophobicContact CZ-CB 3.98Å; I100-L156 HydrophobicContact CG2-CB 3.83Å; I100-L156 HydrophobicContact CG2-CD1 4.3Å; I100-L156 HydrophobicContact CG2-CD2 4.25Å; I100-L156 HydrophobicContact CG2-CG 4.35Å; C101-L156 WeakPolarHBondContact O-CA 3.3Å; I102-L156 HydrophobicContact CG1-CD2 4.04Å; L156-E303 CarbonylContact O-C 3.17Å; L156-E303 WeakPolarHBondContact O-CA 3.26Å; L156-T304 PolarHBondContact N-O 2.79Å; L156-T304 PolarHBondContact O-N 3.41Å; L156-I306 HydrophobicContact CD1-CB 4.36Å; L156-I306 HydrophobicContact CD1-CD1 4.29Å; L156-I306 HydrophobicContact CD1-CG2 3.78Å; L156-I306 HydrophobicContact CD2-CG2 4.49Å; L156-I306 HydrophobicContact CG-CG2 3.85Å; L156-F311 HydrophobicContact CD1-CD2 4.35Å; L156-F311 HydrophobicContact CD2-CD2 4.01Å; L156-F311 HydrophobicContact CD2-CE2 3.9Å; L156-F315 HydrophobicContact CD1-CE2 3.6Å; L156-F315 HydrophobicContact CD1-CZ 3.91Å
157	W	72.2	Confident	55	Low	37 Å²	37	90.5 Å²	90.5	14%	0.14	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	153.1	-179.5	175.4	72.4	0	0	0	111.5	M1 C101 P159 P301 E303	M1-W157 HydrophobicContact CE-CH2 3.44Å; M1-W157 VanDerWaalsContact CE-CH2 3.44Å; M1-W157 HydrophobicContact CE-CZ2 4.32Å; M1-W157 HydrophobicContact CE-CZ3 4.12Å; M1-W157 HydrophobicContact SD-CH2 3.58Å; M1-W157 VanDerWaalsContact SD-CH2 3.58Å; M1-W157 HydrophobicContact SD-CZ3 3.66Å; C101-W157 HydrophobicContact CB-CE3 4.04Å; C101-W157 WeakPolarHBondContact CB-O 3.27Å; C101-W157 PolarHBondContact N-O 3.39Å; C101-W157 PolarHBondContact O-N 2.84Å; W157-P159 VanDerWaalsContact CH2-CA 3.49Å; W157-P159 HydrophobicContact CH2-CB 3.52Å; W157-P159 HydrophobicContact CH2-CG 3.5Å; W157-P159 HydrophobicContact CZ2-CB 4.14Å; W157-P159 HydrophobicContact CZ2-CG 4.42Å; W157-P159 HydrophobicContact CZ3-CB 4.17Å; W157-P159 HydrophobicContact CZ3-CG 3.61Å; W157-P301 VanDerWaalsContact CD1-O 3.24Å; W157-P301 HydrophobicContact CZ2-CG 4.44Å; W157-P301 PolarHBondContact NE1-O 3.41Å; W157-E303 HydrophobicContact CG-CG 4.48Å
158	T	65.4	Low	54.9	Low	10 Å²	10	87.7 Å²	87.7	6%	0.061	42%	0.419	C	S	.	.			trans	-133.7	135.2	174.1	-175.9	0	0	0	0	112.8	F92 V160 Q161	F92-T158 HydrophobicContact CD1-CG2 4.03Å; F92-T158 HydrophobicContact CE1-CG2 3.9Å; T158-V160 PolarHBondContact OG1-N 2.79Å; T158-Q161 HydrophobicContact CG2-CB 4.26Å
159	P	54.5	Low	53.9	Low	36 Å²	36	87.9 Å²	87.9	23%	0.234	42%	0.423	C	S	.	.	S	Bend	trans	-72.7	-26.8	169.5	-1.8	12.7	0	0	0	113.5	M1 W157 Q161 E162	M1-P159 HydrophobicContact SD-CG 4.43Å; W157-P159 VanDerWaalsContact CH2-CA 3.49Å; W157-P159 HydrophobicContact CH2-CB 3.52Å; W157-P159 HydrophobicContact CH2-CG 3.5Å; W157-P159 HydrophobicContact CZ2-CB 4.14Å; W157-P159 HydrophobicContact CZ2-CG 4.42Å; W157-P159 HydrophobicContact CZ3-CB 4.17Å; W157-P159 HydrophobicContact CZ3-CG 3.61Å; P159-Q161 PolarHBondContact O-N 2.86Å; P159-E162 PolarHBondContact O-N 3.31Å
160	V	53.8	Low	53	Low	46 Å²	46	91.7 Å²	91.7	28%	0.279	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-71.4	-21.6	-157.9	-170.6	0	0	0	0	112.4	Y98 T158 E162 H163 I164	Y98-V160 HydrophobicContact CD1-CG1 4.1Å; Y98-V160 HydrophobicContact CE1-CG1 4.06Å; T158-V160 PolarHBondContact OG1-N 2.79Å; V160-E162 PolarHBondContact O-N 2.86Å; V160-H163 PolarHBondContact O-N 2.75Å; V160-H163 VanDerWaalsContact O-N 3.12Å; V160-I164 HydrophobicContact CG1-CD1 3.99Å
161	Q	50.8	Low	51.6	Low	52 Å²	52	93.1 Å²	93.1	24%	0.243	45%	0.445	C	S	.	.	G	3₁₀ helix	trans	-69.2	-16.9	-178	-146.4	156.2	13.4	0	0	113.3	T158 P159 H163 F165	T158-Q161 HydrophobicContact CG2-CB 4.26Å; P159-Q161 PolarHBondContact O-N 2.86Å; Q161-H163 VanDerWaalsContact C-N 3.27Å; Q161-H163 PolarHBondContact O-N 2.99Å; Q161-F165 HydrophobicContact CG-CE2 4.17Å
162	E	43.8	Very low	50.1	Low	118 Å²	118	98.3 Å²	98.3	55%	0.551	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-74.6	-12.7	173.1	-64.8	-177.7	169.3	0	0	113.3	P159 V160	P159-E162 PolarHBondContact O-N 3.31Å; V160-E162 PolarHBondContact O-N 2.86Å
163	H	44.8	Very low	48.3	Very low	165 Å²	165	99.9 Å²	99.9	76%	0.764	49%	0.487	S	S	*	.	S	Bend	trans	-113.4	-3.2	-175.8	-87.7	-73.6	0	0	0	115.6	V160 Q161	V160-H163 PolarHBondContact O-N 2.75Å; V160-H163 VanDerWaalsContact O-N 3.12Å; Q161-H163 VanDerWaalsContact C-N 3.27Å; Q161-H163 PolarHBondContact O-N 2.99Å
164	I	41.6	Very low	46	Very low	101 Å²	101	105 Å²	105	52%	0.518	52%	0.523	S	S	.	.	S	Bend	trans	-98	-7	-176.9	-68.2	175.5	0	0	0	112.6	V160	V160-I164 HydrophobicContact CG1-CD1 3.99Å
165	F	32.6	Very low	44.2	Very low	159 Å²	159	109.7 Å²	109.7	70%	0.697	56%	0.555	S	S	*	*	S	Bend	trans	-104.8	47.9	177.7	-68.4	-74.1	0	0	0	113.3	Q161	Q161-F165 HydrophobicContact CG-CE2 4.17Å
166	Y	30.5	Very low	41.9	Very low	218 Å²	218	115.5 Å²	115.5	86%	0.855	59%	0.592	S	S	*	*			trans	-138.4	76	170.5	-97.8	-78	0	0	0	111.2
167	E	29.8	Very low	39.6	Very low	188 Å²	188	121.8 Å²	121.8	88%	0.879	63%	0.631	S	S	*	*			trans	-128.6	155.1	154.3	-91.7	-156.7	137.6	0	0	109.4
168	P	31.3	Very low	37.6	Very low	119 Å²	119	124.6 Å²	124.6	77%	0.773	66%	0.656	S	S	*	*			trans	-81.5	155.7	-151.5	30.8	-36.8	0	0	0	114.9	K170	P168-K170 PolarHBondContact O-N 2.82Å
169	E	28.8	Very low	36	Very low	187 Å²	187	129.8 Å²	129.8	87%	0.874	69%	0.688	S	S	*	*			trans	-56.3	133.9	168.5	-59.4	178.9	126.4	0	0	111.7
170	K	34	Very low	35	Very low	206 Å²	206	133.7 Å²	133.7	90%	0.896	71%	0.711	S	S	*	*				-161.2	140.6	126.6	-110.3	153.9	-169.1	174.1	0	115.3	P168	P168-K170 PolarHBondContact O-N 2.82Å
171	V	26.2	Very low	34	Very low	119 Å²	119	139.9 Å²	139.9	72%	0.721	74%	0.737	S	S	*	*			trans	-58.6	138.6	168.1	174.8	0	0	0	0	111.3	L173	V171-L173 HydrophobicContact CG1-CD1 4Å
172	I	30.7	Very low	33.2	Very low	169 Å²	169	141.6 Å²	141.6	87%	0.867	76%	0.755	S	S	*	*			trans	-153.4	144.4	138.2	-99.7	150.2	0	0	0	107.6
173	L	30.9	Very low	32.5	Very low	142 Å²	142	141.8 Å²	141.8	74%	0.743	76%	0.764	S	S	*	*			trans	-101.7	128.7	-172.9	-78.9	110.2	0	0	0	113.1	V171	V171-L173 HydrophobicContact CG1-CD1 4Å
174	S	28.4	Very low	31.8	Very low	108 Å²	108	144 Å²	144	76%	0.755	77%	0.767	S	S	*	*			trans	55.3	153.5	145.4	48.4	0	0	0	0	121.9
175	P	41.3	Very low	31.3	Very low	116 Å²	116	145.3 Å²	145.3	75%	0.753	78%	0.78	S	S	*	*			trans	-103.4	177.8	-174.3	42.1	-36.7	0	0	0	113.9
176	P	30.5	Very low	31	Very low	126 Å²	126	142.7 Å²	142.7	82%	0.818	78%	0.781	S	S	*	*			trans	-118.9	150.9	154.4	36.9	-26.4	0	0	0	113.5
177	T	29.8	Very low	30.8	Very low	135 Å²	135	137.4 Å²	137.4	83%	0.828	78%	0.776	S	S	*	*			trans	-105.1	164.8	172.5	-48.9	0	0	0	0	109.8
178	S	30.9	Very low	30.7	Very low	96 Å²	96	133.9 Å²	133.9	67%	0.671	77%	0.772	S	S	*	*			trans	-62.1	161.7	167.7	64.3	0	0	0	0	111.6
179	T	31.5	Very low	30.7	Very low	120 Å²	120	133.6 Å²	133.6	74%	0.736	77%	0.773	S	S	*	*			cis	-160	152.1	29.6	-28.4	0	0	0	0	111.5
180	V	33.1	Very low	31.3	Very low	117 Å²	117	129.7 Å²	129.7	71%	0.709	76%	0.763	S	S	*	*			trans	8	135.6	146.2	175.3	0	0	0	0	117.7
181	E	33.1	Very low	30.9	Very low	176 Å²	176	126.3 Å²	126.3	82%	0.822	76%	0.755	S	S	*	*			cis	-172.6	179.1	-11.7	-114.8	166.8	-165.6	0	0	106.6
182	S	32.8	Very low	31	Very low	89 Å²	89	127 Å²	127	62%	0.622	76%	0.76	S	S	*	*			cis	-161.9	160.9	24.2	80.5	0	0	0	0	112.5
183	V	30.2	Very low	31	Very low	122 Å²	122	122 Å²	122	74%	0.739	75%	0.75	S	S	*	*			trans	71.8	128.3	144.1	172	0	0	0	0	119.1
184	Y	29.4	Very low	31.1	Very low	210 Å²	210	124.8 Å²	124.8	82%	0.824	76%	0.757	S	S	*	*			cis	-164.5	179	-7	-134.3	-108.1	0	0	0	111.5
185	V	31.2	Very low	31.4	Very low	130 Å²	130	126.7 Å²	126.7	79%	0.788	75%	0.753	S	S	*	*			trans	79.4	108.1	166.3	-160	0	0	0	0	120.1
186	S	26.3	Very low	30.9	Very low	104 Å²	104	127 Å²	127	73%	0.727	75%	0.749	S	S	*	*			trans	-45.4	158.3	162.3	-37.8	0	0	0	0	118.2
187	S	25.9	Very low	31	Very low	107 Å²	107	126.8 Å²	126.8	75%	0.748	75%	0.75	S	S	*	*				168.5	159.5	101.1	51	0	0	0	0	116.6
188	S	27.8	Very low	31.1	Very low	113 Å²	113	123.5 Å²	123.5	79%	0.79	74%	0.743	S	S	*	*			trans	66.9	128.1	150.8	55.8	0	0	0	0	123.2
189	S	32.9	Very low	31.2	Very low	113 Å²	113	126.4 Å²	126.4	79%	0.79	75%	0.75	S	S	*	*			trans	-75.2	-172.9	150.2	-134.7	0	0	0	0	109.7
190	P	40.3	Very low	31	Very low	105 Å²	105	128.4 Å²	128.4	68%	0.682	75%	0.752	S	S	*	*			cis	-142.7	-166.4	10.1	30.5	-3.5	0	0	0	115.9
191	D	25.4	Very low	30.8	Very low	135 Å²	135	131 Å²	131	72%	0.722	75%	0.754	S	S	*	*				115.8	140.8	118	-129.1	-24.1	0	0	0	121.4
192	T	29.7	Very low	30.8	Very low	133 Å²	133	128.6 Å²	128.6	82%	0.816	75%	0.751	S	S	*	*			trans	61	145.7	169.1	72.3	0	0	0	0	118.3
193	G	29.7	Very low	30.7	Very low	65 Å²	65	134.8 Å²	134.8	67%	0.67	76%	0.761	S	S	*	*			cis	166.8	169.3	-9.1	0	0	0	0	0	112.8
194	K	33.9	Very low	30.6	Very low	201 Å²	201	133.3 Å²	133.3	87%	0.874	76%	0.756	S	S	*	*			trans	69.6	147.9	173.7	-66.9	176.3	-179.5	173.6	0	117.6
195	Q	33.8	Very low	30.6	Very low	148 Å²	148	130.5 Å²	130.5	69%	0.692	76%	0.755	S	S	*	*			cis	-170.1	165.1	-32.8	-127.3	179.2	9.2	0	0	110.3
196	N	31.6	Very low	30.5	Very low	123 Å²	123	128.4 Å²	128.4	66%	0.658	75%	0.747	S	S	*	*			trans	63.2	105.7	152.2	-57.6	-13.5	0	0	0	117.8
197	S	31.2	Very low	30.6	Very low	120 Å²	120	131.9 Å²	131.9	84%	0.839	75%	0.751	S	S	*	*				87.8	134.2	78.4	73.4	0	0	0	0	114.4
198	G	32.3	Very low	30.8	Very low	66 Å²	66	133.8 Å²	133.8	68%	0.68	76%	0.759	S	S	*	*			cis	162.1	-170	-2.9	0	0	0	0	0	112
199	I	32.4	Very low	30.7	Very low	158 Å²	158	133.7 Å²	133.7	81%	0.81	76%	0.758	S	S	*	*			trans	70	109.1	159.6	-61.1	171.3	0	0	0	115
200	M	27	Very low	31	Very low	161 Å²	161	133.5 Å²	133.5	79%	0.793	75%	0.754	S	S	*	*				58.8	146.3	77.8	-74.1	-161.7	-179.6	0	0	114.8
201	K	30.3	Very low	30.4	Very low	172 Å²	172	134.4 Å²	134.4	75%	0.748	76%	0.758	S	S	*	*			cis	-133.8	-177.1	4.5	-84.8	109.6	-178.9	-178.8	0	108
202	T	33.4	Very low	30.6	Very low	125 Å²	125	137 Å²	137	77%	0.767	76%	0.758	S	S	*	*			cis	-152.9	149.7	2.3	7.4	0	0	0	0	105.4
203	R	29.1	Very low	30.7	Very low	220 Å²	220	140.1 Å²	140.1	83%	0.83	76%	0.755	S	S	*	*			cis	93	103	36.2	-160.1	-140.7	-173.5	174	3.3	114.6
204	S	28.4	Very low	30.8	Very low	90 Å²	90	146.3 Å²	146.3	63%	0.629	76%	0.757	S	S	*	*			trans	64.9	165.9	145.4	72.5	0	0	0	0	118.7
205	N	30.1	Very low	30.6	Very low	151 Å²	151	147 Å²	147	81%	0.807	76%	0.755	S	S	*	*			cis	-150.5	-173.9	2.8	-144	20.7	0	0	0	112.4
206	S	28.6	Very low	30.4	Very low	87 Å²	87	146.3 Å²	146.3	61%	0.608	75%	0.751	S	S	*	*			trans	-98.8	173.9	176.3	58	0	0	0	0	114.4
207	Q	28.8	Very low	30.2	Very low	176 Å²	176	145.3 Å²	145.3	82%	0.822	75%	0.754	S	S	*	*			trans	72.8	110.7	168.1	-57.2	-172.7	-3.6	0	0	119.2
208	T	30.7	Very low	30.2	Very low	148 Å²	148	144.8 Å²	144.8	91%	0.908	75%	0.751	S	S	*	*				-170.6	156.4	104.7	20.7	0	0	0	0	111.9
209	S	25.9	Very low	30	Very low	111 Å²	111	146.2 Å²	146.2	78%	0.776	75%	0.75	S	S	*	*			trans	-93.4	-176.5	173.7	-48.3	0	0	0	0	109.8
210	P	37.5	Very low	29.8	Very low	108 Å²	108	145.3 Å²	145.3	70%	0.701	75%	0.747	S	S	*	*			cis	-144.7	-175.8	5.5	33.9	-9.2	0	0	0	117.8
211	T	28.9	Very low	30.1	Very low	125 Å²	125	144.8 Å²	144.8	77%	0.767	75%	0.747	S	S	*	*			trans	77	117.1	144.6	28.3	0	0	0	0	124.2
212	R	29.9	Very low	30.3	Very low	189 Å²	189	142.6 Å²	142.6	71%	0.713	75%	0.75	S	S	*	*				102.8	127.9	112.1	-167.7	-179.1	-154.9	-163	10.5	120.6
213	R	31.5	Very low	30.3	Very low	199 Å²	199	141.9 Å²	141.9	75%	0.751	75%	0.751	S	S	*	*			trans	65.8	165.5	163.6	-76.3	163.4	179.1	176.4	-5.1	115.9
214	R	31.7	Very low	30.7	Very low	194 Å²	194	137 Å²	137	73%	0.732	75%	0.747	S	S	*	*			cis	-169.2	141.2	-36.6	164.9	179.4	156.6	173.9	-11.6	106.9	E216	R214-E216 IonicContact CZ-OE1 3.91Å; R214-E216 IonicContact NE-OE1 2.71Å; R214-E216 PolarHBondContact NE-OE1 2.68Å; R214-E216 VanDerWaalsContact NE-OE1 3.1Å; R214-E216 IonicContact NH2-OE1 3.22Å; R214-E216 PolarHBondContact NH2-OE1 2.71Å; R214-E216 IonicContact NH2-OE2 2.68Å; R214-E216 PolarHBondContact NH2-OE2 2.85Å
215	R	29.5	Very low	30.6	Very low	217 Å²	217	137.4 Å²	137.4	82%	0.819	75%	0.75	S	S	*	*			trans	2	164.2	157	-97	-176.2	179	170.3	0.3	121.9
216	E	29.9	Very low	30.7	Very low	132 Å²	132	139.3 Å²	139.3	62%	0.617	75%	0.751	S	S	*	*			trans	80.6	148.1	166.5	-57.5	131.6	-117.9	0	0	114	R214	R214-E216 IonicContact CZ-OE1 3.91Å; R214-E216 IonicContact NE-OE1 2.71Å; R214-E216 PolarHBondContact NE-OE1 2.68Å; R214-E216 VanDerWaalsContact NE-OE1 3.1Å; R214-E216 IonicContact NH2-OE1 3.22Å; R214-E216 PolarHBondContact NH2-OE1 2.71Å; R214-E216 IonicContact NH2-OE2 2.68Å; R214-E216 PolarHBondContact NH2-OE2 2.85Å
217	S	27.9	Very low	30.9	Very low	102 Å²	102	140.5 Å²	140.5	71%	0.713	76%	0.755	S	S	*	*			cis	-171.6	175.5	-37.9	45.3	0	0	0	0	109.4
218	S	29.9	Very low	31.3	Very low	110 Å²	110	138.8 Å²	138.8	77%	0.769	75%	0.747	S	S	*	*			trans	66	144.2	-177.8	70.8	0	0	0	0	115.2
219	S	28	Very low	31.4	Very low	95 Å²	95	139.1 Å²	139.1	66%	0.664	74%	0.736	S	S	*	*			cis	99.8	113.9	13.1	82.9	0	0	0	0	117.1
220	N	29.1	Very low	31.7	Very low	140 Å²	140	144.5 Å²	144.5	75%	0.749	74%	0.739	S	S	*	*			trans	77.9	114.4	157	-56.6	-18.1	0	0	0	120.3
221	N	33.5	Very low	31.4	Very low	149 Å²	149	143.1 Å²	143.1	80%	0.797	75%	0.745	S	S	*	*				54.9	137.8	119.7	-58.2	-8.5	0	0	0	120
222	P	34.8	Very low	31.5	Very low	126 Å²	126	142.4 Å²	142.4	82%	0.818	75%	0.745	S	S	*	*				-147.4	165.6	73.8	39.5	-21.6	0	0	0	118.1
223	S	32.8	Very low	31.6	Very low	111 Å²	111	142.6 Å²	142.6	78%	0.776	75%	0.746	S	S	*	*			trans	-91.4	157.8	164.3	-41.6	0	0	0	0	111.4
224	P	36.9	Very low	31.5	Very low	116 Å²	116	139.2 Å²	139.2	75%	0.753	74%	0.739	S	S	*	*				-141.4	153.1	106.9	36.1	-22.8	0	0	0	112.8
225	S	27	Very low	31.2	Very low	99 Å²	99	136.5 Å²	136.5	69%	0.692	74%	0.738	S	S	*	*			cis	90.8	152.2	22.6	92.6	0	0	0	0	116.5
226	K	32.1	Very low	31.2	Very low	191 Å²	191	133.1 Å²	133.1	83%	0.83	74%	0.735	S	S	*	*			trans	85.6	140.9	-176	-56.7	176.6	-178.8	173.2	0	115.2
227	T	33.4	Very low	31	Very low	113 Å²	113	133.7 Å²	133.7	69%	0.693	74%	0.742	S	S	*	*			cis	-157.7	169.1	-12	15.5	0	0	0	0	107.5
228	Q	35.9	Very low	31.2	Very low	139 Å²	139	139.2 Å²	139.2	65%	0.65	75%	0.753	S	S	*	*			cis	-144.9	-154.3	11.4	-124	159.1	79.5	0	0	105.8
229	K	33.1	Very low	31	Very low	155 Å²	155	141.3 Å²	141.3	67%	0.674	75%	0.748	S	S	*	*			cis	-164.8	157.3	-4.9	-121.9	168	176.4	130.1	0	103.6
230	R	31.8	Very low	30.8	Very low	224 Å²	224	142.2 Å²	142.2	85%	0.845	74%	0.742	S	S	*	*			cis	-164.7	117.6	-5.8	-157.9	-177.3	-166.9	179	2	110.5
231	G	30.9	Very low	30.7	Very low	79 Å²	79	144.1 Å²	144.1	81%	0.814	74%	0.743	S	S	*	*			trans	64.3	176.3	160.8	0	0	0	0	0	118.5
232	S	31.5	Very low	30.3	Very low	111 Å²	111	141.7 Å²	141.7	78%	0.776	74%	0.738	S	S	*	*			cis	-166.2	151.6	-18.1	-154.3	0	0	0	0	112.1
233	R	32.6	Very low	29.8	Very low	193 Å²	193	141.6 Å²	141.6	73%	0.728	74%	0.735	S	S	*	*			trans	56.2	126.4	158.5	-70.5	177.3	85.5	137.3	12.9	121.9
234	E	28.9	Very low	29.6	Very low	128 Å²	128	141.5 Å²	141.5	60%	0.598	73%	0.734	S	S	*	*				74.4	124.4	127.6	-68.6	163.7	177.4	0	0	123.6
235	D	26.9	Very low	29.1	Very low	136 Å²	136	139 Å²	139	73%	0.727	73%	0.729	S	S	*	*				77.4	140	125.4	-70.8	6	0	0	0	125.9
236	I	27.8	Very low	29.2	Very low	146 Å²	146	141.5 Å²	141.5	75%	0.749	73%	0.734	S	S	*	*			trans	77.9	157.2	145	-75.2	164.8	0	0	0	118.8
237	L	26.6	Very low	29.1	Very low	144 Å²	144	137.5 Å²	137.5	75%	0.754	73%	0.725	S	S	*	*			trans	-52.8	143.7	-174.3	-65.6	73.4	0	0	0	113.2
238	K	31.5	Very low	28.9	Very low	219 Å²	219	138.4 Å²	138.4	95%	0.952	73%	0.726	S	S	*	*			trans	-120.1	80.7	147.5	-80.2	-172.2	175.9	176.2	0	111.6
239	K	25.6	Very low	28.7	Very low	154 Å²	154	140.1 Å²	140.1	67%	0.67	73%	0.731	S	S	*	*			trans	-100.1	125.9	146	-163.1	-171.3	-163	-107.6	0	107
240	E	24.7	Very low	28.5	Very low	113 Å²	113	136.9 Å²	136.9	53%	0.528	73%	0.728	S	S	.	*			trans	58.4	141.8	153.8	-82.3	168.8	-135.1	0	0	121.9
241	K	25.7	Very low	28.5	Very low	181 Å²	181	133.8 Å²	133.8	79%	0.787	72%	0.721	S	S	*	*			trans	72.2	162.5	147.1	-67.7	163.1	-174.8	158.7	0	114
242	S	25.7	Very low	28.4	Very low	97 Å²	97	136.6 Å²	136.6	68%	0.678	71%	0.712	S	S	*	*			cis	-158.9	163.6	35.6	54.6	0	0	0	0	114.7
243	T	25	Very low	28.4	Very low	125 Å²	125	136.8 Å²	136.8	77%	0.767	71%	0.709	S	S	*	*			trans	28.7	146.1	141.5	56.5	0	0	0	0	120.9
244	S	27.2	Very low	28.3	Very low	108 Å²	108	137 Å²	137	76%	0.755	72%	0.715	S	S	*	*			cis	-170.7	162	6.6	32.9	0	0	0	0	107.7
245	G	27.5	Very low	28.4	Very low	63 Å²	63	134 Å²	134	65%	0.649	72%	0.719	S	S	*	*			cis	157.7	-158.5	6.2	0	0	0	0	0	108.1
246	I	29.5	Very low	28.5	Very low	153 Å²	153	135.8 Å²	135.8	79%	0.785	72%	0.723	S	S	*	*			trans	50.8	99.1	148.7	-59.5	173.5	0	0	0	114.3
247	T	29.6	Very low	28.4	Very low	106 Å²	106	135 Å²	135	65%	0.65	72%	0.72	S	S	*	*			cis	174	172.1	45.2	19.7	0	0	0	0	110.9
248	N	28.2	Very low	28.6	Very low	132 Å²	132	137 Å²	137	71%	0.706	72%	0.723	S	S	*	*			trans	50.9	130.8	139.5	-64.4	-17.7	0	0	0	119.8
249	K	32.4	Very low	28.8	Very low	176 Å²	176	133.3 Å²	133.3	77%	0.765	72%	0.719	S	S	*	*			cis	-150.5	145.2	19.2	-105.4	151.5	179.6	178.7	0	107.4
250	S	28.8	Very low	29.1	Very low	86 Å²	86	129.9 Å²	129.9	60%	0.601	71%	0.712	S	S	*	*				52.8	128.1	84.4	109.9	0	0	0	0	111.6
251	K	31.7	Very low	29.2	Very low	160 Å²	160	132.8 Å²	132.8	70%	0.696	73%	0.726	S	S	*	*				169.7	166.7	58.5	-118.3	171.3	177.5	-92.1	0	105.6
252	E	28.7	Very low	29.2	Very low	137 Å²	137	129.5 Å²	129.5	64%	0.64	72%	0.721	S	S	*	*			cis	-171.1	-176.3	0.5	-165.9	147.5	-140.3	0	0	109.6
253	V	32.3	Very low	29.3	Very low	115 Å²	115	130.3 Å²	130.3	70%	0.697	73%	0.726	S	S	*	*			trans	71.8	128.4	161.5	-174.8	0	0	0	0	115.9
254	K	30.4	Very low	29.6	Very low	197 Å²	197	127.1 Å²	127.1	86%	0.857	72%	0.719	S	S	*	*			cis	-148.8	146.1	-17.1	-108.3	168.4	-164	170.1	0	104.7
255	G	31.4	Very low	29.5	Very low	66 Å²	66	127 Å²	127	68%	0.68	72%	0.718	S	S	*	*				110.3	110.2	79.5	0	0	0	0	0	108
256	Q	27.4	Very low	29.5	Very low	174 Å²	174	128.9 Å²	128.9	81%	0.813	72%	0.721	S	S	*	*				75.5	119.1	87.9	-103.8	-167.8	-14.2	0	0	115.3
257	N	25.9	Very low	29.4	Very low	130 Å²	130	129.1 Å²	129.1	70%	0.695	72%	0.719	S	S	*	*			trans	79.1	153.8	149.7	-50.4	-24.2	0	0	0	118.9
258	K	30.7	Very low	29.5	Very low	185 Å²	185	129.9 Å²	129.9	80%	0.804	72%	0.718	S	S	*	*			trans	75.7	98.3	165.3	-61.6	-173.6	-179.9	-174.8	0	118.7
259	T	36.9	Very low	29.5	Very low	141 Å²	141	130.3 Å²	130.3	87%	0.865	72%	0.721	S	S	*	*				-57.9	135.3	110.1	39.6	0	0	0	0	108.2
260	P	31.5	Very low	29.2	Very low	82 Å²	82	126 Å²	126	53%	0.532	71%	0.712	S	S	.	*				-144	176	79.5	44.9	-30.1	0	0	0	114
261	E	26.1	Very low	29.2	Very low	174 Å²	174	127.1 Å²	127.1	81%	0.813	72%	0.72	S	S	*	*				52	153.4	127.9	-74.3	165.4	-126.7	0	0	122.3
262	T	26	Very low	29	Very low	112 Å²	112	124 Å²	124	69%	0.687	72%	0.719	S	S	*	*			cis	-173.7	166.8	-21.7	-107	0	0	0	0	107.6
263	S	28.8	Very low	29.1	Very low	114 Å²	114	127.9 Å²	127.9	80%	0.797	73%	0.727	S	S	*	*			trans	64.2	166.6	167.9	77.7	0	0	0	0	115.9
264	G	29.7	Very low	28.9	Very low	59 Å²	59	127.7 Å²	127.7	61%	0.608	73%	0.727	S	S	*	*			cis	-106.4	135.9	-13.3	0	0	0	0	0	110.9
265	S	27	Very low	28.7	Very low	104 Å²	104	123.1 Å²	123.1	73%	0.727	72%	0.716	S	S	*	*				50.7	95.7	81.2	72.6	0	0	0	0	112
266	S	27.4	Very low	28.7	Very low	103 Å²	103	126.9 Å²	126.9	72%	0.72	72%	0.72	S	S	*	*				91.7	163	106	82.2	0	0	0	0	111.7
267	Q	26.9	Very low	28.6	Very low	158 Å²	158	122.7 Å²	122.7	74%	0.738	71%	0.71	S	S	*	*			cis	-157.1	-179	-2.3	-146.1	174.8	-2.6	0	0	108.2
268	L	31.8	Very low	28.6	Very low	122 Å²	122	123.8 Å²	123.8	64%	0.639	72%	0.715	S	S	*	*			trans	66.2	109.7	153.8	-66.7	167.8	0	0	0	114.9
269	N	27	Very low	28.5	Very low	141 Å²	141	123.3 Å²	123.3	75%	0.754	72%	0.715	S	S	*	*				76	142.8	83.1	-78.5	15.6	0	0	0	112.7
270	S	27.6	Very low	28	Very low	85 Å²	85	124.6 Å²	124.6	59%	0.594	71%	0.713	S	S	*	*			cis	-174.6	169.3	-7.7	48.2	0	0	0	0	108.3
271	S	28.3	Very low	27.8	Very low	110 Å²	110	129.6 Å²	129.6	77%	0.769	73%	0.727	S	S	*	*			trans	70.2	155.6	150.1	-68.7	0	0	0	0	115.6
272	S	27.3	Very low	27.9	Very low	94 Å²	94	126.5 Å²	126.5	66%	0.657	72%	0.724	S	S	*	*			cis	-167.4	-168.3	-19.6	52.9	0	0	0	0	107.2
273	R	30.7	Very low	28	Very low	219 Å²	219	127 Å²	127	83%	0.826	73%	0.732	S	S	*	*			trans	74.3	113.9	166.5	-68.4	-170.5	157.7	157.7	-4.1	114.1
274	T	28.2	Very low	28	Very low	111 Å²	111	125.2 Å²	125.2	68%	0.681	73%	0.733	S	S	*	*				68.2	135.8	62.2	76.1	0	0	0	0	111.1
275	T	26.7	Very low	27.9	Very low	102 Å²	102	131.3 Å²	131.3	63%	0.626	75%	0.745	S	S	*	*			cis	-167.9	168.2	17	-4.9	0	0	0	0	111.1
276	N	30.8	Very low	27.8	Very low	144 Å²	144	133.5 Å²	133.5	77%	0.77	75%	0.748	S	S	*	*			trans	70.8	156.2	143.8	-72.7	-8.8	0	0	0	119.1
277	S	25.9	Very low	28	Very low	87 Å²	87	136.8 Å²	136.8	61%	0.608	76%	0.756	S	S	*	*			cis	-164	156.6	-25.6	-170	0	0	0	0	110.4
278	L	25	Very low	28	Very low	152 Å²	152	137.1 Å²	137.1	80%	0.796	76%	0.76	S	S	*	*			trans	-2	137.6	149	-52.1	167.5	0	0	0	117.8
279	H	29.5	Very low	28.2	Very low	176 Å²	176	136.4 Å²	136.4	82%	0.815	76%	0.763	S	S	*	*				-154.7	153.6	102.4	-133.9	-85.7	0	0	0	115.2
280	M	25.1	Very low	28.2	Very low	167 Å²	167	138.4 Å²	138.4	82%	0.823	77%	0.768	S	S	*	*			trans	-98	155.9	167.1	-71	-160.4	148.6	0	0	111.9
281	K	28.9	Very low	28.4	Very low	188 Å²	188	141.6 Å²	141.6	82%	0.817	78%	0.776	S	S	*	*			trans	-176.8	142.2	134	-109.1	173	179.7	-177.3	0	113.8
282	S	27.2	Very low	28.5	Very low	108 Å²	108	142.2 Å²	142.2	76%	0.755	78%	0.778	S	S	*	*			trans	55	148.5	150	49.8	0	0	0	0	120.4
283	S	27.7	Very low	28.4	Very low	122 Å²	122	145.3 Å²	145.3	85%	0.853	79%	0.785	S	S	*	*			cis	-176.4	157.2	-8.9	45.1	0	0	0	0	109.5
284	G	29.5	Very low	28.4	Very low	78 Å²	78	144.1 Å²	144.1	80%	0.804	79%	0.786	S	S	*	*			trans	147	132.1	167	0	0	0	0	0	113.5
285	E	26.7	Very low	28.5	Very low	187 Å²	187	143.8 Å²	143.8	87%	0.874	79%	0.788	S	S	*	*			trans	-98.9	155.3	-165.1	-66.3	159.2	137.1	0	0	114.7
286	D	26.7	Very low	28.6	Very low	149 Å²	149	146.8 Å²	146.8	80%	0.797	80%	0.798	S	S	*	*			trans	23.1	136.6	148.8	-60.4	-12	0	0	0	123
287	I	31.2	Very low	28.6	Very low	172 Å²	172	144.5 Å²	144.5	88%	0.882	79%	0.794	S	S	*	*				-179.8	145.3	115.8	-91.9	157.6	0	0	0	111.3
288	M	27.1	Very low	28.9	Very low	165 Å²	165	147.6 Å²	147.6	81%	0.813	81%	0.809	S	S	*	*			trans	-81.8	169.4	172.7	-86.8	-165.9	72.6	0	0	112
289	P	36.4	Very low	29.3	Very low	108 Å²	108	145.8 Å²	145.8	70%	0.701	80%	0.804	S	S	*	*			cis	-146.1	-154.7	25.5	33.3	-6.1	0	0	0	115.9
290	E	26.9	Very low	30	Very low	183 Å²	183	143.5 Å²	143.5	86%	0.855	80%	0.798	S	S	*	*			trans	95.5	154	157	-60.2	-142.2	128	0	0	121.5
291	I	31.9	Very low	31.1	Very low	152 Å²	152	137.3 Å²	137.3	78%	0.779	77%	0.77	S	S	*	*			trans	-131.3	129.6	-163.1	-60.2	164	0	0	0	109.9
292	P	28.5	Very low	32.6	Very low	123 Å²	123	134.2 Å²	134.2	80%	0.799	76%	0.757	S	S	*	*			trans	-102.9	120.7	159.8	32.7	-26	0	0	0	111.8
293	I	26.2	Very low	34.5	Very low	158 Å²	158	134.8 Å²	134.8	81%	0.81	75%	0.748	S	S	*	*			trans	-71.6	134.2	178.6	-63.6	163.4	0	0	0	110.6
294	K	31.2	Very low	36.7	Very low	195 Å²	195	130.2 Å²	130.2	85%	0.848	72%	0.715	S	S	*	*			trans	-115.2	101.8	165.4	-94	-176.4	174.6	175.9	0	112.3
295	S	29.7	Very low	39.1	Very low	103 Å²	103	130.5 Å²	130.5	72%	0.72	69%	0.692	S	S	*	*			trans	31.4	97.5	149.8	60	0	0	0	0	117.7	S297	S295-S297 PolarHBondContact O-N 2.98Å
296	I	28.7	Very low	41.6	Very low	165 Å²	165	121.7 Å²	121.7	85%	0.846	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-70.9	116.1	160.9	-63.4	173.9	0	0	0	108.3
297	S	30.7	Very low	44.1	Very low	97 Å²	97	116.1 Å²	116.1	68%	0.678	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-86.7	156	166.6	53.1	0	0	0	0	111.1	S295 T299	S295-S297 PolarHBondContact O-N 2.98Å; S297-T299 PolarHBondContact O-N 3.23Å; S297-T299 VanDerWaalsContact O-N 3.13Å
298	V	31.6	Very low	46.5	Very low	152 Å²	152	110.8 Å²	110.8	92%	0.921	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-58.4	116.2	-168.5	-179.1	0	0	0	0	111.7
299	T	34.6	Very low	48.9	Very low	114 Å²	114	110.5 Å²	110.5	70%	0.699	59%	0.588	S	S	*	*			trans	-130.1	154.9	170.4	43.7	0	0	0	0	109.5	S297	S297-T299 PolarHBondContact O-N 3.23Å; S297-T299 VanDerWaalsContact O-N 3.13Å
300	N	43.3	Very low	50.8	Low	127 Å²	127	108.1 Å²	108.1	68%	0.679	57%	0.569	S	S	*	*			trans	-48.8	152.9	-161.3	-60.8	-53.1	0	0	0	115.7	K302	N300-K302 PolarHBondContact O-N 3.32Å; N300-K302 VanDerWaalsContact O-N 3.13Å
301	P	49.6	Very low	53.4	Low	38 Å²	38	100.1 Å²	100.1	25%	0.247	53%	0.531	C	S	.	.	S	Bend	trans	-49.4	122.5	169	22.7	-35.6	0	0	0	109.8	W157 E303	W157-P301 VanDerWaalsContact CD1-O 3.24Å; W157-P301 HydrophobicContact CZ2-CG 4.44Å; W157-P301 PolarHBondContact NE1-O 3.41Å; P301-E303 PolarHBondContact O-N 3.14Å; P301-E303 VanDerWaalsContact O-N 3.14Å
302	K	58.6	Low	55.5	Low	123 Å²	123	97 Å²	97	54%	0.535	52%	0.522	S	S	.	.			trans	-59	115.3	-153.8	-69.6	-179.5	176.1	179.4	0	112.7	N300	N300-K302 PolarHBondContact O-N 3.32Å; N300-K302 VanDerWaalsContact O-N 3.13Å
303	E	67.7	Low	57.7	Low	119 Å²	119	95.3 Å²	95.3	56%	0.556	50%	0.503	S	S	*	.			trans	-84.8	105.7	164.2	-65.5	-171.8	177.9	0	0	108.3	L155 L156 W157 P301	L155-E303 HydrophobicContact CD1-CB 3.88Å; L155-E303 HydrophobicContact CD2-CB 4.39Å; L155-E303 HydrophobicContact CG-CB 4.27Å; L156-E303 CarbonylContact O-C 3.17Å; L156-E303 WeakPolarHBondContact O-CA 3.26Å; W157-E303 HydrophobicContact CG-CG 4.48Å; P301-E303 PolarHBondContact O-N 3.14Å; P301-E303 VanDerWaalsContact O-N 3.14Å
304	T	73.4	Confident	59.9	Low	27 Å²	27	87.8 Å²	87.8	17%	0.166	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	126.4	-174.6	-56.7	0	0	0	0	111.2	F90 L156	F90-T304 HydrophobicContact CB-CG2 3.92Å; F90-T304 HydrophobicContact CD1-CG2 3.66Å; F90-T304 HydrophobicContact CG-CG2 4.19Å; F90-T304 PolarHBondContact O-OG1 2.87Å; L156-T304 PolarHBondContact N-O 2.79Å; L156-T304 PolarHBondContact O-N 3.41Å
305	W	79.7	Confident	61.9	Low	84 Å²	84	79 Å²	79	32%	0.318	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	134.1	171.4	-73.6	97.1	0	0	0	110.9	K104 R106 I110 L154 L155	K104-W305 HydrophobicContact CB-CH2 3.92Å; K104-W305 HydrophobicContact CB-CZ2 4.42Å; R106-W305 HydrophobicContact CB-CH2 4.27Å; R106-W305 HydrophobicContact CB-CZ3 4.27Å; R106-W305 HydrophobicContact CG-CE3 4.21Å; R106-W305 HydrophobicContact CG-CH2 4.01Å; R106-W305 HydrophobicContact CG-CZ3 3.67Å; I110-W305 HydrophobicContact CD1-CB 4.21Å; L154-W305 CarbonylContact O-C 3.59Å; L154-W305 WeakPolarHBondContact O-CA 3.38Å; L155-W305 HydrophobicContact CB-CD2 4.08Å; L155-W305 HydrophobicContact CB-CE3 4.02Å; L155-W305 HydrophobicContact CB-CH2 4.02Å; L155-W305 HydrophobicContact CB-CZ2 4.08Å; L155-W305 HydrophobicContact CB-CZ3 3.99Å; L155-W305 HydrophobicContact CD1-CD2 3.93Å; L155-W305 HydrophobicContact CD1-CG 3.89Å; L155-W305 HydrophobicContact CD1-CZ2 4.45Å; L155-W305 HydrophobicContact CD2-CZ2 4.16Å; L155-W305 HydrophobicContact CG-CZ2 4.48Å
306	I	79.9	Confident	63.8	Low	1 Å²	1	80.4 Å²	80.4	1%	0.005	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	147.9	176.3	-168.1	165.9	0	0	0	109.8	F90 S153 L154 L156 D310 F311 I314	F90-I306 HydrophobicContact CD2-CD1 4.04Å; F90-I306 HydrophobicContact CE1-CG1 4.32Å; F90-I306 HydrophobicContact CE2-CD1 3.59Å; F90-I306 HydrophobicContact CE2-CG1 4.04Å; F90-I306 HydrophobicContact CZ-CD1 3.94Å; F90-I306 HydrophobicContact CZ-CG1 3.83Å; S153-I306 CarbonylContact C-O 3.59Å; S153-I306 WeakPolarHBondContact CA-O 3.5Å; S153-I306 WeakPolarHBondContact CB-O 3.38Å; L154-I306 HydrophobicContact CB-CG2 4.12Å; L154-I306 PolarHBondContact N-O 2.9Å; L154-I306 PolarHBondContact O-N 3.04Å; L156-I306 HydrophobicContact CD1-CB 4.36Å; L156-I306 HydrophobicContact CD1-CD1 4.29Å; L156-I306 HydrophobicContact CD1-CG2 3.78Å; L156-I306 HydrophobicContact CD2-CG2 4.49Å; L156-I306 HydrophobicContact CG-CG2 3.85Å; I306-D310 HydrophobicContact CD1-CB 3.99Å; I306-D310 HydrophobicContact CG1-CB 3.77Å; I306-F311 HydrophobicContact CD1-CB 4.35Å; I306-F311 HydrophobicContact CG2-CB 4.03Å; I306-F311 HydrophobicContact CG2-CD2 4.34Å; I306-I314 HydrophobicContact CD1-CD1 4.05Å
307	D	80.2	Confident	65.5	Low	33 Å²	33	73.7 Å²	73.7	18%	0.176	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	149.8	169.5	-164.5	-77.4	0	0	0	109.7	R152 K309 D310 F311	R152-D307 CarbonylContact O-C 3.58Å; R152-D307 WeakPolarHBondContact O-CA 3.21Å; R152-D307 VanDerWaalsContact O-CG 3.27Å; D307-K309 PolarHBondContact O-N 3.27Å; D307-K309 WeakPolarHBondContact OD1-CB 3.39Å; D307-K309 WeakPolarHBondContact OD1-CG 3.27Å; D307-K309 PolarHBondContact OD1-N 3.38Å; D307-D310 PolarHBondContact O-N 3.16Å; D307-F311 WeakPolarHBondContact O-CB 3.41Å; D307-F311 PolarHBondContact O-N 3.46Å
308	I	80.7	Confident	67.5	Low	59 Å²	59	72.1 Å²	72.1	30%	0.303	37%	0.373	S	S	.	.	H	α-helix	trans	-64.3	-24.6	179	-163.3	163.8	0	0	0	112.2	I151 R152 L154 C312	I151-I308 HydrophobicContact CB-CD1 4.33Å; I151-I308 HydrophobicContact CG2-CD1 4.21Å; R152-I308 PolarHBondContact O-N 3.06Å; L154-I308 HydrophobicContact CD1-CG1 4.37Å; I308-C312 PolarHBondContact O-N 3.39Å; I308-C312 PolarHBondContact O-SG 3.11Å
309	K	77.4	Confident	69.3	Low	160 Å²	160	67.3 Å²	67.3	70%	0.696	34%	0.342	S	S	*	.	H	α-helix	trans	-66.6	-56.5	172.3	-66.8	179.6	178.5	-176	0	111.6	D307 F311 C312 E313	D307-K309 PolarHBondContact O-N 3.27Å; D307-K309 WeakPolarHBondContact OD1-CB 3.39Å; D307-K309 WeakPolarHBondContact OD1-CG 3.27Å; D307-K309 PolarHBondContact OD1-N 3.38Å; K309-F311 PolarHBondContact O-N 2.79Å; K309-C312 PolarHBondContact O-N 2.99Å; K309-C312 VanDerWaalsContact O-N 3.08Å; K309-E313 PolarHBondContact O-N 3.21Å; K309-E313 VanDerWaalsContact O-N 3.07Å
310	D	76.1	Confident	71.2	Confident	58 Å²	58	66 Å²	66	31%	0.31	33%	0.329	S	S	.	.	H	α-helix	trans	-61.9	-34.4	-178.8	-44	-28.1	0	0	0	110.9	I306 D307 E313 I314	I306-D310 HydrophobicContact CD1-CB 3.99Å; I306-D310 HydrophobicContact CG1-CB 3.77Å; D307-D310 PolarHBondContact O-N 3.16Å; D310-E313 PolarHBondContact O-N 2.92Å; D310-I314 WeakPolarHBondContact O-CB 3.37Å; D310-I314 VanDerWaalsContact O-CG1 3.32Å; D310-I314 WeakPolarHBondContact O-CG1 3.34Å; D310-I314 PolarHBondContact O-N 3.25Å
311	F	81.1	Confident	72.6	Confident	15 Å²	15	66.4 Å²	66.4	7%	0.066	32%	0.323	C	S	.	.	H	α-helix	trans	-59.3	-50	172.2	176.9	-93.3	0	0	0	112.1	A62 I102 L154 L156 I306 D307 K309 E313 I314 F315 V318	A62-F311 HydrophobicContact CB-CE2 3.75Å; A62-F311 HydrophobicContact CB-CZ 3.76Å; I102-F311 HydrophobicContact CD1-CE1 4.46Å; I102-F311 HydrophobicContact CD1-CE2 3.95Å; I102-F311 HydrophobicContact CD1-CZ 3.66Å; I102-F311 HydrophobicContact CG1-CE2 4.36Å; I102-F311 HydrophobicContact CG1-CZ 4.49Å; L154-F311 HydrophobicContact CD1-CB 4.26Å; L154-F311 HydrophobicContact CD1-CD1 3.81Å; L154-F311 HydrophobicContact CD1-CD2 4.08Å; L154-F311 HydrophobicContact CD1-CE1 4.2Å; L154-F311 HydrophobicContact CD1-CE2 4.45Å; L154-F311 HydrophobicContact CD1-CG 3.76Å; L156-F311 HydrophobicContact CD1-CD2 4.35Å; L156-F311 HydrophobicContact CD2-CD2 4.01Å; L156-F311 HydrophobicContact CD2-CE2 3.9Å; I306-F311 HydrophobicContact CD1-CB 4.35Å; I306-F311 HydrophobicContact CG2-CB 4.03Å; I306-F311 HydrophobicContact CG2-CD2 4.34Å; D307-F311 WeakPolarHBondContact O-CB 3.41Å; D307-F311 PolarHBondContact O-N 3.46Å; K309-F311 PolarHBondContact O-N 2.79Å; F311-E313 PolarHBondContact O-N 3.14Å; F311-I314 PolarHBondContact O-N 3.4Å; F311-F315 HydrophobicContact CD2-CB 4.48Å; F311-F315 AromaticContact CD2-CD2 3.4Å; F311-F315 HydrophobicContact CD2-CD2 3.4Å; F311-F315 VanDerWaalsContact CD2-CD2 3.4Å; F311-F315 AromaticContact CD2-CE2 3.93Å; F311-F315 HydrophobicContact CD2-CE2 3.93Å; F311-F315 HydrophobicContact CD2-CG 4.17Å; F311-F315 HydrophobicContact CE1-CB 4.48Å; F311-F315 HydrophobicContact CE2-CB 4.09Å; F311-F315 AromaticContact CE2-CD2 3.54Å; F311-F315 HydrophobicContact CE2-CD2 3.54Å; F311-F315 HydrophobicContact CE2-CE2 4.15Å; F311-F315 AromaticContact CE2-CG 3.87Å; F311-F315 HydrophobicContact CE2-CG 3.87Å; F311-F315 HydrophobicContact CG-CD2 4.14Å; F311-F315 HydrophobicContact CZ-CB 4.08Å; F311-F315 HydrophobicContact CZ-CD2 4.37Å; F311-F315 HydrophobicContact CZ-CG 4.35Å; F311-F315 WeakPolarHBondContact O-CB 3.41Å; F311-F315 WeakPolarHBondContact O-CD2 3.38Å; F311-F315 PolarHBondContact O-N 3.03Å; F311-V318 HydrophobicContact CE1-CG2 4.29Å; F311-V318 HydrophobicContact CZ-CG2 4.08Å
312	C	76.1	Confident	73.9	Confident	87 Å²	87	67.1 Å²	67.1	59%	0.588	32%	0.323	S	S	*	.	H	α-helix	trans	-67.1	-23.4	178.9	-70.4	0	0	0	0	113.3	I308 K309	I308-C312 PolarHBondContact O-N 3.39Å; I308-C312 PolarHBondContact O-SG 3.11Å; K309-C312 PolarHBondContact O-N 2.99Å; K309-C312 VanDerWaalsContact O-N 3.08Å
313	E	75.8	Confident	74.8	Confident	86 Å²	86	64.7 Å²	64.7	40%	0.402	31%	0.312	S	S	.	.	H	α-helix	trans	-75	-43	174.3	-162.5	-160.8	151.6	0	0	112	K86 K309 D310 F311	K86-E313 IonicContact NZ-OE1 2.67Å; K86-E313 PolarHBondContact NZ-OE1 2.92Å; K86-E313 IonicContact NZ-OE2 3.81Å; K86-E313 PolarHBondContact NZ-OE2 3.47Å; K309-E313 PolarHBondContact O-N 3.21Å; K309-E313 VanDerWaalsContact O-N 3.07Å; D310-E313 PolarHBondContact O-N 2.92Å; F311-E313 PolarHBondContact O-N 3.14Å
314	I	71.8	Confident	75	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-83	-39.3	-174.5	-67.5	171.7	0	0	0	112.3	I83 K86 L87 F90 I306 D310 F311	I83-I314 HydrophobicContact CG2-CG2 4.18Å; K86-I314 HydrophobicContact CB-CD1 3.66Å; K86-I314 HydrophobicContact CB-CG1 4.35Å; K86-I314 HydrophobicContact CD-CD1 4.15Å; K86-I314 HydrophobicContact CD-CG1 4.33Å; L87-I314 HydrophobicContact CD1-CG2 4.23Å; L87-I314 HydrophobicContact CD2-CG2 3.75Å; L87-I314 HydrophobicContact CG-CG2 3.91Å; F90-I314 HydrophobicContact CD2-CD1 4.2Å; F90-I314 HydrophobicContact CE2-CD1 3.83Å; I306-I314 HydrophobicContact CD1-CD1 4.05Å; D310-I314 WeakPolarHBondContact O-CB 3.37Å; D310-I314 VanDerWaalsContact O-CG1 3.32Å; D310-I314 WeakPolarHBondContact O-CG1 3.34Å; D310-I314 PolarHBondContact O-N 3.25Å; F311-I314 PolarHBondContact O-N 3.4Å
315	F	73.8	Confident	75	Confident	10 Å²	10	67 Å²	67	4%	0.044	33%	0.329	C	S	.	.			trans	-107.4	98.5	-170.6	-65.1	-80.3	0	0	0	112.4	A62 C64 L87 I100 L156 F311	A62-F315 HydrophobicContact CB-CB 3.99Å; A62-F315 HydrophobicContact CB-CD1 3.44Å; A62-F315 VanDerWaalsContact CB-CD1 3.44Å; A62-F315 HydrophobicContact CB-CE1 4.02Å; A62-F315 HydrophobicContact CB-CG 3.73Å; C64-F315 VanDerWaalsContact SG-CE1 3.59Å; L87-F315 HydrophobicContact CD2-CZ 3.96Å; I100-F315 HydrophobicContact CB-CE1 4.13Å; I100-F315 HydrophobicContact CB-CZ 4.35Å; I100-F315 HydrophobicContact CD1-CE1 3.93Å; I100-F315 HydrophobicContact CD1-CZ 3.85Å; I100-F315 HydrophobicContact CG1-CE1 4.41Å; I100-F315 HydrophobicContact CG2-CZ 4.43Å; L156-F315 HydrophobicContact CD1-CE2 3.6Å; L156-F315 HydrophobicContact CD1-CZ 3.91Å; F311-F315 HydrophobicContact CD2-CB 4.48Å; F311-F315 AromaticContact CD2-CD2 3.4Å; F311-F315 HydrophobicContact CD2-CD2 3.4Å; F311-F315 VanDerWaalsContact CD2-CD2 3.4Å; F311-F315 AromaticContact CD2-CE2 3.93Å; F311-F315 HydrophobicContact CD2-CE2 3.93Å; F311-F315 HydrophobicContact CD2-CG 4.17Å; F311-F315 HydrophobicContact CE1-CB 4.48Å; F311-F315 HydrophobicContact CE2-CB 4.09Å; F311-F315 AromaticContact CE2-CD2 3.54Å; F311-F315 HydrophobicContact CE2-CD2 3.54Å; F311-F315 HydrophobicContact CE2-CE2 4.15Å; F311-F315 AromaticContact CE2-CG 3.87Å; F311-F315 HydrophobicContact CE2-CG 3.87Å; F311-F315 HydrophobicContact CG-CD2 4.14Å; F311-F315 HydrophobicContact CZ-CB 4.08Å; F311-F315 HydrophobicContact CZ-CD2 4.37Å; F311-F315 HydrophobicContact CZ-CG 4.35Å; F311-F315 WeakPolarHBondContact O-CB 3.41Å; F311-F315 WeakPolarHBondContact O-CD2 3.38Å; F311-F315 PolarHBondContact O-N 3.03Å
316	K	68.8	Low	74.9	Confident	132 Å²	132	64.3 Å²	64.3	57%	0.574	32%	0.322	S	S	*	.			trans	-81.7	-9.5	-177.4	-60.5	-172.6	179.6	-176.4	0	114.6	S63	S63-K316 PolarHBondContact O-N 3.47Å
317	T	65.2	Low	74.8	Confident	24 Å²	24	65 Å²	65	15%	0.147	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	142.4	179.2	30.5	0	0	0	0	111.4	A62 S63 K65 N66	A62-T317 WeakPolarHBondContact CA-O 3.25Å; S63-T317 PolarHBondContact N-O 3.38Å; S63-T317 PolarHBondContact O-N 3.4Å; S63-T317 VanDerWaalsContact O-N 3.11Å; S63-T317 PolarHBondContact O-OG1 2.75Å; K65-T317 PolarHBondContact O-OG1 3.27Å; K65-T317 VanDerWaalsContact O-OG1 3.1Å; N66-T317 HydrophobicContact CB-CG2 3.92Å
318	V	72.6	Confident	74.4	Confident	65 Å²	65	67.6 Å²	67.6	39%	0.394	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	115.5	-177.7	178.1	0	0	0	0	109.6	I60 F61 A62 F311 I320	I60-V318 HydrophobicContact CG2-CG1 3.35Å; F61-V318 CarbonylContact O-C 3.52Å; F61-V318 VanDerWaalsContact O-CA 3.29Å; F61-V318 WeakPolarHBondContact O-CA 3.48Å; F61-V318 WeakPolarHBondContact O-CG1 3.45Å; A62-V318 HydrophobicContact CB-CG2 4.36Å; F311-V318 HydrophobicContact CE1-CG2 4.29Å; F311-V318 HydrophobicContact CZ-CG2 4.08Å; V318-I320 HydrophobicContact CG1-CG1 4.36Å
319	D	69.1	Low	74.2	Confident	51 Å²	51	66.1 Å²	66.1	27%	0.273	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	123.2	178.9	-60.6	-41.8	0	0	0	110	F61 Y321	F61-D319 PolarHBondContact N-O 2.95Å; F61-D319 PolarHBondContact O-N 3.14Å; D319-Y321 HydrophobicContact CB-CD2 4.31Å; D319-Y321 HydrophobicContact CB-CE2 3.56Å
320	I	73.6	Confident	74.5	Confident	85 Å²	85	61.6 Å²	61.6	44%	0.436	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	111.6	-179.9	-50.8	179.2	0	0	0	109.5	I60 V318 H322	I60-I320 HydrophobicContact CG1-CG1 4.47Å; I60-I320 HydrophobicContact CG1-CG2 4.3Å; I60-I320 HydrophobicContact CG2-CG1 4.44Å; V318-I320 HydrophobicContact CG1-CG1 4.36Å; I320-H322 VanDerWaalsContact CG2-CE1 3.46Å; I320-H322 WeakPolarHBondContact CG2-CE1 3.42Å; I320-H322 WeakPolarHBondContact CG2-NE2 3.09Å; I320-H322 PolarHBondContact O-CD2 3.46Å; I320-H322 VanDerWaalsContact O-CD2 3.29Å
321	Y	73.9	Confident	74.8	Confident	136 Å²	136	62.3 Å²	62.3	53%	0.533	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	113.2	178.1	-66.6	-95.3	0	0	0	109.7	T58 I59 F61 D319	T58-Y321 CarbonylContact C-O 3.6Å; T58-Y321 WeakPolarHBondContact CA-O 3.4Å; I59-Y321 PolarHBondContact N-O 3.42Å; I59-Y321 PolarHBondContact O-N 2.97Å; F61-Y321 AromaticContact CD2-CD2 3.66Å; F61-Y321 HydrophobicContact CD2-CD2 3.66Å; F61-Y321 AromaticContact CD2-CE2 3.7Å; F61-Y321 HydrophobicContact CD2-CE2 3.7Å; F61-Y321 HydrophobicContact CE2-CD2 4.14Å; F61-Y321 HydrophobicContact CE2-CE2 4.34Å; D319-Y321 HydrophobicContact CB-CD2 4.31Å; D319-Y321 HydrophobicContact CB-CE2 3.56Å
322	H	75.8	Confident	74.9	Confident	54 Å²	54	65.5 Å²	65.5	25%	0.25	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	141.8	179.9	-58.8	-88	0	0	0	110.8	T58 I320 P324 Y327 I358 L515	T58-H322 WeakPolarHBondContact CG2-ND1 3.33Å; I320-H322 VanDerWaalsContact CG2-CE1 3.46Å; I320-H322 WeakPolarHBondContact CG2-CE1 3.42Å; I320-H322 WeakPolarHBondContact CG2-NE2 3.09Å; I320-H322 PolarHBondContact O-CD2 3.46Å; I320-H322 VanDerWaalsContact O-CD2 3.29Å; H322-P324 WeakPolarHBondContact O-CD 3.3Å; H322-Y327 HydrophobicContact CB-CE2 4.18Å; H322-Y327 PolarHBondContact CE1-OH 3.15Å; H322-Y327 AromaticContact ND1-CZ 3.79Å; H322-Y327 PolarHBondContact ND1-OH 3.35Å; H322-I358 WeakPolarHBondContact CE1-CD1 3.49Å; H322-L515 HydrophobicContact CB-CD1 4.36Å
323	K	77.9	Confident	75.3	Confident	72 Å²	72	64.1 Å²	64.1	31%	0.313	33%	0.328	S	S	.	.			trans	-95.1	102.7	168.9	-171.8	-179.7	177.8	-170.6	0	109.1	E57 N325 T326	E57-K323 HydrophobicContact CB-CB 4.02Å; E57-K323 HydrophobicContact CB-CD 3.87Å; E57-K323 HydrophobicContact CG-CD 4.3Å; E57-K323 WeakPolarHBondContact O-CB 3.24Å; E57-K323 PolarHBondContact O-N 2.99Å; E57-K323 IonicContact OE1-NZ 2.73Å; E57-K323 PolarHBondContact OE1-NZ 2.96Å; E57-K323 VanDerWaalsContact OE2-CD 3.24Å; E57-K323 WeakPolarHBondContact OE2-CD 3.42Å; E57-K323 IonicContact OE2-NZ 3.4Å; E57-K323 PolarHBondContact OE2-NZ 2.76Å; K323-N325 VanDerWaalsContact C-N 3.31Å; K323-N325 PolarHBondContact O-N 3.2Å; K323-T326 HydrophobicContact CB-CG2 4.24Å; K323-T326 HydrophobicContact CD-CG2 3.73Å; K323-T326 HydrophobicContact CG-CG2 4.03Å; K323-T326 PolarHBondContact O-N 2.82Å; K323-T326 PolarHBondContact O-OG1 3.38Å
324	P	72.3	Confident	75.7	Confident	44 Å²	44	63.8 Å²	63.8	29%	0.286	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-53.2	-45.5	-168	-30.6	38.2	0	0	0	113.4	H322 T326 Y327 V330 L515	H322-P324 WeakPolarHBondContact O-CD 3.3Å; P324-T326 PolarHBondContact O-N 3.01Å; P324-Y327 PolarHBondContact O-N 2.8Å; P324-V330 VanDerWaalsContact O-CG2 3.23Å; P324-V330 WeakPolarHBondContact O-CG2 3.29Å; P324-L515 HydrophobicContact CB-CD2 3.89Å
325	N	73.9	Confident	76	Confident	149 Å²	149	66 Å²	66	80%	0.797	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-63.9	7.5	-178.3	-48.7	30.6	0	0	0	114.9	K323	K323-N325 VanDerWaalsContact C-N 3.31Å; K323-N325 PolarHBondContact O-N 3.2Å
326	T	76.1	Confident	76	Confident	28 Å²	28	70.8 Å²	70.8	17%	0.172	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-113.8	-1.4	175	64.6	0	0	0	0	113.7	P56 E57 K323 P324	P56-T326 WeakPolarHBondContact CA-OG1 3.33Å; P56-T326 WeakPolarHBondContact CB-OG1 3.34Å; E57-T326 HydrophobicContact CB-CG2 4.1Å; E57-T326 HydrophobicContact CG-CG2 4.03Å; E57-T326 PolarHBondContact N-OG1 3.29Å; E57-T326 WeakPolarHBondContact OE1-CG2 3.44Å; K323-T326 HydrophobicContact CB-CG2 4.24Å; K323-T326 HydrophobicContact CD-CG2 3.73Å; K323-T326 HydrophobicContact CG-CG2 4.03Å; K323-T326 PolarHBondContact O-N 2.82Å; K323-T326 PolarHBondContact O-OG1 3.38Å; P324-T326 PolarHBondContact O-N 3.01Å
327	Y	77.9	Confident	75.9	Confident	17 Å²	17	72.1 Å²	72.1	7%	0.067	38%	0.377	C	S	.	.	S	Bend	trans	-83.1	150.2	170.3	-78.9	-106.3	0	0	0	111	P56 H322 P324 I329 I358 L515 R517	P56-Y327 HydrophobicContact CB-CD2 3.68Å; P56-Y327 HydrophobicContact CB-CE1 4.47Å; P56-Y327 HydrophobicContact CB-CE2 3.38Å; P56-Y327 HydrophobicContact CB-CG 4.3Å; P56-Y327 HydrophobicContact CG-CD2 4.38Å; P56-Y327 HydrophobicContact CG-CE1 4.17Å; P56-Y327 HydrophobicContact CG-CE2 3.87Å; H322-Y327 HydrophobicContact CB-CE2 4.18Å; H322-Y327 PolarHBondContact CE1-OH 3.15Å; H322-Y327 AromaticContact ND1-CZ 3.79Å; H322-Y327 PolarHBondContact ND1-OH 3.35Å; P324-Y327 PolarHBondContact O-N 2.8Å; Y327-I329 VanDerWaalsContact C-N 3.29Å; Y327-I329 PolarHBondContact O-N 2.85Å; Y327-I358 HydrophobicContact CE1-CD1 4.09Å; Y327-I358 WeakPolarHBondContact OH-CD1 3.44Å; Y327-L515 HydrophobicContact CD1-CB 3.64Å; Y327-L515 HydrophobicContact CD2-CB 4.25Å; Y327-L515 HydrophobicContact CD2-CD1 4.26Å; Y327-L515 HydrophobicContact CE1-CB 4.03Å; Y327-L515 HydrophobicContact CE2-CD1 4.29Å; Y327-L515 HydrophobicContact CG-CB 3.78Å; Y327-R517 HydrophobicContact CD1-CB 3.92Å; Y327-R517 HydrophobicContact CD1-CG 4.36Å; Y327-R517 HydrophobicContact CE1-CB 4.14Å; Y327-R517 HydrophobicContact CE1-CG 4.07Å
328	S	72.2	Confident	75.7	Confident	87 Å²	87	75.6 Å²	75.6	61%	0.608	40%	0.4	S	S	*	.	S	Bend	trans	-70.5	-24.5	178.4	40.3	0	0	0	0	113.6	G516 R517	S328-G516 PolarHBondContact N-O 3.2Å; S328-G516 PolarHBondContact OG-O 3.02Å; S328-R517 WeakPolarHBondContact OG-CA 3.44Å
329	I	76.6	Confident	75	Confident	28 Å²	28	74 Å²	74	14%	0.144	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	130	173.7	-57.3	175.6	0	0	0	107.6	Y327 K331 L515 G516 M539 V541	Y327-I329 VanDerWaalsContact C-N 3.29Å; Y327-I329 PolarHBondContact O-N 2.85Å; I329-K331 HydrophobicContact CG2-CG 4.32Å; I329-L515 CarbonylContact O-C 3.58Å; I329-L515 WeakPolarHBondContact O-CA 3.37Å; I329-G516 PolarHBondContact N-O 2.91Å; I329-G516 PolarHBondContact O-N 3.11Å; I329-M539 HydrophobicContact CD1-CB 4.25Å; I329-M539 HydrophobicContact CD1-CE 4.37Å; I329-M539 HydrophobicContact CD1-CG 3.75Å; I329-M539 HydrophobicContact CD1-SD 3.97Å; I329-V541 HydrophobicContact CD1-CB 4.31Å; I329-V541 HydrophobicContact CD1-CG2 3.87Å; I329-V541 HydrophobicContact CG2-CB 4.43Å
330	V	83.6	Confident	74.6	Confident	64 Å²	64	81.3 Å²	81.3	39%	0.388	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	122.7	169.8	-177.5	0	0	0	0	107.2	P324 T513 I514 L515	P324-V330 VanDerWaalsContact O-CG2 3.23Å; P324-V330 WeakPolarHBondContact O-CG2 3.29Å; V330-T513 HydrophobicContact CG1-CG2 4.33Å; V330-I514 WeakPolarHBondContact CA-O 2.93Å; V330-L515 HydrophobicContact CB-CD2 4.31Å; V330-L515 HydrophobicContact CG1-CD2 3.9Å; V330-L515 HydrophobicContact CG2-CD2 3.9Å
331	K	82.6	Confident	74.2	Confident	73 Å²	73	83.1 Å²	83.1	32%	0.317	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	132.2	171.3	-65.3	-169.4	170	-176.6	0	109.9	I329 Y333 T513 I514 V541	I329-K331 HydrophobicContact CG2-CG 4.32Å; K331-Y333 HydrophobicContact CB-CE2 3.65Å; K331-T513 CarbonylContact O-C 3.47Å; K331-T513 WeakPolarHBondContact O-CA 3.4Å; K331-I514 PolarHBondContact N-O 3.47Å; K331-I514 PolarHBondContact O-N 3.33Å; K331-V541 VanDerWaalsContact CE-O 3.31Å; K331-V541 WeakPolarHBondContact CE-O 3.32Å; K331-V541 PolarHBondContact NZ-O 3.19Å
332	T	84	Confident	74.1	Confident	82 Å²	82	79.8 Å²	79.8	50%	0.503	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.2	-176.3	-63.1	0	0	0	0	110.1	V511 I512 T513	T332-V511 HydrophobicContact CG2-CG1 3.61Å; T332-I512 CarbonylContact C-O 3.52Å; T332-I512 VanDerWaalsContact CA-O 3.31Å; T332-I512 WeakPolarHBondContact CA-O 3.35Å; T332-T513 WeakPolarHBondContact CG2-OG1 3.48Å; T332-T513 WeakPolarHBondContact OG1-CG2 3.49Å; T332-T513 PolarHBondContact OG1-OG1 3.06Å
333	Y	84	Confident	74.3	Confident	59 Å²	59	79.3 Å²	79.3	23%	0.231	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	138	-176.5	-61	-99.3	0	0	0	108.4	K331 V511 I512 I514 L543	K331-Y333 HydrophobicContact CB-CE2 3.65Å; Y333-V511 CarbonylContact O-C 3.55Å; Y333-V511 WeakPolarHBondContact O-CA 3.22Å; Y333-I512 PolarHBondContact N-O 3.43Å; Y333-I512 PolarHBondContact O-N 2.72Å; Y333-I514 HydrophobicContact CD2-CD1 4.48Å; Y333-I514 HydrophobicContact CE2-CD1 4.21Å; Y333-L543 HydrophobicContact CD1-CD2 4.13Å; Y333-L543 HydrophobicContact CD2-CB 4.34Å; Y333-L543 HydrophobicContact CD2-CD2 3.55Å; Y333-L543 HydrophobicContact CE1-CB 4.41Å; Y333-L543 HydrophobicContact CE1-CD2 4.37Å; Y333-L543 WeakPolarHBondContact CE1-O 3.37Å; Y333-L543 HydrophobicContact CE2-CB 3.73Å; Y333-L543 HydrophobicContact CE2-CD2 3.84Å; Y333-L543 HydrophobicContact CE2-CG 4.41Å; Y333-L543 HydrophobicContact CG-CD2 3.72Å; Y333-L543 PolarHBondContact OH-N 3.34Å; Y333-L543 PolarHBondContact OH-O 2.94Å
334	S	83.9	Confident	74.6	Confident	78 Å²	78	78.3 Å²	78.3	55%	0.545	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	144.4	-178.7	62.5	0	0	0	0	111.9	Y510	S334-Y510 WeakPolarHBondContact CA-O 3.43Å
335	N	78.4	Confident	75.3	Confident	48 Å²	48	77.4 Å²	77.4	26%	0.257	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	88.3	178	-159.8	-50.5	0	0	0	109.1	K337 K343 G509 Y510	N335-K337 VanDerWaalsContact C-N 3.26Å; N335-K337 PolarHBondContact O-N 2.81Å; N335-K343 PolarHBondContact OD1-NZ 2.77Å; N335-G509 WeakPolarHBondContact O-CA 3.37Å; N335-Y510 HydrophobicContact CB-CD1 4.42Å; N335-Y510 HydrophobicContact CB-CE1 3.96Å; N335-Y510 HydrophobicContact CB-CE2 4.05Å; N335-Y510 PolarHBondContact N-O 3.41Å; N335-Y510 PolarHBondContact O-N 3.12Å; N335-Y510 VanDerWaalsContact O-N 3.11Å
336	I	73.8	Confident	75.9	Confident	110 Å²	110	72.1 Å²	72.1	56%	0.564	38%	0.379	S	S	*	.			trans	-93.3	19.9	-172.1	-49.3	166.7	0	0	0	110.7	P338 I364	I336-P338 WeakPolarHBondContact O-CD 3.43Å; I336-I364 HydrophobicContact CG2-CD1 3.82Å
337	K	66.5	Low	76.4	Confident	160 Å²	160	70.8 Å²	70.8	70%	0.696	37%	0.37	S	S	*	.	S	Bend	trans	-92	111.5	172.8	-68.6	-174	-179.9	179.6	0	108.8	N335 S339 K343	N335-K337 VanDerWaalsContact C-N 3.26Å; N335-K337 PolarHBondContact O-N 2.81Å; K337-S339 PolarHBondContact O-N 3.02Å; K337-K343 PolarHBondContact O-NZ 2.92Å
338	P	60.4	Low	76.7	Confident	98 Å²	98	70.1 Å²	70.1	64%	0.636	37%	0.368	S	S	*	.			trans	-59.1	133	178.6	25.6	-34.1	0	0	0	109.6	I336 P507	I336-P338 WeakPolarHBondContact O-CD 3.43Å; P338-P507 CarbonylContact C-O 3.57Å; P338-P507 WeakPolarHBondContact CA-O 3.25Å; P338-P507 WeakPolarHBondContact CB-O 3.3Å
339	S	59	Low	77.2	Confident	31 Å²	31	66 Å²	66	22%	0.217	34%	0.339	C	S	.	.			trans	-163.8	132.8	180	178.6	0	0	0	0	108.8	K337 Q341 P507	K337-S339 PolarHBondContact O-N 3.02Å; S339-Q341 PolarHBondContact O-N 2.76Å; S339-Q341 PolarHBondContact OG-N 3.06Å; S339-P507 PolarHBondContact N-O 2.7Å
340	Y	61.2	Low	77.3	Confident	204 Å²	204	64.7 Å²	64.7	80%	0.8	33%	0.332	S	S	*	.	S	Bend	trans	-77.9	-9.1	174.1	-67.7	-85.5	0	0	0	112.9	P507	Y340-P507 HydrophobicContact CD1-CB 4.17Å; Y340-P507 HydrophobicContact CD1-CG 4.48Å; Y340-P507 HydrophobicContact CE1-CB 4.08Å
341	Q	64.7	Low	77	Confident	123 Å²	123	61.6 Å²	61.6	58%	0.575	31%	0.314	S	S	*	.	S	Bend	trans	-79.2	140.5	176.1	-67.8	173.7	-21.2	0	0	111.3	S339	S339-Q341 PolarHBondContact O-N 2.76Å; S339-Q341 PolarHBondContact OG-N 3.06Å
342	S	71.1	Confident	76.5	Confident	66 Å²	66	59 Å²	59	46%	0.462	30%	0.303	S	S	.	.			trans	-61.9	144.9	168.5	50.7	0	0	0	0	110.8	I504	S342-I504 CarbonylContact C-O 3.55Å; S342-I504 VanDerWaalsContact CA-O 3.31Å; S342-I504 WeakPolarHBondContact CA-O 3.38Å
343	K	80.3	Confident	76	Confident	44 Å²	44	57 Å²	57	19%	0.191	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	133.9	175.5	-67.2	175.6	-170	155.6	0	108.9	N335 K337 I504 Y510	N335-K343 PolarHBondContact OD1-NZ 2.77Å; K337-K343 PolarHBondContact O-NZ 2.92Å; K343-I504 PolarHBondContact N-O 2.93Å; K343-I504 PolarHBondContact O-N 3.48Å; K343-Y510 HydrophobicContact CB-CE1 4.48Å; K343-Y510 WeakPolarHBondContact CB-OH 3.26Å; K343-Y510 HydrophobicContact CD-CE1 4.04Å
344	V	85.1	Confident	75.9	Confident	51 Å²	51	55.2 Å²	55.2	31%	0.309	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	130.8	-178.8	-175.4	0	0	0	0	109.3	Y346 K501 L502 L503	V344-Y346 HydrophobicContact CG1-CD2 4.48Å; V344-Y346 HydrophobicContact CG1-CE2 3.83Å; V344-K501 HydrophobicContact CG1-CD 4.23Å; V344-K501 HydrophobicContact CG1-CG 3.71Å; V344-L502 CarbonylContact C-O 3.59Å; V344-L502 WeakPolarHBondContact CA-O 3.36Å; V344-L503 HydrophobicContact CG2-CD2 3.75Å; V344-L503 HydrophobicContact CG2-CG 4.45Å
345	H	86.4	Confident	75.8	Confident	25 Å²	25	51.5 Å²	51.5	12%	0.116	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	155	166.6	-67.4	-93.6	0	0	0	109.6	L502 Y510 L543	H345-L502 HydrophobicContact CB-CB 4.35Å; H345-L502 PolarHBondContact N-O 2.88Å; H345-L502 PolarHBondContact O-N 2.84Å; H345-Y510 AromaticContact NE2-CZ 3.93Å; H345-Y510 PolarHBondContact NE2-OH 2.84Å; H345-L543 HydrophobicContact CB-CD1 3.83Å; H345-L543 HydrophobicContact CB-CD2 4.26Å; H345-L543 HydrophobicContact CB-CG 4.06Å
346	Y	86	Confident	76.1	Confident	39 Å²	39	50.3 Å²	50.3	15%	0.153	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	141.3	170.7	-67.1	-95.5	0	0	0	109.5	V344 Y467 Y500 K501 L543 D544 Y546 I549	V344-Y346 HydrophobicContact CG1-CD2 4.48Å; V344-Y346 HydrophobicContact CG1-CE2 3.83Å; Y346-Y467 AromaticContact CD1-CD1 4Å; Y346-Y467 HydrophobicContact CD1-CD1 4Å; Y346-Y467 HydrophobicContact CD1-CE1 4.31Å; Y346-Y467 HydrophobicContact CD1-CG 4.12Å; Y346-Y467 AromaticContact CE1-CD1 4Å; Y346-Y467 HydrophobicContact CE1-CD1 4Å; Y346-Y467 AromaticContact CE1-CD2 3.82Å; Y346-Y467 HydrophobicContact CE1-CD2 3.82Å; Y346-Y467 HydrophobicContact CE1-CE1 4.07Å; Y346-Y467 AromaticContact CE1-CE2 3.89Å; Y346-Y467 HydrophobicContact CE1-CE2 3.89Å; Y346-Y467 AromaticContact CE1-CG 3.88Å; Y346-Y467 HydrophobicContact CE1-CG 3.88Å; Y346-Y500 CarbonylContact C-O 3.54Å; Y346-Y500 WeakPolarHBondContact CA-O 3.46Å; Y346-K501 HydrophobicContact CD1-CB 4.3Å; Y346-K501 HydrophobicContact CE1-CB 4.09Å; Y346-K501 HydrophobicContact CE1-CD 4.42Å; Y346-K501 HydrophobicContact CE1-CG 4.21Å; Y346-L543 VanDerWaalsContact O-CA 3.23Å; Y346-L543 WeakPolarHBondContact O-CA 3.26Å; Y346-L543 WeakPolarHBondContact O-CD1 3.28Å; Y346-D544 PolarHBondContact N-O 2.96Å; Y346-D544 PolarHBondContact O-N 3.26Å; Y346-D544 VanDerWaalsContact O-N 3.07Å; Y346-Y546 HydrophobicContact CD1-CD2 4.26Å; Y346-Y546 HydrophobicContact CD2-CD2 4.37Å; Y346-Y546 HydrophobicContact CE1-CD2 4.02Å; Y346-Y546 HydrophobicContact CE2-CD2 4.16Å; Y346-Y546 HydrophobicContact CE2-CG 4.43Å; Y346-Y546 HydrophobicContact CG-CD2 4.42Å; Y346-Y546 AromaticContact CZ-CD2 3.98Å; Y346-I549 VanDerWaalsContact C-CD1 3.45Å; Y346-I549 WeakPolarHBondContact O-CD1 3.48Å
347	L	86.3	Confident	76.8	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	111.8	177.6	173.6	62.3	0	0	0	109.3	I359 C499 Y500 L502 I514 V541 M542 L543	L347-I359 HydrophobicContact CD2-CD1 3.75Å; L347-I359 HydrophobicContact CD2-CG1 4.39Å; L347-C499 CarbonylContact O-C 3.58Å; L347-C499 WeakPolarHBondContact O-CA 3.43Å; L347-Y500 HydrophobicContact CD2-CD2 4.24Å; L347-Y500 HydrophobicContact CG-CD2 4.48Å; L347-Y500 PolarHBondContact N-O 2.92Å; L347-Y500 PolarHBondContact O-N 3.34Å; L347-L502 HydrophobicContact CB-CD1 3.45Å; L347-L502 VanDerWaalsContact CB-CD1 3.45Å; L347-L502 HydrophobicContact CD2-CD1 4.23Å; L347-L502 HydrophobicContact CG-CD1 4.5Å; L347-I514 HydrophobicContact CD1-CD1 4.01Å; L347-V541 HydrophobicContact CD1-CG1 3.58Å; L347-M542 CarbonylContact C-O 3.52Å; L347-M542 WeakPolarHBondContact CA-O 3.34Å; L347-L543 HydrophobicContact CB-CD1 3.83Å; L347-L543 HydrophobicContact CD1-CB 4.33Å; L347-L543 HydrophobicContact CD1-CD1 4.33Å
348	F	84.3	Confident	77.8	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.009	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	138.4	174.2	178.9	-106.9	0	0	0	111	D350 R497 Y498 V541 M542 I549 G553	F348-D350 HydrophobicContact CE1-CB 3.98Å; F348-D350 HydrophobicContact CZ-CB 4.01Å; F348-R497 HydrophobicContact CE2-CB 4.46Å; F348-R497 HydrophobicContact CE2-CG 4.45Å; F348-R497 HydrophobicContact CZ-CG 4.36Å; F348-Y498 WeakPolarHBondContact CA-O 3.46Å; F348-V541 CarbonylContact O-C 3.58Å; F348-V541 WeakPolarHBondContact O-CA 3.25Å; F348-M542 HydrophobicContact CB-CB 4.46Å; F348-M542 HydrophobicContact CD1-SD 4.16Å; F348-M542 PolarHBondContact N-O 3.04Å; F348-M542 PolarHBondContact O-N 3Å; F348-I549 HydrophobicContact CB-CD1 4.13Å; F348-I549 HydrophobicContact CB-CG1 4.21Å; F348-I549 HydrophobicContact CB-CG2 3.89Å; F348-G553 VanDerWaalsContact CE1-O 3.26Å; F348-G553 WeakPolarHBondContact CE1-O 3.41Å; F348-G553 VanDerWaalsContact CZ-O 3.27Å; F348-G553 WeakPolarHBondContact CZ-O 3.46Å
349	C	82.4	Confident	79.2	Confident	1 Å²	1	33 Å²	33	1%	0.007	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	128.3	172.3	178.7	0	0	0	0	109.6	I357 L493 R497 Y498 N540 V541	C349-I357 HydrophobicContact CB-CD1 3.91Å; C349-L493 HydrophobicContact CB-CD1 4.43Å; C349-R497 CarbonylContact O-C 3.59Å; C349-R497 VanDerWaalsContact O-CA 3.3Å; C349-R497 WeakPolarHBondContact O-CA 3.1Å; C349-Y498 PolarHBondContact N-O 2.86Å; C349-Y498 PolarHBondContact O-N 2.9Å; C349-N540 WeakPolarHBondContact CA-O 3.47Å; C349-V541 HydrophobicContact CB-CG2 4.36Å
350	D	78.6	Confident	80.6	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	112.1	166.8	-166.1	20.7	0	0	0	108.5	F348 R497 N540 L559 L560	F348-D350 HydrophobicContact CE1-CB 3.98Å; F348-D350 HydrophobicContact CZ-CB 4.01Å; D350-R497 HydrophobicContact CB-CG 4.06Å; D350-R497 WeakPolarHBondContact OD1-CG 3.07Å; D350-R497 IonicContact OD1-CZ 3.11Å; D350-R497 IonicContact OD1-NE 3.58Å; D350-R497 PolarHBondContact OD1-NE 3.44Å; D350-R497 IonicContact OD1-NH2 3.45Å; D350-R497 IonicContact OD2-CZ 3.67Å; D350-R497 VanDerWaalsContact OD2-CZ 3.23Å; D350-R497 IonicContact OD2-NE 2.66Å; D350-R497 PolarHBondContact OD2-NE 2.82Å; D350-R497 IonicContact OD2-NH2 2.94Å; D350-R497 PolarHBondContact OD2-NH2 3.29Å; D350-N540 PolarHBondContact N-O 3.08Å; D350-N540 PolarHBondContact O-N 3.16Å; D350-L559 WeakPolarHBondContact OD2-CB 3.46Å; D350-L559 PolarHBondContact OD2-N 2.98Å; D350-L560 WeakPolarHBondContact OD1-CB 3.47Å; D350-L560 PolarHBondContact OD2-N 2.83Å
351	S	77.9	Confident	81.8	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	125.1	-175.1	-167.2	0	0	0	0	112.3	Q353 S496	S351-Q353 VanDerWaalsContact C-N 3.26Å; S351-Q353 WeakPolarHBondContact CB-O 3.48Å; S351-Q353 PolarHBondContact O-N 2.83Å; S351-Q353 PolarHBondContact OG-O 2.9Å; S351-S496 PolarHBondContact N-O 2.86Å; S351-S496 PolarHBondContact O-N 2.82Å
352	I	71.8	Confident	82.8	Confident	18 Å²	18	20 Å²	20	9%	0.092	11%	0.108	C	C	.	.	S	Bend	trans	-76.7	-18.2	-179.7	-59.3	167	0	0	0	110.9	M531 S538 L559 L560 Y563	I352-M531 HydrophobicContact CG2-CE 3.98Å; I352-S538 PolarHBondContact N-O 2.72Å; I352-L559 HydrophobicContact CD1-CB 4.33Å; I352-L560 HydrophobicContact CG1-CD1 4.49Å; I352-Y563 HydrophobicContact CD1-CG 4.34Å; I352-Y563 HydrophobicContact CG1-CG 4.4Å; I352-Y563 HydrophobicContact CG2-CD1 3.73Å; I352-Y563 HydrophobicContact CG2-CD2 3.87Å; I352-Y563 HydrophobicContact CG2-CE1 3.93Å; I352-Y563 HydrophobicContact CG2-CE2 4.09Å; I352-Y563 HydrophobicContact CG2-CG 3.69Å
353	Q	74.8	Confident	83.4	Confident	39 Å²	39	17.7 Å²	17.7	18%	0.182	9%	0.09	C	C	.	.	S	Bend	trans	-127.7	156.5	176.9	-66.6	-175.3	7.9	0	0	111	S351 C355 I518	S351-Q353 VanDerWaalsContact C-N 3.26Å; S351-Q353 WeakPolarHBondContact CB-O 3.48Å; S351-Q353 PolarHBondContact O-N 2.83Å; S351-Q353 PolarHBondContact OG-O 2.9Å; Q353-C355 PolarHBondContact O-N 2.86Å; Q353-I518 HydrophobicContact CB-CG2 3.61Å; Q353-I518 HydrophobicContact CG-CG2 4.44Å; Q353-I518 VanDerWaalsContact OE1-CG2 3.26Å
354	P	80	Confident	83.2	Confident	23 Å²	23	19.2 Å²	19.2	15%	0.149	10%	0.1	C	C	.	.			trans	-55.6	132.2	173.2	-25.6	36.2	0	0	0	111.5	L493 F495 R519 I522	P354-L493 CarbonylContact C-O 3.56Å; P354-L493 WeakPolarHBondContact CA-O 3.17Å; P354-F495 HydrophobicContact CG-CD1 4.41Å; P354-R519 PolarHBondContact O-N 2.86Å; P354-I522 HydrophobicContact CG-CD1 4.25Å
355	C	82.8	Confident	82.4	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	169	-171.4	64.6	0	0	0	0	112.2	Q353 L493 R517 M539	Q353-C355 PolarHBondContact O-N 2.86Å; C355-L493 PolarHBondContact N-O 2.93Å; C355-L493 PolarHBondContact O-N 3.46Å; C355-R517 CarbonylContact C-O 3.53Å; C355-R517 VanDerWaalsContact CA-O 3.28Å; C355-R517 WeakPolarHBondContact CA-O 3.47Å; C355-R517 WeakPolarHBondContact CB-O 3.16Å; C355-M539 HydrophobicContact CB-CE 3.62Å; C355-M539 HydrophobicContact CB-SD 3.61Å
356	E	85.3	Confident	81	Confident	23 Å²	23	24 Å²	24	11%	0.107	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	126.9	175.4	-176.4	178.9	179.7	0	0	108.3	S490 L491 L492 R517 R519	E356-S490 VanDerWaalsContact CG-OG 3.28Å; E356-S490 WeakPolarHBondContact CG-OG 3.18Å; E356-S490 PolarHBondContact OE1-OG 3.3Å; E356-L491 WeakPolarHBondContact CA-O 3.24Å; E356-L492 HydrophobicContact CB-CD1 4.45Å; E356-R517 HydrophobicContact CB-CG 3.95Å; E356-R517 PolarHBondContact N-O 3.08Å; E356-R517 PolarHBondContact O-N 3.03Å; E356-R517 IonicContact OE2-CZ 2.73Å; E356-R517 IonicContact OE2-NE 2.74Å; E356-R517 PolarHBondContact OE2-NE 2.8Å; E356-R517 IonicContact OE2-NH2 3.85Å; E356-R517 PolarHBondContact OE2-NH2 2.96Å; E356-R519 IonicContact OE2-NH1 3.92Å
357	I	87.9	Confident	79.3	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.7	178.3	-57.7	-176.2	0	0	0	108	C349 I359 L491 L493 I514 L515 M539 V541	C349-I357 HydrophobicContact CB-CD1 3.91Å; I357-I359 HydrophobicContact CG2-CG1 4.18Å; I357-L491 PolarHBondContact N-O 2.78Å; I357-L491 PolarHBondContact O-N 3.03Å; I357-L493 HydrophobicContact CD1-CD1 3.65Å; I357-L493 HydrophobicContact CG1-CD1 4.1Å; I357-I514 HydrophobicContact CG2-CG2 3.59Å; I357-L515 WeakPolarHBondContact CA-O 3.47Å; I357-M539 HydrophobicContact CD1-CE 4.04Å; I357-M539 HydrophobicContact CG1-CE 3.65Å; I357-V541 HydrophobicContact CD1-CG1 4.38Å; I357-V541 HydrophobicContact CD1-CG2 3.91Å
358	I	87.2	Confident	77.3	Confident	4 Å²	4	37.7 Å²	37.7	2%	0.021	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	123.3	172.9	-49.8	-178.4	0	0	0	108.5	H322 Y327 I489 I514 L515	H322-I358 WeakPolarHBondContact CE1-CD1 3.49Å; Y327-I358 HydrophobicContact CE1-CD1 4.09Å; Y327-I358 WeakPolarHBondContact OH-CD1 3.44Å; I358-I489 CarbonylContact C-O 3.48Å; I358-I489 WeakPolarHBondContact CA-O 3.46Å; I358-I514 CarbonylContact O-C 3.51Å; I358-I514 WeakPolarHBondContact O-CA 3.45Å; I358-L515 HydrophobicContact CB-CB 4.25Å; I358-L515 PolarHBondContact N-O 2.81Å; I358-L515 PolarHBondContact O-N 2.73Å
359	I	89.7	Confident	74.8	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	103.5	177.2	-57.7	162.2	0	0	0	107	L347 I357 L462 I464 S488 I489 L491 L502 I512	L347-I359 HydrophobicContact CD2-CD1 3.75Å; L347-I359 HydrophobicContact CD2-CG1 4.39Å; I357-I359 HydrophobicContact CG2-CG1 4.18Å; I359-L462 HydrophobicContact CG2-CD2 3.88Å; I359-I464 HydrophobicContact CD1-CD1 3.59Å; I359-S488 CarbonylContact O-C 3.49Å; I359-S488 WeakPolarHBondContact O-CA 3.44Å; I359-I489 PolarHBondContact N-O 3.44Å; I359-I489 PolarHBondContact O-N 2.96Å; I359-L491 HydrophobicContact CD1-CD1 3.74Å; I359-L491 HydrophobicContact CD1-CG 4.42Å; I359-L502 HydrophobicContact CD1-CD2 4.42Å; I359-L502 HydrophobicContact CG2-CD2 4.29Å; I359-I512 HydrophobicContact CG2-CG2 3.81Å
360	Q	88.1	Confident	72.4	Confident	60 Å²	60	49.4 Å²	49.4	28%	0.28	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	122.2	171.9	178.5	-176.4	-27.2	0	0	109.2	S362 I512 T513	Q360-S362 PolarHBondContact NE2-OG 3.37Å; Q360-S362 VanDerWaalsContact NE2-OG 3.11Å; Q360-I512 CarbonylContact O-C 3.53Å; Q360-I512 WeakPolarHBondContact O-CA 3.38Å; Q360-T513 PolarHBondContact N-O 2.89Å; Q360-T513 PolarHBondContact O-N 2.85Å
361	L	86.9	Confident	70.3	Confident	1 Å²	1	57 Å²	57	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	123.6	166.3	-178.8	72.9	0	0	0	108.7	V363 L462 T483 S486 S487 I504 Y510 I512	L361-V363 HydrophobicContact CD1-CG1 4.15Å; L361-V363 HydrophobicContact CD2-CG1 3.7Å; L361-V363 HydrophobicContact CG-CG1 3.71Å; L361-L462 HydrophobicContact CB-CD2 4.41Å; L361-L462 HydrophobicContact CD2-CB 3.95Å; L361-T483 HydrophobicContact CD2-CG2 3.81Å; L361-T483 HydrophobicContact CG-CG2 4.36Å; L361-S486 WeakPolarHBondContact O-CA 3.41Å; L361-S487 PolarHBondContact N-O 3.1Å; L361-S487 PolarHBondContact O-N 2.73Å; L361-S487 VanDerWaalsContact O-O 3.13Å; L361-I504 HydrophobicContact CD1-CD1 4.35Å; L361-I504 HydrophobicContact CD1-CG2 4.23Å; L361-Y510 HydrophobicContact CD1-CD2 4.29Å; L361-Y510 HydrophobicContact CD1-CG 4.37Å; L361-I512 HydrophobicContact CD1-CG1 4.47Å
362	S	86	Confident	67.9	Low	25 Å²	25	61.2 Å²	61.2	18%	0.175	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	119.8	170.5	-69	0	0	0	0	108.7	Q360 G485 S486 Y510 V511	Q360-S362 PolarHBondContact NE2-OG 3.37Å; Q360-S362 VanDerWaalsContact NE2-OG 3.11Å; S362-G485 CarbonylContact C-O 3.53Å; S362-G485 WeakPolarHBondContact CA-O 3.47Å; S362-S486 VanDerWaalsContact CB-OG 3.29Å; S362-S486 WeakPolarHBondContact CB-OG 3.46Å; S362-S486 WeakPolarHBondContact OG-CB 3.36Å; S362-S486 PolarHBondContact OG-OG 3.33Å; S362-Y510 CarbonylContact O-C 3.56Å; S362-Y510 WeakPolarHBondContact O-CA 3.49Å; S362-V511 PolarHBondContact N-O 2.81Å; S362-V511 PolarHBondContact O-N 2.77Å
363	V	82.9	Confident	66.1	Low	17 Å²	17	69.3 Å²	69.3	10%	0.103	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	151.6	-174.6	-57.7	0	0	0	0	111.9	L361 T483 G485 A506	L361-V363 HydrophobicContact CD1-CG1 4.15Å; L361-V363 HydrophobicContact CD2-CG1 3.7Å; L361-V363 HydrophobicContact CG-CG1 3.71Å; V363-T483 HydrophobicContact CG1-CG2 3.89Å; V363-T483 HydrophobicContact CG2-CG2 3.87Å; V363-G485 PolarHBondContact N-O 3.42Å; V363-A506 HydrophobicContact CG1-CB 4.26Å
364	I	76.6	Confident	63.8	Low	76 Å²	76	78 Å²	78	39%	0.39	39%	0.388	S	S	.	.			trans	-83.7	121.4	166.4	-58.7	174.1	0	0	0	106.6	I336 L508 G509	I336-I364 HydrophobicContact CG2-CD1 3.82Å; I364-L508 HydrophobicContact CB-CB 3.96Å; I364-L508 HydrophobicContact CG2-CB 3.78Å; I364-L508 HydrophobicContact CG2-CD1 4.22Å; I364-L508 WeakPolarHBondContact O-CB 3.25Å; I364-G509 PolarHBondContact N-O 2.86Å
365	Y	67.6	Low	61.3	Low	60 Å²	60	85.2 Å²	85.2	24%	0.235	43%	0.425	C	S	.	.			trans	-125.1	142.5	176	-166.7	-96.3	0	0	0	109.2	W367 T457 T484	Y365-W367 PolarHBondContact O-N 3.47Å; Y365-T457 PolarHBondContact OH-O 3.06Å; Y365-T457 VanDerWaalsContact OH-O 3.09Å; Y365-T457 PolarHBondContact OH-OG1 3.39Å; Y365-T484 WeakPolarHBondContact CB-O 3.49Å; Y365-T484 HydrophobicContact CD1-CG2 4.43Å; Y365-T484 HydrophobicContact CD2-CG2 3.93Å; Y365-T484 HydrophobicContact CE1-CG2 4.18Å; Y365-T484 HydrophobicContact CE2-CG2 3.65Å; Y365-T484 HydrophobicContact CG-CG2 4.3Å
366	Q	58.5	Low	58.8	Low	115 Å²	115	89.9 Å²	89.9	54%	0.537	45%	0.453	S	S	.	.			trans	-75.9	110.6	176.2	-175.4	169.7	4.3	0	0	108.3	L508	Q366-L508 HydrophobicContact CB-CD1 4.01Å
367	W	49.8	Very low	56.1	Low	224 Å²	224	94.8 Å²	94.8	85%	0.848	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-52.1	128.5	168.9	-72	85.9	0	0	0	108.6	Y365 I369	Y365-W367 PolarHBondContact O-N 3.47Å; W367-I369 PolarHBondContact O-N 2.86Å; W367-I369 VanDerWaalsContact O-N 3.11Å
368	P	43.9	Very low	53.3	Low	104 Å²	104	100.9 Å²	100.9	68%	0.675	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-57.3	124.2	170.2	25.2	-32.5	0	0	0	106.8	P370	P368-P370 WeakPolarHBondContact O-CD 3.44Å
369	I	31.4	Very low	50.6	Low	137 Å²	137	105.8 Å²	105.8	70%	0.703	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-53.7	120.3	179.9	-60.2	173.7	0	0	0	106.1	W367 I371	W367-I369 PolarHBondContact O-N 2.86Å; W367-I369 VanDerWaalsContact O-N 3.11Å; I369-I371 PolarHBondContact O-N 3.27Å
370	P	31.9	Very low	47.6	Very low	111 Å²	111	117.5 Å²	117.5	72%	0.721	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-59.3	117.9	-177.9	23.3	-32.5	0	0	0	107.1	P368 A372	P368-P370 WeakPolarHBondContact O-CD 3.44Å; P370-A372 VanDerWaalsContact C-N 3.26Å; P370-A372 PolarHBondContact O-N 2.91Å
371	I	34.4	Very low	45	Very low	160 Å²	160	119 Å²	119	82%	0.821	62%	0.617	S	S	*	*			trans	-63.6	97.5	178	-61.7	175.4	0	0	0	106	I369 K373	I369-I371 PolarHBondContact O-N 3.27Å; I371-K373 VanDerWaalsContact C-N 3.27Å; I371-K373 PolarHBondContact O-N 3.28Å
372	A	29.3	Very low	42.3	Very low	88 Å²	88	131 Å²	131	73%	0.727	66%	0.663	S	S	*	*			trans	-65.4	93	177.7	0	0	0	0	0	107.3	P370 R374	P370-A372 VanDerWaalsContact C-N 3.26Å; P370-A372 PolarHBondContact O-N 2.91Å; A372-R374 PolarHBondContact O-N 2.88Å
373	K	32.1	Very low	39.5	Very low	189 Å²	189	133 Å²	133	82%	0.822	69%	0.688	S	S	*	*			trans	-46.8	116.9	166.2	-72.1	-174.7	175.7	-176.6	0	106.3	I371 L375	I371-K373 VanDerWaalsContact C-N 3.27Å; I371-K373 PolarHBondContact O-N 3.28Å; K373-L375 PolarHBondContact O-N 3.4Å
374	R	28.2	Very low	36.9	Very low	220 Å²	220	140.3 Å²	140.3	83%	0.83	73%	0.725	S	S	*	*			trans	-59.2	98.5	-174.1	-84.6	-174.9	174.6	177.1	-0.7	109.9	A372 T376	A372-R374 PolarHBondContact O-N 2.88Å; R374-T376 HydrophobicContact CB-CG2 4.32Å; R374-T376 PolarHBondContact O-N 2.6Å
375	L	26.3	Very low	34.6	Very low	176 Å²	176	142.5 Å²	142.5	92%	0.921	74%	0.742	S	S	*	*			trans	-77.1	64.1	154.7	-69.3	174.1	0	0	0	108.1	K373	K373-L375 PolarHBondContact O-N 3.4Å
376	T	30.2	Very low	32.7	Very low	98 Å²	98	145 Å²	145	60%	0.601	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-71.8	134.9	158.8	40.2	0	0	0	0	107.8	R374	R374-T376 HydrophobicContact CB-CG2 4.32Å; R374-T376 PolarHBondContact O-N 2.6Å
377	P	29.7	Very low	31	Very low	125 Å²	125	147.5 Å²	147.5	81%	0.812	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-64.6	159	-168.9	-23.6	34.5	0	0	0	114.4
378	T	27.8	Very low	30.7	Very low	128 Å²	128	141.3 Å²	141.3	79%	0.785	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-56.1	146.8	162.2	49.2	0	0	0	0	111.4
379	T	30.6	Very low	29.9	Very low	107 Å²	107	145 Å²	145	66%	0.656	78%	0.777	S	S	*	*				174.6	121.3	106.5	-66.3	0	0	0	0	109.8	S381	T379-S381 WeakPolarHBondContact CG2-OG 3.45Å
380	Y	28.2	Very low	29.9	Very low	247 Å²	247	143.5 Å²	143.5	97%	0.969	78%	0.775	S	S	*	*			trans	-102.4	114.1	158	-112.3	-73	0	0	0	108.2
381	S	32.1	Very low	29.7	Very low	90 Å²	90	144.5 Å²	144.5	63%	0.629	77%	0.774	S	S	*	*			trans	-148.4	90.6	172.7	63.8	0	0	0	0	112.1	T379	T379-S381 WeakPolarHBondContact CG2-OG 3.45Å
382	R	30.2	Very low	29.6	Very low	255 Å²	255	143.9 Å²	143.9	96%	0.962	77%	0.773	S	S	*	*			trans	61	128.4	157.9	-61.6	176.4	169.9	171.8	-4.5	118.5
383	G	27.7	Very low	29.6	Very low	67 Å²	67	145.2 Å²	145.2	69%	0.691	77%	0.771	S	S	*	*			trans	166	51.4	156.9	0	0	0	0	0	119.8
384	L	28.1	Very low	29.3	Very low	169 Å²	169	141.9 Å²	141.9	89%	0.885	77%	0.767	S	S	*	*			trans	66.9	149	164.3	-48.9	162	0	0	0	114.5
385	T	28.6	Very low	29.4	Very low	123 Å²	123	137.6 Å²	137.6	76%	0.755	77%	0.765	S	S	*	*			cis	-161.1	160	-13.2	13	0	0	0	0	106.4
386	C	28.1	Very low	29.2	Very low	111 Å²	111	137.1 Å²	137.1	75%	0.75	76%	0.76	S	S	*	*			cis	-135.2	-129.4	3.4	-159.1	0	0	0	0	110.5
387	M	23.2	Very low	29.7	Very low	168 Å²	168	137 Å²	137	83%	0.828	76%	0.761	S	S	*	*			trans	-142.5	172.9	-177.6	-84.9	-78.3	90.5	0	0	111.9
388	P	41.8	Very low	29.7	Very low	95 Å²	95	137.3 Å²	137.3	62%	0.617	76%	0.761	S	S	*	*			trans	-116.5	179.7	-165.9	44	-34.5	0	0	0	115.3
389	E	29.1	Very low	29.6	Very low	180 Å²	180	137.9 Å²	137.9	84%	0.841	76%	0.759	S	S	*	*			trans	-135.1	129.9	158.1	-80.4	153.2	-175.8	0	0	105
390	T	29.5	Very low	29.5	Very low	107 Å²	107	138.6 Å²	138.6	66%	0.656	76%	0.755	S	S	*	*			cis	80.7	147.6	45.7	78.4	0	0	0	0	112.6
391	D	29.4	Very low	29.5	Very low	132 Å²	132	136.8 Å²	136.8	71%	0.706	75%	0.746	S	S	*	*			cis	-148.9	-178.9	20.5	-89.9	-65.4	0	0	0	114
392	D	30.7	Very low	29.2	Very low	147 Å²	147	136.8 Å²	136.8	79%	0.786	75%	0.746	S	S	*	*			trans	71	147.7	152.3	-71.4	-14.5	0	0	0	121.9
393	V	29.7	Very low	28.9	Very low	115 Å²	115	130.1 Å²	130.1	70%	0.697	74%	0.739	S	S	*	*			cis	-155.3	147.5	-5.5	113.6	0	0	0	0	113.5
394	V	26.2	Very low	28.9	Very low	120 Å²	120	133.8 Å²	133.8	73%	0.727	74%	0.741	S	S	*	*			trans	11	136.4	151.9	-169.1	0	0	0	0	119.7
395	T	29.9	Very low	28.8	Very low	130 Å²	130	132.6 Å²	132.6	80%	0.798	73%	0.731	S	S	*	*				-175.4	166.3	89.9	-48.6	0	0	0	0	114
396	M	22.8	Very low	28.7	Very low	166 Å²	166	135.5 Å²	135.5	82%	0.818	73%	0.733	S	S	*	*			trans	-139.9	-174.4	-175.5	-89.5	-88	-83.6	0	0	109.4
397	P	40.4	Very low	28.5	Very low	94 Å²	94	137.1 Å²	137.1	61%	0.61	73%	0.734	S	S	*	*			cis	-134.1	-151.5	-30.5	29.6	-4.7	0	0	0	112.8
398	T	29.1	Very low	28.8	Very low	133 Å²	133	135 Å²	135	82%	0.816	73%	0.732	S	S	*	*			trans	88.8	150.2	157.9	69.9	0	0	0	0	120.4
399	N	25.8	Very low	27.9	Very low	140 Å²	140	134.1 Å²	134.1	75%	0.749	73%	0.725	S	S	*	*			cis	-167.3	171.4	-32	-166.9	21.4	0	0	0	111
400	E	28.6	Very low	27.7	Very low	121 Å²	121	129 Å²	129	57%	0.565	71%	0.706	S	S	*	*			trans	86.8	127	155.6	-60.4	-154.6	-176.6	0	0	124.4
401	R	29.3	Very low	27.4	Very low	209 Å²	209	129.4 Å²	129.4	79%	0.789	71%	0.709	S	S	*	*			trans	64.5	154.6	137.3	-73.6	178.5	164.4	130	-8.7	122.1
402	S	25.5	Very low	27.3	Very low	90 Å²	90	129 Å²	129	63%	0.629	71%	0.711	S	S	*	*			cis	-175.9	126.3	-38	50.7	0	0	0	0	112.8
403	S	24.3	Very low	27	Very low	115 Å²	115	127.4 Å²	127.4	80%	0.804	71%	0.712	S	S	*	*			trans	65	155.4	155	-44.1	0	0	0	0	117.1
404	I	27.1	Very low	26.9	Very low	145 Å²	145	126.3 Å²	126.3	74%	0.744	71%	0.714	S	S	*	*			cis	-159.5	134.6	41.5	-94.3	-174.7	0	0	0	110.7
405	H	25.9	Very low	26.9	Very low	143 Å²	143	125.6 Å²	125.6	66%	0.662	72%	0.715	S	S	*	*			trans	57.8	159.6	150.5	-69.2	-122.7	0	0	0	121.2
406	F	25.7	Very low	26.9	Very low	185 Å²	185	128.8 Å²	128.8	81%	0.811	72%	0.718	S	S	*	*			cis	-147.9	163.1	3.1	-111.5	-55.8	0	0	0	111.5
407	L	24.6	Very low	27.2	Very low	145 Å²	145	126.2 Å²	126.2	76%	0.759	71%	0.711	S	S	*	*			trans	-109.4	151.8	164.8	-82.9	164.4	0	0	0	109.4	V409	L407-V409 HydrophobicContact CD2-CG2 4.38Å
408	P	29.3	Very low	26.6	Very low	122 Å²	122	131.3 Å²	131.3	79%	0.792	72%	0.718	S	S	*	*				-147.4	-167.4	83.2	29.7	-6.5	0	0	0	114.3
409	V	23.6	Very low	26.5	Very low	77 Å²	77	131.2 Å²	131.2	47%	0.467	71%	0.713	S	S	.	*			cis	153	103.6	-42.1	162.8	0	0	0	0	113.5	L407	L407-V409 HydrophobicContact CD2-CG2 4.38Å
410	T	23.8	Very low	26.7	Very low	73 Å²	73	131 Å²	131	45%	0.448	71%	0.712	S	S	.	*			trans	74.5	130.3	146.4	58.2	0	0	0	0	127	L74	L74-T410 HydrophobicContact CB-CG2 4.18Å; L74-T410 HydrophobicContact CD2-CG2 3.95Å; L74-T410 HydrophobicContact CG-CG2 4.4Å
411	T	24.5	Very low	26.8	Very low	115 Å²	115	131.6 Å²	131.6	71%	0.706	72%	0.719	S	S	*	*				79.8	111.9	129.4	53.3	0	0	0	0	127
412	T	26	Very low	26.6	Very low	124 Å²	124	126.2 Å²	126.2	76%	0.761	71%	0.713	S	S	*	*				54.3	125.6	128.6	56.9	0	0	0	0	126.3
413	S	25.6	Very low	27	Very low	114 Å²	114	130.2 Å²	130.2	80%	0.797	72%	0.722	S	S	*	*				89.5	101.8	129.1	-63.3	0	0	0	0	124.7
414	A	26.3	Very low	27.2	Very low	91 Å²	91	127.6 Å²	127.6	75%	0.752	70%	0.703	S	S	*	*				81.2	120.1	124.9	0	0	0	0	0	125
415	S	26	Very low	27.3	Very low	105 Å²	105	123.1 Å²	123.1	73%	0.734	68%	0.679	S	S	*	*			trans	95.1	121.8	135.8	72.4	0	0	0	0	123.2
416	F	29.8	Very low	27.4	Very low	198 Å²	198	120.4 Å²	120.4	87%	0.868	67%	0.67	S	S	*	*			trans	31.9	144.1	144.9	-62.3	-67.7	0	0	0	122.2
417	V	29.3	Very low	27.5	Very low	111 Å²	111	115.3 Å²	115.3	67%	0.673	65%	0.651	S	S	*	*			cis	-167.8	147.5	-18.6	96.8	0	0	0	0	106
418	R	28.6	Very low	27.8	Very low	202 Å²	202	110.1 Å²	110.1	76%	0.762	63%	0.627	S	S	*	*				175.1	142.4	86.4	-174.5	165	-76.3	-145.5	-2.2	110.5
419	D	27.7	Very low	28.3	Very low	131 Å²	131	107.3 Å²	107.3	70%	0.701	61%	0.608	S	S	*	*			trans	37.7	137.4	155.7	-44.2	-18.7	0	0	0	119.4
420	D	29.9	Very low	28.6	Very low	136 Å²	136	109.6 Å²	109.6	73%	0.727	62%	0.618	S	S	*	*			cis	-149.4	153.5	41	-120.8	-36.2	0	0	0	114.3
421	N	29.4	Very low	29	Very low	133 Å²	133	112.1 Å²	112.1	71%	0.711	63%	0.629	S	S	*	*			trans	43.4	113.3	156.8	-59.7	-57.6	0	0	0	120
422	S	26.7	Very low	29.3	Very low	96 Å²	96	113 Å²	113	67%	0.671	63%	0.628	S	S	*	*				165.9	165.5	55.2	49.2	0	0	0	0	112.8
423	H	32.5	Very low	29.4	Very low	174 Å²	174	114.3 Å²	114.3	81%	0.806	63%	0.626	S	S	*	*			trans	70.1	158.2	170.1	-66.1	-67.7	0	0	0	120
424	S	29.2	Very low	29.4	Very low	60 Å²	60	113.7 Å²	113.7	42%	0.42	62%	0.622	S	S	.	*			trans	-152.2	164.2	-149.3	56.7	0	0	0	0	116.7	K1617	S424-K1617 PolarHBondContact O-NZ 3.19Å
425	Q	29.9	Very low	29.5	Very low	50 Å²	50	115 Å²	115	23%	0.234	62%	0.621	C	S	.	*			trans	73	136.3	154.1	-80.3	142.2	-32.7	0	0	120	E1614 K1617	Q425-E1614 HydrophobicContact CG-CG 3.95Å; Q425-E1614 PolarHBondContact NE2-OE1 2.83Å; Q425-K1617 HydrophobicContact CB-CD 4.45Å; Q425-K1617 WeakPolarHBondContact O-CE 3.41Å; Q425-K1617 PolarHBondContact O-NZ 3.35Å
426	N	27.1	Very low	29.5	Very low	87 Å²	87	115.9 Å²	115.9	47%	0.465	62%	0.622	S	S	.	*				35.2	152.7	97.9	-47.6	5.2	0	0	0	116.6	K1617	N426-K1617 WeakPolarHBondContact O-CD 3.43Å; N426-K1617 WeakPolarHBondContact O-CE 3.42Å; N426-K1617 VanDerWaalsContact O-CG 3.29Å; N426-K1617 WeakPolarHBondContact O-CG 3.45Å
427	N	28.4	Very low	29.5	Very low	77 Å²	77	112.5 Å²	112.5	41%	0.412	62%	0.621	S	S	.	*			cis	-164.8	153.5	-12.4	-97.5	-2.6	0	0	0	106.2	E1618 Q1621	N427-E1618 HydrophobicContact CB-CG 3.52Å; N427-E1618 WeakPolarHBondContact CB-OE1 3.38Å; N427-E1618 PolarHBondContact ND2-OE1 3.48Å; N427-E1618 VanDerWaalsContact O-CA 3.31Å; N427-E1618 WeakPolarHBondContact O-CA 3.33Å; N427-E1618 WeakPolarHBondContact O-CG 3.49Å; N427-Q1621 VanDerWaalsContact C-CD 3.44Å; N427-Q1621 PolarHBondContact O-NE2 3.47Å
428	S	30	Very low	29.3	Very low	37 Å²	37	110.7 Å²	110.7	26%	0.259	63%	0.625	S	S	.	*			trans	169.9	163.5	131.2	-109.3	0	0	0	0	112.8	E1618 Q1621	S428-E1618 WeakPolarHBondContact CB-O 3.4Å; S428-E1618 VanDerWaalsContact OG-CA 3.28Å; S428-E1618 WeakPolarHBondContact OG-CA 3.34Å; S428-E1618 WeakPolarHBondContact OG-CB 3.47Å; S428-E1618 PolarHBondContact OG-O 2.99Å; S428-Q1621 VanDerWaalsContact CB-CB 3.49Å
429	P	39.7	Very low	29.3	Very low	62 Å²	62	109.3 Å²	109.3	40%	0.403	63%	0.631	S	S	.	*			trans	-123.6	-166.2	-160.3	45.9	-33.4	0	0	0	115.3	N1625	P429-N1625 PolarHBondContact O-ND2 3.35Å
430	D	30.9	Very low	29	Very low	126 Å²	126	110.2 Å²	110.2	67%	0.674	64%	0.636	S	S	*	*			trans	64.9	155.2	154.3	-54.3	-25	0	0	0	118.7
431	D	31.7	Very low	29.3	Very low	126 Å²	126	108.3 Å²	108.3	67%	0.674	63%	0.631	S	S	*	*			cis	-155.8	160.3	15	-147	-7	0	0	0	115.1
432	L	29.9	Very low	29.1	Very low	132 Å²	132	106.8 Å²	106.8	69%	0.691	63%	0.631	S	S	*	*			trans	62	159.7	157.9	-55.7	169.5	0	0	0	120.2
433	Q	29.1	Very low	29.1	Very low	152 Å²	152	108 Å²	108	71%	0.71	63%	0.634	S	S	*	*			cis	-158.4	134.1	-0.8	-135.8	168.7	56.9	0	0	115.3
434	S	26	Very low	28.7	Very low	102 Å²	102	107.5 Å²	107.5	71%	0.713	63%	0.632	S	S	*	*			trans	64.9	167.9	151.7	90.8	0	0	0	0	119.7
435	T	28	Very low	28.5	Very low	119 Å²	119	110.2 Å²	110.2	73%	0.73	65%	0.646	S	S	*	*			cis	-147.3	142.5	7.5	1.3	0	0	0	0	112.9
436	T	25.5	Very low	28.3	Very low	123 Å²	123	113.3 Å²	113.3	76%	0.755	67%	0.673	S	S	*	*			trans	44.9	115.8	139.5	-45.6	0	0	0	0	123.2
437	C	29.4	Very low	28.2	Very low	126 Å²	126	114.8 Å²	114.8	85%	0.851	69%	0.69	S	S	*	*				176.6	113.7	118.3	-106.7	0	0	0	0	116.1
438	G	24.9	Very low	28.1	Very low	74 Å²	74	116.6 Å²	116.6	76%	0.763	71%	0.709	S	S	*	*			trans	62.4	153.1	142.9	0	0	0	0	0	121.7
439	I	28.6	Very low	28	Very low	172 Å²	172	121.2 Å²	121.2	88%	0.882	74%	0.736	S	S	*	*			cis	-146.2	150.4	1.9	-67	-174.8	0	0	0	109.7
440	N	23.1	Very low	27.4	Very low	150 Å²	150	124 Å²	124	80%	0.802	76%	0.757	S	S	*	*			trans	-121.6	172.7	171.9	-121	-13.7	0	0	0	108.4
441	P	35.5	Very low	27.3	Very low	96 Å²	96	123.7 Å²	123.7	62%	0.623	76%	0.764	S	S	*	*			cis	-137.3	-173	-23.2	36.5	-15.7	0	0	0	113.8
442	S	24.8	Very low	27.1	Very low	101 Å²	101	123.8 Å²	123.8	71%	0.706	78%	0.775	S	S	*	*			trans	28.4	139.4	145.7	65.6	0	0	0	0	123.8
443	V	26.7	Very low	27.2	Very low	121 Å²	121	123 Å²	123	73%	0.733	78%	0.781	S	S	*	*				178.7	131.5	117.4	143.5	0	0	0	0	114.9
444	Q	25.4	Very low	27.4	Very low	165 Å²	165	121.3 Å²	121.3	77%	0.771	79%	0.786	S	S	*	*			trans	60	145.3	151.8	-72.5	175.3	14.5	0	0	126.4
445	T	24.3	Very low	28	Very low	117 Å²	117	122.1 Å²	122.1	72%	0.718	79%	0.791	S	S	*	*			trans	63.7	101.7	147.4	48.5	0	0	0	0	122.1
446	S	26.2	Very low	29.1	Very low	114 Å²	114	121.3 Å²	121.3	80%	0.797	79%	0.79	S	S	*	*			trans	11.8	109.2	130.7	59.4	0	0	0	0	119.5
447	S	23.9	Very low	30.7	Very low	119 Å²	119	117.9 Å²	117.9	83%	0.832	77%	0.77	S	S	*	*				-162.8	165.1	123	52.8	0	0	0	0	111
448	S	27.3	Very low	32.3	Very low	115 Å²	115	115.8 Å²	115.8	80%	0.804	75%	0.754	S	S	*	*			trans	-84.9	115.5	-173.9	54.2	0	0	0	0	113
449	T	26.9	Very low	34.5	Very low	133 Å²	133	114.9 Å²	114.9	82%	0.816	74%	0.735	S	S	*	*			trans	-150.1	136.3	149.6	13.5	0	0	0	0	112
450	S	26.4	Very low	37.1	Very low	121 Å²	121	106.8 Å²	106.8	85%	0.846	69%	0.693	S	S	*	*			trans	-53.3	130.1	-179.3	50.5	0	0	0	0	115.9
451	S	30	Very low	40.1	Very low	119 Å²	119	100.3 Å²	100.3	83%	0.832	66%	0.66	S	S	*	*			trans	-131.2	149.3	143	65.9	0	0	0	0	108.8
452	S	26.6	Very low	42.6	Very low	128 Å²	128	95.8 Å²	95.8	90%	0.895	63%	0.63	S	S	*	*			trans	-107.3	110.7	-163.4	56	0	0	0	0	113.3
453	S	31.9	Very low	45.6	Very low	116 Å²	116	93 Å²	93	81%	0.811	61%	0.608	S	S	*	*			trans	-116.9	141.8	158	57.7	0	0	0	0	109.5	S455	S453-S455 PolarHBondContact O-N 3.11Å
454	S	34.4	Very low	48.6	Very low	117 Å²	117	87.3 Å²	87.3	82%	0.818	57%	0.573	S	S	*	*			trans	-85.1	107.2	-168.8	53	0	0	0	0	112.3	S456	S454-S456 PolarHBondContact O-N 2.97Å
455	S	37.3	Very low	51.6	Low	118 Å²	118	79.5 Å²	79.5	83%	0.825	54%	0.537	S	S	*	.			trans	-72	85.6	169.9	48.8	0	0	0	0	111.5	S453 T457	S453-S455 PolarHBondContact O-N 3.11Å; S455-T457 PolarHBondContact O-N 3.19Å
456	S	52.5	Low	54.4	Low	102 Å²	102	76 Å²	76	71%	0.713	52%	0.515	S	S	*	.			trans	-68.2	113.5	167.8	53.5	0	0	0	0	109.7	S454	S454-S456 PolarHBondContact O-N 2.97Å
457	T	58	Low	56.8	Low	52 Å²	52	71.7 Å²	71.7	32%	0.319	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-60.9	139	166.4	37.2	0	0	0	0	109.4	Y365 S455	Y365-T457 PolarHBondContact OH-O 3.06Å; Y365-T457 VanDerWaalsContact OH-O 3.09Å; Y365-T457 PolarHBondContact OH-OG1 3.39Å; S455-T457 PolarHBondContact O-N 3.19Å
458	P	64.6	Low	58.9	Low	81 Å²	81	71.9 Å²	71.9	53%	0.526	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-62.7	145.7	-178.9	24.8	-33.5	0	0	0	110.8
459	P	69.8	Low	60.6	Low	56 Å²	56	69.4 Å²	69.4	36%	0.364	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-61	148	175.3	28	-34.7	0	0	0	110.2	E482 T484	P459-E482 HydrophobicContact CB-CB 4.29Å; P459-E482 HydrophobicContact CB-CG 4.38Å; P459-E482 HydrophobicContact CG-CG 4.27Å; P459-T484 HydrophobicContact CB-CG2 4.44Å
460	S	82.8	Confident	61.8	Low	1 Å²	1	67.4 Å²	67.4	1%	0.007	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	135.9	176.9	-58.5	0	0	0	0	109.5	E482 T483 T505	S460-E482 CarbonylContact O-C 3.55Å; S460-E482 WeakPolarHBondContact O-CA 3.49Å; S460-T483 WeakPolarHBondContact CB-O 3.36Å; S460-T483 PolarHBondContact N-O 3.44Å; S460-T483 PolarHBondContact O-N 2.81Å; S460-T505 CarbonylContact C-O 3.54Å; S460-T505 VanDerWaalsContact CA-O 3.23Å; S460-T505 WeakPolarHBondContact CA-O 3.2Å; S460-T505 WeakPolarHBondContact CB-O 3.47Å
461	S	86.8	Confident	63	Low	14 Å²	14	67.9 Å²	67.9	10%	0.098	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	153	-174.4	74.8	0	0	0	0	114.7	Y480 V481 I504 T505	S461-Y480 VanDerWaalsContact CB-OH 3.27Å; S461-Y480 WeakPolarHBondContact CB-OH 3.46Å; S461-V481 CarbonylContact C-O 3.59Å; S461-V481 VanDerWaalsContact CA-O 3.25Å; S461-V481 WeakPolarHBondContact CA-O 3.41Å; S461-I504 CarbonylContact O-C 3.59Å; S461-I504 WeakPolarHBondContact O-CA 3.43Å; S461-T505 PolarHBondContact N-O 2.91Å; S461-T505 PolarHBondContact N-OG1 2.82Å; S461-T505 PolarHBondContact O-N 2.82Å; S461-T505 PolarHBondContact OG-OG1 2.92Å
462	L	88.1	Confident	64.1	Low	1 Å²	1	66.7 Å²	66.7	1%	0.005	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	120.4	169.5	162	64.1	0	0	0	108.7	I359 L361 I464 Y480 V481 I489 L502 L503 I504	I359-L462 HydrophobicContact CG2-CD2 3.88Å; L361-L462 HydrophobicContact CB-CD2 4.41Å; L361-L462 HydrophobicContact CD2-CB 3.95Å; L462-I464 HydrophobicContact CD1-CG1 4.1Å; L462-I464 HydrophobicContact CG-CG1 4.21Å; L462-Y480 CarbonylContact O-C 3.57Å; L462-Y480 WeakPolarHBondContact O-CA 3.39Å; L462-V481 PolarHBondContact N-O 3.45Å; L462-V481 PolarHBondContact O-N 3.3Å; L462-I489 HydrophobicContact CD2-CD1 3.86Å; L462-I489 HydrophobicContact CG-CD1 4.2Å; L462-L502 HydrophobicContact CD1-CB 3.97Å; L462-L502 HydrophobicContact CD1-CD2 4.06Å; L462-L502 HydrophobicContact CD1-CG 4.06Å; L462-L503 WeakPolarHBondContact CA-O 3.5Å; L462-I504 HydrophobicContact CB-CG1 4.42Å; L462-I504 HydrophobicContact CD1-CD1 4.26Å; L462-I504 HydrophobicContact CD1-CG1 3.71Å
463	L	88.3	Confident	65.4	Low	44 Å²	44	65.9 Å²	65.9	23%	0.23	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	134.6	168.7	179.9	65.7	0	0	0	109.6	E465 P477 Y480 L502 L503	L463-E465 HydrophobicContact CD2-CG 4.37Å; L463-E465 HydrophobicContact CG-CG 4.41Å; L463-P477 HydrophobicContact CD1-CB 3.87Å; L463-Y480 HydrophobicContact CB-CD2 3.99Å; L463-Y480 HydrophobicContact CD1-CD2 3.99Å; L463-L502 WeakPolarHBondContact O-CA 3.29Å; L463-L503 HydrophobicContact CB-CB 4.2Å; L463-L503 HydrophobicContact CD2-CD1 4.1Å; L463-L503 PolarHBondContact N-O 3.03Å; L463-L503 PolarHBondContact O-N 2.84Å
464	I	89	Confident	66.6	Low	0 Å²	0	67.3 Å²	67.3	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	113.9	176.1	-52.1	-179.3	0	0	0	108.7	I359 L462 I478 K479 I489 L491 Y500 L502	I359-I464 HydrophobicContact CD1-CD1 3.59Å; L462-I464 HydrophobicContact CD1-CG1 4.1Å; L462-I464 HydrophobicContact CG-CG1 4.21Å; I464-I478 HydrophobicContact CG2-CD1 4.33Å; I464-I478 PolarHBondContact O-N 3.41Å; I464-K479 PolarHBondContact N-O 3.33Å; I464-I489 HydrophobicContact CD1-CD1 3.81Å; I464-I489 HydrophobicContact CD1-CG2 4.15Å; I464-I489 HydrophobicContact CG1-CD1 4.35Å; I464-L491 HydrophobicContact CD1-CD1 4.37Å; I464-Y500 HydrophobicContact CG2-CD1 4.39Å; I464-Y500 HydrophobicContact CG2-CG 4.22Å; I464-L502 HydrophobicContact CG1-CG 4.43Å
465	E	88.1	Confident	68	Low	2 Å²	2	62.4 Å²	62.4	1%	0.009	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	151.2	174.2	-67.2	176.8	164.9	0	0	110.9	L463 Q474 G475 Y500 K501 L503	L463-E465 HydrophobicContact CD2-CG 4.37Å; L463-E465 HydrophobicContact CG-CG 4.41Å; E465-Q474 WeakPolarHBondContact OE1-CG 3.4Å; E465-Q474 PolarHBondContact OE1-NE2 2.76Å; E465-G475 WeakPolarHBondContact CB-O 3.35Å; E465-Y500 VanDerWaalsContact O-CA 3.32Å; E465-Y500 WeakPolarHBondContact O-CA 3.4Å; E465-K501 HydrophobicContact CB-CB 4.28Å; E465-K501 PolarHBondContact N-O 3.22Å; E465-K501 PolarHBondContact O-N 2.86Å; E465-K501 IonicContact OE1-NZ 2.7Å; E465-K501 VanDerWaalsContact OE2-CD 3.25Å; E465-K501 WeakPolarHBondContact OE2-CD 3.35Å; E465-K501 VanDerWaalsContact OE2-CE 3.27Å; E465-K501 WeakPolarHBondContact OE2-CE 3.29Å; E465-K501 IonicContact OE2-NZ 3.39Å; E465-K501 PolarHBondContact OE2-NZ 3.03Å; E465-L503 HydrophobicContact CG-CD1 4.23Å; E465-L503 WeakPolarHBondContact OE1-CD1 3.39Å
466	T	83.6	Confident	69.8	Low	42 Å²	42	62.8 Å²	62.8	26%	0.258	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	151.5	162.3	57.4	0	0	0	0	110.5	G475 D476 I478	T466-G475 WeakPolarHBondContact O-CA 3.37Å; T466-G475 VanDerWaalsContact OG1-C 3.3Å; T466-G475 VanDerWaalsContact OG1-CA 3.29Å; T466-G475 WeakPolarHBondContact OG1-CA 3.17Å; T466-D476 PolarHBondContact N-O 3.47Å; T466-D476 PolarHBondContact OG1-N 3.18Å; T466-I478 HydrophobicContact CG2-CD1 3.54Å; T466-I478 HydrophobicContact CG2-CG1 3.79Å
467	Y	76.7	Confident	71.1	Confident	24 Å²	24	62.4 Å²	62.4	9%	0.094	34%	0.339	C	S	.	.			trans	-141.2	130.4	174.2	-174.8	-98.4	0	0	0	113.2	Y346 W469 C499 Y546	Y346-Y467 AromaticContact CD1-CD1 4Å; Y346-Y467 HydrophobicContact CD1-CD1 4Å; Y346-Y467 HydrophobicContact CD1-CE1 4.31Å; Y346-Y467 HydrophobicContact CD1-CG 4.12Å; Y346-Y467 AromaticContact CE1-CD1 4Å; Y346-Y467 HydrophobicContact CE1-CD1 4Å; Y346-Y467 AromaticContact CE1-CD2 3.82Å; Y346-Y467 HydrophobicContact CE1-CD2 3.82Å; Y346-Y467 HydrophobicContact CE1-CE1 4.07Å; Y346-Y467 AromaticContact CE1-CE2 3.89Å; Y346-Y467 HydrophobicContact CE1-CE2 3.89Å; Y346-Y467 AromaticContact CE1-CG 3.88Å; Y346-Y467 HydrophobicContact CE1-CG 3.88Å; Y467-W469 HydrophobicContact CE1-CB 4.14Å; Y467-C499 HydrophobicContact CD1-CB 4.42Å; Y467-C499 PolarHBondContact N-O 3.24Å; Y467-Y546 HydrophobicContact CE1-CD2 4.35Å; Y467-Y546 AromaticContact CE1-CE2 3.72Å; Y467-Y546 HydrophobicContact CE1-CE2 3.72Å; Y467-Y546 AromaticContact CZ-CE2 3.77Å; Y467-Y546 VanDerWaalsContact OH-CE2 3.22Å; Y467-Y546 WeakPolarHBondContact OH-CE2 3.31Å
468	H	68.6	Low	72.3	Confident	124 Å²	124	63.2 Å²	63.2	57%	0.574	34%	0.341	S	S	*	.			trans	-113.6	108.9	176.1	-78.9	-52.2	0	0	0	110.7	N470 K471	H468-N470 PolarHBondContact O-N 3.4Å; H468-K471 HydrophobicContact CB-CB 4.35Å; H468-K471 PolarHBondContact O-N 2.73Å
469	W	63	Low	73.3	Confident	63 Å²	63	63.9 Å²	63.9	24%	0.239	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-16.3	-177.8	61.2	79.8	0	0	0	115.5	Y467 C499 I554	Y467-W469 HydrophobicContact CE1-CB 4.14Å; W469-C499 HydrophobicContact CE3-CB 4.28Å; W469-C499 HydrophobicContact CZ3-CB 4.48Å; W469-I554 HydrophobicContact CB-CD1 4Å; W469-I554 HydrophobicContact CD2-CD1 3.69Å; W469-I554 HydrophobicContact CE3-CD1 4.2Å; W469-I554 HydrophobicContact CG-CD1 3.57Å
470	N	51.8	Low	74.1	Confident	90 Å²	90	66.9 Å²	66.9	48%	0.481	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	3.7	176	-84	6.6	0	0	0	114.2	H468	H468-N470 PolarHBondContact O-N 3.4Å
471	K	52	Low	74.2	Confident	131 Å²	131	68.3 Å²	68.3	57%	0.57	35%	0.349	S	S	*	.			trans	-143.2	121.1	179.7	-70.4	-170.8	174.6	-171.4	0	111.6	H468 I473	H468-K471 HydrophobicContact CB-CB 4.35Å; H468-K471 PolarHBondContact O-N 2.73Å; K471-I473 HydrophobicContact CB-CD1 4.31Å; K471-I473 HydrophobicContact CB-CG1 4.34Å; K471-I473 HydrophobicContact CD-CD1 4.1Å; K471-I473 PolarHBondContact O-N 2.9Å
472	S	51.5	Low	74.1	Confident	94 Å²	94	72.6 Å²	72.6	66%	0.657	37%	0.367	S	S	*	.			trans	-78.9	52.8	176.2	60.1	0	0	0	0	112.7
473	I	55.1	Low	73.7	Confident	111 Å²	111	73.1 Å²	73.1	57%	0.569	37%	0.37	S	S	*	.	S	Bend	trans	-113.7	135.5	179.2	-58.8	173.9	0	0	0	106.9	K471 G475	K471-I473 HydrophobicContact CB-CD1 4.31Å; K471-I473 HydrophobicContact CB-CG1 4.34Å; K471-I473 HydrophobicContact CD-CD1 4.1Å; K471-I473 PolarHBondContact O-N 2.9Å; I473-G475 PolarHBondContact O-N 3.25Å; I473-G475 VanDerWaalsContact O-N 3.09Å
474	Q	58	Low	73.2	Confident	147 Å²	147	74.9 Å²	74.9	69%	0.687	38%	0.383	S	S	*	.			trans	-61.7	112.2	169	-175.7	174.9	5.2	0	0	108.1	E465	E465-Q474 WeakPolarHBondContact OE1-CG 3.4Å; E465-Q474 PolarHBondContact OE1-NE2 2.76Å
475	G	63.1	Low	72.8	Confident	14 Å²	14	76.2 Å²	76.2	14%	0.144	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-78.6	154.9	-175.9	0	0	0	0	0	112	E465 T466 I473	E465-G475 WeakPolarHBondContact CB-O 3.35Å; T466-G475 WeakPolarHBondContact O-CA 3.37Å; T466-G475 VanDerWaalsContact OG1-C 3.3Å; T466-G475 VanDerWaalsContact OG1-CA 3.29Å; T466-G475 WeakPolarHBondContact OG1-CA 3.17Å; I473-G475 PolarHBondContact O-N 3.25Å; I473-G475 VanDerWaalsContact O-N 3.09Å
476	D	75.7	Confident	72.5	Confident	126 Å²	126	79.9 Å²	79.9	67%	0.674	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-55.1	136	-172.8	-54.9	-55.4	0	0	0	112.2	T466 I478	T466-D476 PolarHBondContact N-O 3.47Å; T466-D476 PolarHBondContact OG1-N 3.18Å; D476-I478 PolarHBondContact O-N 2.86Å
477	P	79.4	Confident	72.4	Confident	94 Å²	94	79.7 Å²	79.7	61%	0.61	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	127	176.2	28.7	-34.1	0	0	0	110.6	L463	L463-P477 HydrophobicContact CD1-CB 3.87Å
478	I	82.9	Confident	72.8	Confident	69 Å²	69	81.7 Å²	81.7	35%	0.354	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-48.2	-172.2	-43.2	176	0	0	0	111	I464 T466 D476 Y500	I464-I478 HydrophobicContact CG2-CD1 4.33Å; I464-I478 PolarHBondContact O-N 3.41Å; T466-I478 HydrophobicContact CG2-CD1 3.54Å; T466-I478 HydrophobicContact CG2-CG1 3.79Å; D476-I478 PolarHBondContact O-N 2.86Å; I478-Y500 HydrophobicContact CD1-CD1 3.34Å; I478-Y500 HydrophobicContact CD1-CE1 3.2Å; I478-Y500 HydrophobicContact CD1-CG 4.48Å
479	K	86.4	Confident	73.6	Confident	94 Å²	94	76.2 Å²	76.2	41%	0.409	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	146.8	-177.6	-67.3	-162.7	175.9	-168.2	0	111.1	I464 I489 S490 L491	I464-K479 PolarHBondContact N-O 3.33Å; K479-I489 HydrophobicContact CB-CD1 4.31Å; K479-I489 HydrophobicContact CB-CG2 4.08Å; K479-I489 HydrophobicContact CD-CG2 3.4Å; K479-I489 HydrophobicContact CG-CG2 4.32Å; K479-S490 PolarHBondContact NZ-O 3.29Å; K479-L491 HydrophobicContact CD-CD2 3.99Å; K479-L491 HydrophobicContact CG-CD2 4.45Å
480	Y	85.5	Confident	74.7	Confident	120 Å²	120	75.1 Å²	75.1	47%	0.471	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	142.8	179.6	-178.1	-111.9	0	0	0	109.6	S461 L462 L463 E482	S461-Y480 VanDerWaalsContact CB-OH 3.27Å; S461-Y480 WeakPolarHBondContact CB-OH 3.46Å; L462-Y480 CarbonylContact O-C 3.57Å; L462-Y480 WeakPolarHBondContact O-CA 3.39Å; L463-Y480 HydrophobicContact CB-CD2 3.99Å; L463-Y480 HydrophobicContact CD1-CD2 3.99Å; Y480-E482 HydrophobicContact CE1-CG 3.75Å; Y480-E482 VanDerWaalsContact CE1-OE1 3.23Å; Y480-E482 WeakPolarHBondContact CE1-OE1 3.22Å; Y480-E482 WeakPolarHBondContact OH-CG 3.49Å; Y480-E482 PolarHBondContact OH-OE1 2.91Å
481	V	85.3	Confident	76.3	Confident	31 Å²	31	71.1 Å²	71.1	19%	0.188	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	133.2	172.3	157.5	0	0	0	0	109.4	S461 L462 S487 I489	S461-V481 CarbonylContact C-O 3.59Å; S461-V481 VanDerWaalsContact CA-O 3.25Å; S461-V481 WeakPolarHBondContact CA-O 3.41Å; L462-V481 PolarHBondContact N-O 3.45Å; L462-V481 PolarHBondContact O-N 3.3Å; V481-S487 VanDerWaalsContact CG1-CB 3.49Å; V481-I489 HydrophobicContact CB-CD1 3.98Å; V481-I489 HydrophobicContact CB-CG1 4.16Å; V481-I489 HydrophobicContact CG2-CD1 3.67Å; V481-I489 HydrophobicContact CG2-CG1 3.41Å; V481-I489 VanDerWaalsContact CG2-CG1 3.41Å
482	E	84.3	Confident	77.9	Confident	103 Å²	103	70.1 Å²	70.1	48%	0.481	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	148.6	161.8	-80.9	169	-156.5	0	0	110.5	P459 S460 Y480	P459-E482 HydrophobicContact CB-CB 4.29Å; P459-E482 HydrophobicContact CB-CG 4.38Å; P459-E482 HydrophobicContact CG-CG 4.27Å; S460-E482 CarbonylContact O-C 3.55Å; S460-E482 WeakPolarHBondContact O-CA 3.49Å; Y480-E482 HydrophobicContact CE1-CG 3.75Å; Y480-E482 VanDerWaalsContact CE1-OE1 3.23Å; Y480-E482 WeakPolarHBondContact CE1-OE1 3.22Å; Y480-E482 WeakPolarHBondContact OH-CG 3.49Å; Y480-E482 PolarHBondContact OH-OE1 2.91Å
483	T	80.3	Confident	79.3	Confident	12 Å²	12	66 Å²	66	7%	0.074	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	148.4	177.7	-167.2	0	0	0	0	112.3	L361 V363 S460 G485 S486 S487	L361-T483 HydrophobicContact CD2-CG2 3.81Å; L361-T483 HydrophobicContact CG-CG2 4.36Å; V363-T483 HydrophobicContact CG1-CG2 3.89Å; V363-T483 HydrophobicContact CG2-CG2 3.87Å; S460-T483 WeakPolarHBondContact CB-O 3.36Å; S460-T483 PolarHBondContact N-O 3.44Å; S460-T483 PolarHBondContact O-N 2.81Å; T483-G485 PolarHBondContact OG1-N 3.43Å; T483-G485 VanDerWaalsContact OG1-N 3.15Å; T483-S486 PolarHBondContact OG1-N 2.77Å; T483-S487 WeakPolarHBondContact CB-OG 3.48Å; T483-S487 PolarHBondContact OG1-OG 3.01Å
484	T	78.2	Confident	80.4	Confident	81 Å²	81	64.1 Å²	64.1	50%	0.497	36%	0.362	S	S	.	.	S	Bend	trans	-111.2	10.3	168.1	54.5	0	0	0	0	111.4	Y365 P459	Y365-T484 WeakPolarHBondContact CB-O 3.49Å; Y365-T484 HydrophobicContact CD1-CG2 4.43Å; Y365-T484 HydrophobicContact CD2-CG2 3.93Å; Y365-T484 HydrophobicContact CE1-CG2 4.18Å; Y365-T484 HydrophobicContact CE2-CG2 3.65Å; Y365-T484 HydrophobicContact CG-CG2 4.3Å; P459-T484 HydrophobicContact CB-CG2 4.44Å
485	G	80.4	Confident	81	Confident	28 Å²	28	61.7 Å²	61.7	29%	0.289	35%	0.349	S	S	.	.	S	Bend	trans	-157.1	-97.4	-174.2	0	0	0	0	0	112.7	S362 V363 T483	S362-G485 CarbonylContact C-O 3.53Å; S362-G485 WeakPolarHBondContact CA-O 3.47Å; V363-G485 PolarHBondContact N-O 3.42Å; T483-G485 PolarHBondContact OG1-N 3.43Å; T483-G485 VanDerWaalsContact OG1-N 3.15Å
486	S	80.8	Confident	81.5	Confident	79 Å²	79	62.9 Å²	62.9	55%	0.552	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.6	125.9	177.2	-67.3	0	0	0	0	111.3	L361 S362 T483	L361-S486 WeakPolarHBondContact O-CA 3.41Å; S362-S486 VanDerWaalsContact CB-OG 3.29Å; S362-S486 WeakPolarHBondContact CB-OG 3.46Å; S362-S486 WeakPolarHBondContact OG-CB 3.36Å; S362-S486 PolarHBondContact OG-OG 3.33Å; T483-S486 PolarHBondContact OG1-N 2.77Å
487	S	82.5	Confident	81.5	Confident	39 Å²	39	59.1 Å²	59.1	27%	0.273	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	152.4	-178.6	-62	0	0	0	0	110.1	L361 V481 T483	L361-S487 PolarHBondContact N-O 3.1Å; L361-S487 PolarHBondContact O-N 2.73Å; L361-S487 VanDerWaalsContact O-O 3.13Å; V481-S487 VanDerWaalsContact CG1-CB 3.49Å; T483-S487 WeakPolarHBondContact CB-OG 3.48Å; T483-S487 PolarHBondContact OG1-OG 3.01Å
488	S	83.3	Confident	81.5	Confident	65 Å²	65	57 Å²	57	46%	0.455	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	136	-175.5	59.8	0	0	0	0	114.2	I359	I359-S488 CarbonylContact O-C 3.49Å; I359-S488 WeakPolarHBondContact O-CA 3.44Å
489	I	86.4	Confident	81.5	Confident	9 Å²	9	54.2 Å²	54.2	5%	0.046	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	125	176.3	-60.9	176.2	0	0	0	109.5	I358 I359 L462 I464 K479 V481 L491	I358-I489 CarbonylContact C-O 3.48Å; I358-I489 WeakPolarHBondContact CA-O 3.46Å; I359-I489 PolarHBondContact N-O 3.44Å; I359-I489 PolarHBondContact O-N 2.96Å; L462-I489 HydrophobicContact CD2-CD1 3.86Å; L462-I489 HydrophobicContact CG-CD1 4.2Å; I464-I489 HydrophobicContact CD1-CD1 3.81Å; I464-I489 HydrophobicContact CD1-CG2 4.15Å; I464-I489 HydrophobicContact CG1-CD1 4.35Å; K479-I489 HydrophobicContact CB-CD1 4.31Å; K479-I489 HydrophobicContact CB-CG2 4.08Å; K479-I489 HydrophobicContact CD-CG2 3.4Å; K479-I489 HydrophobicContact CG-CG2 4.32Å; V481-I489 HydrophobicContact CB-CD1 3.98Å; V481-I489 HydrophobicContact CB-CG1 4.16Å; V481-I489 HydrophobicContact CG2-CD1 3.67Å; V481-I489 HydrophobicContact CG2-CG1 3.41Å; V481-I489 VanDerWaalsContact CG2-CG1 3.41Å; I489-L491 HydrophobicContact CG2-CD2 4.36Å
490	S	85.8	Confident	81.5	Confident	40 Å²	40	50.6 Å²	50.6	28%	0.28	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	132.1	164.7	-179	0	0	0	0	111.4	E356 K479	E356-S490 VanDerWaalsContact CG-OG 3.28Å; E356-S490 WeakPolarHBondContact CG-OG 3.18Å; E356-S490 PolarHBondContact OE1-OG 3.3Å; K479-S490 PolarHBondContact NZ-O 3.29Å
491	L	85.8	Confident	81.5	Confident	6 Å²	6	46.7 Å²	46.7	3%	0.031	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	118.8	169.6	-64.2	176.8	0	0	0	108.8	E356 I357 I359 I464 K479 I489 L493 Y500	E356-L491 WeakPolarHBondContact CA-O 3.24Å; I357-L491 PolarHBondContact N-O 2.78Å; I357-L491 PolarHBondContact O-N 3.03Å; I359-L491 HydrophobicContact CD1-CD1 3.74Å; I359-L491 HydrophobicContact CD1-CG 4.42Å; I464-L491 HydrophobicContact CD1-CD1 4.37Å; K479-L491 HydrophobicContact CD-CD2 3.99Å; K479-L491 HydrophobicContact CG-CD2 4.45Å; I489-L491 HydrophobicContact CG2-CD2 4.36Å; L491-L493 HydrophobicContact CB-CD2 4.26Å; L491-L493 HydrophobicContact CB-CG 4.43Å; L491-Y500 HydrophobicContact CD1-CD2 4.28Å; L491-Y500 HydrophobicContact CD1-CE2 4.15Å
492	L	85	Confident	81.7	Confident	110 Å²	110	45.2 Å²	45.2	58%	0.576	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	116	173.7	-172.9	73.8	0	0	0	108.9	E356 R519	E356-L492 HydrophobicContact CB-CD1 4.45Å; L492-R519 VanDerWaalsContact CD1-CD 3.45Å
493	L	82.1	Confident	81.9	Confident	9 Å²	9	42 Å²	42	5%	0.047	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	130.2	-171.8	-56.7	-177.5	0	0	0	111.1	C349 P354 C355 I357 L491 Y498 Y500	C349-L493 HydrophobicContact CB-CD1 4.43Å; P354-L493 CarbonylContact C-O 3.56Å; P354-L493 WeakPolarHBondContact CA-O 3.17Å; C355-L493 PolarHBondContact N-O 2.93Å; C355-L493 PolarHBondContact O-N 3.46Å; I357-L493 HydrophobicContact CD1-CD1 3.65Å; I357-L493 HydrophobicContact CG1-CD1 4.1Å; L491-L493 HydrophobicContact CB-CD2 4.26Å; L491-L493 HydrophobicContact CB-CG 4.43Å; L493-Y498 HydrophobicContact CB-CD2 4.11Å; L493-Y498 HydrophobicContact CB-CE2 3.93Å; L493-Y498 HydrophobicContact CD1-CD2 3.96Å; L493-Y498 HydrophobicContact CD1-CG 4.33Å; L493-Y498 HydrophobicContact CD2-CD2 4.33Å; L493-Y498 HydrophobicContact CD2-CG 4.36Å; L493-Y498 HydrophobicContact CG-CD2 4.36Å; L493-Y500 HydrophobicContact CD1-CE2 4.3Å; L493-Y500 HydrophobicContact CD2-CE2 4.16Å; L493-Y500 WeakPolarHBondContact CD2-OH 3.36Å
494	P	76.7	Confident	82.2	Confident	71 Å²	71	41.5 Å²	41.5	46%	0.461	24%	0.242	S	C	.	.			trans	-57.6	177.6	164.3	-23.5	32	0	0	0	113.3	S496 Y498	P494-S496 PolarHBondContact O-N 2.83Å; P494-Y498 WeakPolarHBondContact CB-OH 3.35Å; P494-Y498 VanDerWaalsContact CD-OH 3.3Å; P494-Y498 WeakPolarHBondContact CD-OH 3.34Å; P494-Y498 WeakPolarHBondContact CG-OH 3.29Å
495	F	71.4	Confident	82.5	Confident	96 Å²	96	40.1 Å²	40.1	42%	0.421	23%	0.233	S	C	.	.	S	Bend	trans	-72.3	112.7	166.4	66.4	-81.6	0	0	0	108.8	P354	P354-F495 HydrophobicContact CG-CD1 4.41Å
496	S	73.3	Confident	82.7	Confident	39 Å²	39	39.1 Å²	39.1	27%	0.273	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.8	-174.3	175.3	-160	0	0	0	0	110.1	S351 P494 Y498	S351-S496 PolarHBondContact N-O 2.86Å; S351-S496 PolarHBondContact O-N 2.82Å; P494-S496 PolarHBondContact O-N 2.83Å; S496-Y498 VanDerWaalsContact CB-CE2 3.5Å; S496-Y498 WeakPolarHBondContact CB-OH 3.32Å
497	R	74.7	Confident	82.3	Confident	46 Å²	46	36.4 Å²	36.4	17%	0.174	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	138.1	157.5	-72.1	176.9	-173.6	179.6	1.8	111	F348 C349 D350 P558 L560 I561	F348-R497 HydrophobicContact CE2-CB 4.46Å; F348-R497 HydrophobicContact CE2-CG 4.45Å; F348-R497 HydrophobicContact CZ-CG 4.36Å; C349-R497 CarbonylContact O-C 3.59Å; C349-R497 VanDerWaalsContact O-CA 3.3Å; C349-R497 WeakPolarHBondContact O-CA 3.1Å; D350-R497 HydrophobicContact CB-CG 4.06Å; D350-R497 WeakPolarHBondContact OD1-CG 3.07Å; D350-R497 IonicContact OD1-CZ 3.11Å; D350-R497 IonicContact OD1-NE 3.58Å; D350-R497 PolarHBondContact OD1-NE 3.44Å; D350-R497 IonicContact OD1-NH2 3.45Å; D350-R497 IonicContact OD2-CZ 3.67Å; D350-R497 VanDerWaalsContact OD2-CZ 3.23Å; D350-R497 IonicContact OD2-NE 2.66Å; D350-R497 PolarHBondContact OD2-NE 2.82Å; D350-R497 IonicContact OD2-NH2 2.94Å; D350-R497 PolarHBondContact OD2-NH2 3.29Å; R497-P558 PolarHBondContact NH2-O 3.1Å; R497-P558 VanDerWaalsContact NH2-O 3.1Å; R497-L560 HydrophobicContact CG-CD2 4.42Å; R497-I561 VanDerWaalsContact NH1-CD1 3.35Å
498	Y	80.2	Confident	82	Confident	50 Å²	50	37.6 Å²	37.6	20%	0.196	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	140.9	173.3	-62.9	-78.8	0	0	0	109.8	F348 C349 L493 P494 S496 Y500	F348-Y498 WeakPolarHBondContact CA-O 3.46Å; C349-Y498 PolarHBondContact N-O 2.86Å; C349-Y498 PolarHBondContact O-N 2.9Å; L493-Y498 HydrophobicContact CB-CD2 4.11Å; L493-Y498 HydrophobicContact CB-CE2 3.93Å; L493-Y498 HydrophobicContact CD1-CD2 3.96Å; L493-Y498 HydrophobicContact CD1-CG 4.33Å; L493-Y498 HydrophobicContact CD2-CD2 4.33Å; L493-Y498 HydrophobicContact CD2-CG 4.36Å; L493-Y498 HydrophobicContact CG-CD2 4.36Å; P494-Y498 WeakPolarHBondContact CB-OH 3.35Å; P494-Y498 VanDerWaalsContact CD-OH 3.3Å; P494-Y498 WeakPolarHBondContact CD-OH 3.34Å; P494-Y498 WeakPolarHBondContact CG-OH 3.29Å; S496-Y498 VanDerWaalsContact CB-CE2 3.5Å; S496-Y498 WeakPolarHBondContact CB-OH 3.32Å; Y498-Y500 VanDerWaalsContact CD1-OH 3.27Å; Y498-Y500 WeakPolarHBondContact CD1-OH 3.34Å; Y498-Y500 HydrophobicContact CG-CE2 4.35Å
499	C	82.5	Confident	81.9	Confident	10 Å²	10	34.5 Å²	34.5	7%	0.068	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	132.6	167.6	-161.9	0	0	0	0	108.3	L347 Y467 W469	L347-C499 CarbonylContact O-C 3.58Å; L347-C499 WeakPolarHBondContact O-CA 3.43Å; Y467-C499 HydrophobicContact CD1-CB 4.42Å; Y467-C499 PolarHBondContact N-O 3.24Å; W469-C499 HydrophobicContact CE3-CB 4.28Å; W469-C499 HydrophobicContact CZ3-CB 4.48Å
500	Y	86.6	Confident	81.9	Confident	19 Å²	19	34.3 Å²	34.3	8%	0.075	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	152.3	-178.7	-59	-62.2	0	0	0	110.1	Y346 L347 I464 E465 I478 L491 L493 Y498	Y346-Y500 CarbonylContact C-O 3.54Å; Y346-Y500 WeakPolarHBondContact CA-O 3.46Å; L347-Y500 HydrophobicContact CD2-CD2 4.24Å; L347-Y500 HydrophobicContact CG-CD2 4.48Å; L347-Y500 PolarHBondContact N-O 2.92Å; L347-Y500 PolarHBondContact O-N 3.34Å; I464-Y500 HydrophobicContact CG2-CD1 4.39Å; I464-Y500 HydrophobicContact CG2-CG 4.22Å; E465-Y500 VanDerWaalsContact O-CA 3.32Å; E465-Y500 WeakPolarHBondContact O-CA 3.4Å; I478-Y500 HydrophobicContact CD1-CD1 3.34Å; I478-Y500 HydrophobicContact CD1-CE1 3.2Å; I478-Y500 HydrophobicContact CD1-CG 4.48Å; L491-Y500 HydrophobicContact CD1-CD2 4.28Å; L491-Y500 HydrophobicContact CD1-CE2 4.15Å; L493-Y500 HydrophobicContact CD1-CE2 4.3Å; L493-Y500 HydrophobicContact CD2-CE2 4.16Å; L493-Y500 WeakPolarHBondContact CD2-OH 3.36Å; Y498-Y500 VanDerWaalsContact CD1-OH 3.27Å; Y498-Y500 WeakPolarHBondContact CD1-OH 3.34Å; Y498-Y500 HydrophobicContact CG-CE2 4.35Å
501	K	86.8	Confident	81.9	Confident	37 Å²	37	34.7 Å²	34.7	16%	0.161	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	123.3	172.9	172.8	-177.8	157.7	-141.7	0	108	V344 Y346 E465	V344-K501 HydrophobicContact CG1-CD 4.23Å; V344-K501 HydrophobicContact CG1-CG 3.71Å; Y346-K501 HydrophobicContact CD1-CB 4.3Å; Y346-K501 HydrophobicContact CE1-CB 4.09Å; Y346-K501 HydrophobicContact CE1-CD 4.42Å; Y346-K501 HydrophobicContact CE1-CG 4.21Å; E465-K501 HydrophobicContact CB-CB 4.28Å; E465-K501 PolarHBondContact N-O 3.22Å; E465-K501 PolarHBondContact O-N 2.86Å; E465-K501 IonicContact OE1-NZ 2.7Å; E465-K501 VanDerWaalsContact OE2-CD 3.25Å; E465-K501 WeakPolarHBondContact OE2-CD 3.35Å; E465-K501 VanDerWaalsContact OE2-CE 3.27Å; E465-K501 WeakPolarHBondContact OE2-CE 3.29Å; E465-K501 IonicContact OE2-NZ 3.39Å; E465-K501 PolarHBondContact OE2-NZ 3.03Å
502	L	89	Confident	82.1	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	112.7	-179.4	-75.1	74.6	0	0	0	108.5	V344 H345 L347 I359 L462 L463 I464 L543	V344-L502 CarbonylContact C-O 3.59Å; V344-L502 WeakPolarHBondContact CA-O 3.36Å; H345-L502 HydrophobicContact CB-CB 4.35Å; H345-L502 PolarHBondContact N-O 2.88Å; H345-L502 PolarHBondContact O-N 2.84Å; L347-L502 HydrophobicContact CB-CD1 3.45Å; L347-L502 VanDerWaalsContact CB-CD1 3.45Å; L347-L502 HydrophobicContact CD2-CD1 4.23Å; L347-L502 HydrophobicContact CG-CD1 4.5Å; I359-L502 HydrophobicContact CD1-CD2 4.42Å; I359-L502 HydrophobicContact CG2-CD2 4.29Å; L462-L502 HydrophobicContact CD1-CB 3.97Å; L462-L502 HydrophobicContact CD1-CD2 4.06Å; L462-L502 HydrophobicContact CD1-CG 4.06Å; L463-L502 WeakPolarHBondContact O-CA 3.29Å; I464-L502 HydrophobicContact CG1-CG 4.43Å; L502-L543 HydrophobicContact CD1-CD1 4.16Å; L502-L543 HydrophobicContact CD2-CD1 3.95Å
503	L	87.3	Confident	82.2	Confident	37 Å²	37	29.9 Å²	29.9	19%	0.194	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	119.4	173.2	-77.3	144.8	0	0	0	108.5	V344 L462 L463 E465	V344-L503 HydrophobicContact CG2-CD2 3.75Å; V344-L503 HydrophobicContact CG2-CG 4.45Å; L462-L503 WeakPolarHBondContact CA-O 3.5Å; L463-L503 HydrophobicContact CB-CB 4.2Å; L463-L503 HydrophobicContact CD2-CD1 4.1Å; L463-L503 PolarHBondContact N-O 3.03Å; L463-L503 PolarHBondContact O-N 2.84Å; E465-L503 HydrophobicContact CG-CD1 4.23Å; E465-L503 WeakPolarHBondContact OE1-CD1 3.39Å
504	I	87.2	Confident	82.5	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123.9	-177.5	-63.4	170.9	0	0	0	110.3	S342 K343 L361 S461 L462 A506 Y510 I512	S342-I504 CarbonylContact C-O 3.55Å; S342-I504 VanDerWaalsContact CA-O 3.31Å; S342-I504 WeakPolarHBondContact CA-O 3.38Å; K343-I504 PolarHBondContact N-O 2.93Å; K343-I504 PolarHBondContact O-N 3.48Å; L361-I504 HydrophobicContact CD1-CD1 4.35Å; L361-I504 HydrophobicContact CD1-CG2 4.23Å; S461-I504 CarbonylContact O-C 3.59Å; S461-I504 WeakPolarHBondContact O-CA 3.43Å; L462-I504 HydrophobicContact CB-CG1 4.42Å; L462-I504 HydrophobicContact CD1-CD1 4.26Å; L462-I504 HydrophobicContact CD1-CG1 3.71Å; I504-A506 HydrophobicContact CG2-CB 4.21Å; I504-Y510 HydrophobicContact CB-CE1 4.42Å; I504-Y510 HydrophobicContact CD1-CD2 4.35Å; I504-Y510 HydrophobicContact CD1-CE2 3.95Å; I504-Y510 HydrophobicContact CG2-CD1 3.8Å; I504-Y510 HydrophobicContact CG2-CD2 4.31Å; I504-Y510 HydrophobicContact CG2-CE1 3.76Å; I504-Y510 HydrophobicContact CG2-CE2 4.35Å; I504-Y510 HydrophobicContact CG2-CG 4.04Å; I504-I512 HydrophobicContact CD1-CD1 3.38Å; I504-I512 HydrophobicContact CD1-CG1 3.76Å
505	T	85.4	Confident	83	Confident	52 Å²	52	26.2 Å²	26.2	32%	0.319	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	125.7	166.8	67.5	0	0	0	0	108.7	S460 S461	S460-T505 CarbonylContact C-O 3.54Å; S460-T505 VanDerWaalsContact CA-O 3.23Å; S460-T505 WeakPolarHBondContact CA-O 3.2Å; S460-T505 WeakPolarHBondContact CB-O 3.47Å; S461-T505 PolarHBondContact N-O 2.91Å; S461-T505 PolarHBondContact N-OG1 2.82Å; S461-T505 PolarHBondContact O-N 2.82Å; S461-T505 PolarHBondContact OG-OG1 2.92Å
506	A	83.1	Confident	83.6	Confident	6 Å²	6	21.6 Å²	21.6	5%	0.05	12%	0.115	C	C	.	.			trans	-163.4	90.4	-177.7	0	0	0	0	0	110.4	V363 I504 L508 G509 Y510	V363-A506 HydrophobicContact CG1-CB 4.26Å; I504-A506 HydrophobicContact CG2-CB 4.21Å; A506-L508 VanDerWaalsContact C-N 3.3Å; A506-L508 PolarHBondContact O-N 2.88Å; A506-L508 VanDerWaalsContact O-N 3.13Å; A506-G509 PolarHBondContact O-N 3.11Å; A506-G509 VanDerWaalsContact O-N 3.08Å; A506-Y510 HydrophobicContact CB-CD1 3.66Å; A506-Y510 HydrophobicContact CB-CG 4.26Å
507	P	73	Confident	84	Confident	23 Å²	23	22.8 Å²	22.8	15%	0.149	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-36.3	-164.7	-29.7	36.1	0	0	0	115.6	P338 S339 Y340	P338-P507 CarbonylContact C-O 3.57Å; P338-P507 WeakPolarHBondContact CA-O 3.25Å; P338-P507 WeakPolarHBondContact CB-O 3.3Å; S339-P507 PolarHBondContact N-O 2.7Å; Y340-P507 HydrophobicContact CD1-CB 4.17Å; Y340-P507 HydrophobicContact CD1-CG 4.48Å; Y340-P507 HydrophobicContact CE1-CB 4.08Å
508	L	76.8	Confident	84.1	Confident	64 Å²	64	22.4 Å²	22.4	34%	0.335	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-6	-177.3	-56	173.3	0	0	0	113.7	I364 Q366 A506	I364-L508 HydrophobicContact CB-CB 3.96Å; I364-L508 HydrophobicContact CG2-CB 3.78Å; I364-L508 HydrophobicContact CG2-CD1 4.22Å; I364-L508 WeakPolarHBondContact O-CB 3.25Å; Q366-L508 HydrophobicContact CB-CD1 4.01Å; A506-L508 VanDerWaalsContact C-N 3.3Å; A506-L508 PolarHBondContact O-N 2.88Å; A506-L508 VanDerWaalsContact O-N 3.13Å
509	G	79.8	Confident	83.6	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.122	C	C	.	.			trans	112.2	167	-177.6	0	0	0	0	0	114.8	N335 I364 A506	N335-G509 WeakPolarHBondContact O-CA 3.37Å; I364-G509 PolarHBondContact N-O 2.86Å; A506-G509 PolarHBondContact O-N 3.11Å; A506-G509 VanDerWaalsContact O-N 3.08Å
510	Y	87.2	Confident	82.3	Confident	4 Å²	4	27.7 Å²	27.7	2%	0.016	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	167.2	-170.7	61.9	-92.5	0	0	0	114.1	S334 N335 K343 H345 L361 S362 I504 A506 I512	S334-Y510 WeakPolarHBondContact CA-O 3.43Å; N335-Y510 HydrophobicContact CB-CD1 4.42Å; N335-Y510 HydrophobicContact CB-CE1 3.96Å; N335-Y510 HydrophobicContact CB-CE2 4.05Å; N335-Y510 PolarHBondContact N-O 3.41Å; N335-Y510 PolarHBondContact O-N 3.12Å; N335-Y510 VanDerWaalsContact O-N 3.11Å; K343-Y510 HydrophobicContact CB-CE1 4.48Å; K343-Y510 WeakPolarHBondContact CB-OH 3.26Å; K343-Y510 HydrophobicContact CD-CE1 4.04Å; H345-Y510 AromaticContact NE2-CZ 3.93Å; H345-Y510 PolarHBondContact NE2-OH 2.84Å; L361-Y510 HydrophobicContact CD1-CD2 4.29Å; L361-Y510 HydrophobicContact CD1-CG 4.37Å; S362-Y510 CarbonylContact O-C 3.56Å; S362-Y510 WeakPolarHBondContact O-CA 3.49Å; I504-Y510 HydrophobicContact CB-CE1 4.42Å; I504-Y510 HydrophobicContact CD1-CD2 4.35Å; I504-Y510 HydrophobicContact CD1-CE2 3.95Å; I504-Y510 HydrophobicContact CG2-CD1 3.8Å; I504-Y510 HydrophobicContact CG2-CD2 4.31Å; I504-Y510 HydrophobicContact CG2-CE1 3.76Å; I504-Y510 HydrophobicContact CG2-CE2 4.35Å; I504-Y510 HydrophobicContact CG2-CG 4.04Å; A506-Y510 HydrophobicContact CB-CD1 3.66Å; A506-Y510 HydrophobicContact CB-CG 4.26Å; Y510-I512 HydrophobicContact CD2-CD1 4.44Å; Y510-I512 HydrophobicContact CD2-CG1 3.84Å; Y510-I512 HydrophobicContact CE2-CD1 3.94Å; Y510-I512 HydrophobicContact CE2-CG1 3.84Å
511	V	86.9	Confident	80.5	Confident	48 Å²	48	30.1 Å²	30.1	29%	0.291	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	126.5	169.3	-174.4	0	0	0	0	108.6	T332 Y333 S362	T332-V511 HydrophobicContact CG2-CG1 3.61Å; Y333-V511 CarbonylContact O-C 3.55Å; Y333-V511 WeakPolarHBondContact O-CA 3.22Å; S362-V511 PolarHBondContact N-O 2.81Å; S362-V511 PolarHBondContact O-N 2.77Å
512	I	88.2	Confident	78.5	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	133.2	168.5	-42.8	168.6	0	0	0	107.5	T332 Y333 I359 Q360 L361 I504 Y510 I514 L543	T332-I512 CarbonylContact C-O 3.52Å; T332-I512 VanDerWaalsContact CA-O 3.31Å; T332-I512 WeakPolarHBondContact CA-O 3.35Å; Y333-I512 PolarHBondContact N-O 3.43Å; Y333-I512 PolarHBondContact O-N 2.72Å; I359-I512 HydrophobicContact CG2-CG2 3.81Å; Q360-I512 CarbonylContact O-C 3.53Å; Q360-I512 WeakPolarHBondContact O-CA 3.38Å; L361-I512 HydrophobicContact CD1-CG1 4.47Å; I504-I512 HydrophobicContact CD1-CD1 3.38Å; I504-I512 HydrophobicContact CD1-CG1 3.76Å; Y510-I512 HydrophobicContact CD2-CD1 4.44Å; Y510-I512 HydrophobicContact CD2-CG1 3.84Å; Y510-I512 HydrophobicContact CE2-CD1 3.94Å; Y510-I512 HydrophobicContact CE2-CG1 3.84Å; I512-I514 HydrophobicContact CG2-CG1 4.17Å; I512-L543 HydrophobicContact CD1-CD2 3.81Å
513	T	87.6	Confident	76.3	Confident	16 Å²	16	37.3 Å²	37.3	10%	0.098	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	127.8	165.1	-65.5	0	0	0	0	110.2	V330 K331 T332 Q360 L515	V330-T513 HydrophobicContact CG1-CG2 4.33Å; K331-T513 CarbonylContact O-C 3.47Å; K331-T513 WeakPolarHBondContact O-CA 3.4Å; T332-T513 WeakPolarHBondContact CG2-OG1 3.48Å; T332-T513 WeakPolarHBondContact OG1-CG2 3.49Å; T332-T513 PolarHBondContact OG1-OG1 3.06Å; Q360-T513 PolarHBondContact N-O 2.89Å; Q360-T513 PolarHBondContact O-N 2.85Å; T513-L515 HydrophobicContact CG2-CD2 3.75Å; T513-L515 HydrophobicContact CG2-CG 4.25Å
514	I	88.5	Confident	73.9	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	120.8	-177.7	-60	166.4	0	0	0	108.2	V330 K331 Y333 L347 I357 I358 I512 V541 L543	V330-I514 WeakPolarHBondContact CA-O 2.93Å; K331-I514 PolarHBondContact N-O 3.47Å; K331-I514 PolarHBondContact O-N 3.33Å; Y333-I514 HydrophobicContact CD2-CD1 4.48Å; Y333-I514 HydrophobicContact CE2-CD1 4.21Å; L347-I514 HydrophobicContact CD1-CD1 4.01Å; I357-I514 HydrophobicContact CG2-CG2 3.59Å; I358-I514 CarbonylContact O-C 3.51Å; I358-I514 WeakPolarHBondContact O-CA 3.45Å; I512-I514 HydrophobicContact CG2-CG1 4.17Å; I514-V541 HydrophobicContact CG2-CG1 4.08Å; I514-L543 HydrophobicContact CD1-CB 3.51Å; I514-L543 HydrophobicContact CD1-CD1 4.01Å; I514-L543 HydrophobicContact CD1-CD2 3.97Å; I514-L543 HydrophobicContact CD1-CG 4.02Å
515	L	86.8	Confident	71.6	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	109.5	-179.4	-52.5	177.8	0	0	0	109.5	H322 P324 Y327 I329 V330 I357 I358 T513	H322-L515 HydrophobicContact CB-CD1 4.36Å; P324-L515 HydrophobicContact CB-CD2 3.89Å; Y327-L515 HydrophobicContact CD1-CB 3.64Å; Y327-L515 HydrophobicContact CD2-CB 4.25Å; Y327-L515 HydrophobicContact CD2-CD1 4.26Å; Y327-L515 HydrophobicContact CE1-CB 4.03Å; Y327-L515 HydrophobicContact CE2-CD1 4.29Å; Y327-L515 HydrophobicContact CG-CB 3.78Å; I329-L515 CarbonylContact O-C 3.58Å; I329-L515 WeakPolarHBondContact O-CA 3.37Å; V330-L515 HydrophobicContact CB-CD2 4.31Å; V330-L515 HydrophobicContact CG1-CD2 3.9Å; V330-L515 HydrophobicContact CG2-CD2 3.9Å; I357-L515 WeakPolarHBondContact CA-O 3.47Å; I358-L515 HydrophobicContact CB-CB 4.25Å; I358-L515 PolarHBondContact N-O 2.81Å; I358-L515 PolarHBondContact O-N 2.73Å; T513-L515 HydrophobicContact CG2-CD2 3.75Å; T513-L515 HydrophobicContact CG2-CG 4.25Å
516	G	84.6	Confident	69.5	Low	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	130	-179.3	0	0	0	0	0	112.7	S328 I329	S328-G516 PolarHBondContact N-O 3.2Å; S328-G516 PolarHBondContact OG-O 3.02Å; I329-G516 PolarHBondContact N-O 2.91Å; I329-G516 PolarHBondContact O-N 3.11Å
517	R	82.6	Confident	67.5	Low	64 Å²	64	57 Å²	57	24%	0.242	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	149	169.3	72.9	175.1	-173.2	168.6	-7.8	112.8	Y327 S328 C355 E356	Y327-R517 HydrophobicContact CD1-CB 3.92Å; Y327-R517 HydrophobicContact CD1-CG 4.36Å; Y327-R517 HydrophobicContact CE1-CB 4.14Å; Y327-R517 HydrophobicContact CE1-CG 4.07Å; S328-R517 WeakPolarHBondContact OG-CA 3.44Å; C355-R517 CarbonylContact C-O 3.53Å; C355-R517 VanDerWaalsContact CA-O 3.28Å; C355-R517 WeakPolarHBondContact CA-O 3.47Å; C355-R517 WeakPolarHBondContact CB-O 3.16Å; E356-R517 HydrophobicContact CB-CG 3.95Å; E356-R517 PolarHBondContact N-O 3.08Å; E356-R517 PolarHBondContact O-N 3.03Å; E356-R517 IonicContact OE2-CZ 2.73Å; E356-R517 IonicContact OE2-NE 2.74Å; E356-R517 PolarHBondContact OE2-NE 2.8Å; E356-R517 IonicContact OE2-NH2 3.85Å; E356-R517 PolarHBondContact OE2-NH2 2.96Å
518	I	76.6	Confident	65.9	Low	38 Å²	38	60.2 Å²	60.2	20%	0.195	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	139.3	171.2	-60.6	175.2	0	0	0	109.5	Q353 S520 S538 M539	Q353-I518 HydrophobicContact CB-CG2 3.61Å; Q353-I518 HydrophobicContact CG-CG2 4.44Å; Q353-I518 VanDerWaalsContact OE1-CG2 3.26Å; I518-S520 PolarHBondContact O-N 2.68Å; I518-S538 WeakPolarHBondContact CD1-OG 3.45Å; I518-M539 HydrophobicContact CD1-CB 3.72Å; I518-M539 HydrophobicContact CG1-CB 3.82Å; I518-M539 HydrophobicContact CG1-CG 4.46Å; I518-M539 HydrophobicContact CG1-SD 3.85Å
519	R	68.4	Low	64.2	Low	97 Å²	97	61.4 Å²	61.4	37%	0.366	32%	0.324	S	S	.	.			trans	-91.2	90.4	176.4	-67.9	-176.2	65.5	129.4	-7	110.1	P354 E356 L492 S521	P354-R519 PolarHBondContact O-N 2.86Å; E356-R519 IonicContact OE2-NH1 3.92Å; L492-R519 VanDerWaalsContact CD1-CD 3.45Å; R519-S521 PolarHBondContact O-N 2.92Å
520	S	55.6	Low	62.3	Low	73 Å²	73	65.3 Å²	65.3	51%	0.51	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	44.6	-178.9	65.6	0	0	0	0	114.5	I518	I518-S520 PolarHBondContact O-N 2.68Å
521	S	49.1	Very low	60.1	Low	71 Å²	71	67.7 Å²	67.7	50%	0.497	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.1	9.5	-173.7	72.8	0	0	0	0	114.5	R519	R519-S521 PolarHBondContact O-N 2.92Å
522	I	44.2	Very low	57.9	Low	117 Å²	117	74.4 Å²	74.4	60%	0.6	38%	0.378	S	S	*	.			trans	-133.8	76.4	177	-51.9	176.8	0	0	0	108.2	P354	P354-I522 HydrophobicContact CG-CD1 4.25Å
523	I	42.7	Very low	55.5	Low	70 Å²	70	77.6 Å²	77.6	36%	0.359	41%	0.411	S	S	.	.			trans	-134.5	113.4	168	-57.3	179.4	0	0	0	107.7
524	N	38.2	Very low	53.3	Low	119 Å²	119	79.4 Å²	79.4	64%	0.636	42%	0.42	S	S	*	.			trans	-69.6	129.1	167.9	-129.4	-12.7	0	0	0	107.8	K526 Y527	N524-K526 PolarHBondContact O-N 3.13Å; N524-Y527 HydrophobicContact CB-CD2 4.27Å; N524-Y527 PolarHBondContact O-N 2.85Å
525	T	38.2	Very low	51	Low	120 Å²	120	86.9 Å²	86.9	74%	0.736	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-56	-29.4	-163.1	44.5	0	0	0	0	114.6	Y527 N528	T525-Y527 PolarHBondContact O-N 2.93Å; T525-N528 PolarHBondContact O-N 2.96Å
526	K	41.2	Very low	49	Very low	185 Å²	185	96.5 Å²	96.5	80%	0.804	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-55.2	-28.3	173.6	-74.9	-169.9	171.3	-173.5	0	114.7	N524	N524-K526 PolarHBondContact O-N 3.13Å
527	Y	40.5	Very low	47.6	Very low	87 Å²	87	99 Å²	99	34%	0.341	52%	0.517	S	S	.	.	G	3₁₀ helix	trans	-83	-14.1	-175.4	-77.6	-82	0	0	0	115.1	N524 T525 S529 I648	N524-Y527 HydrophobicContact CB-CD2 4.27Å; N524-Y527 PolarHBondContact O-N 2.85Å; T525-Y527 PolarHBondContact O-N 2.93Å; Y527-S529 VanDerWaalsContact C-N 3.28Å; Y527-S529 PolarHBondContact O-N 2.86Å; Y527-I648 WeakPolarHBondContact OH-CD1 3.35Å
528	N	39.5	Very low	46.8	Very low	89 Å²	89	98.3 Å²	98.3	48%	0.476	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-71	-18.7	-176.4	-87	-29.3	0	0	0	114.3	T525 F530	T525-N528 PolarHBondContact O-N 2.96Å; N528-F530 PolarHBondContact O-N 2.8Å
529	S	42.3	Very low	46.7	Very low	90 Å²	90	97.1 Å²	97.1	63%	0.629	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-60.3	-46.8	-179.5	-169.7	0	0	0	0	112.4	Y527 M531	Y527-S529 VanDerWaalsContact C-N 3.28Å; Y527-S529 PolarHBondContact O-N 2.86Å; S529-M531 PolarHBondContact O-N 2.86Å
530	F	40.2	Very low	47	Very low	82 Å²	82	94 Å²	94	36%	0.36	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-81.8	-7.7	-170.2	-63.1	-80.3	0	0	0	114.7	N528 S570	N528-F530 PolarHBondContact O-N 2.8Å; F530-S570 WeakPolarHBondContact CD1-OG 3.49Å; F530-S570 VanDerWaalsContact CE1-OG 3.31Å; F530-S570 WeakPolarHBondContact CE1-OG 3.44Å
531	M	41	Very low	48.2	Very low	54 Å²	54	90.6 Å²	90.6	27%	0.266	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-85.4	-7.6	-175.1	-77.9	-68.4	-167.2	0	0	114.9	I352 S529 G533 I534 Y563	I352-M531 HydrophobicContact CG2-CE 3.98Å; S529-M531 PolarHBondContact O-N 2.86Å; M531-G533 PolarHBondContact O-N 3.16Å; M531-I534 PolarHBondContact O-N 2.87Å; M531-Y563 HydrophobicContact CE-CD2 4.11Å; M531-Y563 HydrophobicContact CE-CE2 3.32Å; M531-Y563 HydrophobicContact SD-CE2 4.01Å
532	K	39.4	Very low	49.6	Very low	188 Å²	188	87.7 Å²	87.7	82%	0.817	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-62.8	-9.8	-172.8	-85.7	-173.5	174.1	-179.5	0	116.3
533	G	38.2	Very low	51.4	Low	67 Å²	67	82.1 Å²	82.1	69%	0.691	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-97.2	-22	-178.9	0	0	0	0	0	116.3	M531 H535	M531-G533 PolarHBondContact O-N 3.16Å; G533-H535 PolarHBondContact O-N 2.73Å
534	I	40.8	Very low	53.2	Low	55 Å²	55	81.2 Å²	81.2	28%	0.282	43%	0.428	S	S	.	.			trans	-99.3	81.2	-170	-50.7	-179	0	0	0	110.5	M531	M531-I534 PolarHBondContact O-N 2.87Å
535	H	40.3	Very low	55	Low	158 Å²	158	80.6 Å²	80.6	73%	0.731	43%	0.425	S	S	*	.			trans	-73.8	143.5	171.2	-79	-104	0	0	0	111.9	G533	G533-H535 PolarHBondContact O-N 2.73Å
536	Q	45	Very low	56.6	Low	202 Å²	202	76 Å²	76	94%	0.944	39%	0.394	S	S	*	.	S	Bend	trans	80.3	-14.3	162.2	-70.5	177.8	-44.1	0	0	122.9
537	S	54.6	Low	57.9	Low	52 Å²	52	70 Å²	70	36%	0.364	37%	0.371	S	S	.	.			trans	-149.6	95.2	169.9	56.2	0	0	0	0	116.2
538	S	66.9	Low	59.3	Low	51 Å²	51	71.1 Å²	71.1	36%	0.357	38%	0.376	S	S	.	.	S	Bend	trans	-95.5	-2.2	173.7	39.9	0	0	0	0	114.6	I352 I518	I352-S538 PolarHBondContact N-O 2.72Å; I518-S538 WeakPolarHBondContact CD1-OG 3.45Å
539	M	74.3	Confident	60.7	Low	13 Å²	13	67.2 Å²	67.2	6%	0.064	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	132.7	176.6	177.8	-176.8	-177.3	0	0	108.5	I329 C355 I357 I518 V541	I329-M539 HydrophobicContact CD1-CB 4.25Å; I329-M539 HydrophobicContact CD1-CE 4.37Å; I329-M539 HydrophobicContact CD1-CG 3.75Å; I329-M539 HydrophobicContact CD1-SD 3.97Å; C355-M539 HydrophobicContact CB-CE 3.62Å; C355-M539 HydrophobicContact CB-SD 3.61Å; I357-M539 HydrophobicContact CD1-CE 4.04Å; I357-M539 HydrophobicContact CG1-CE 3.65Å; I518-M539 HydrophobicContact CD1-CB 3.72Å; I518-M539 HydrophobicContact CG1-CB 3.82Å; I518-M539 HydrophobicContact CG1-CG 4.46Å; I518-M539 HydrophobicContact CG1-SD 3.85Å; M539-V541 HydrophobicContact CE-CG2 3.61Å; M539-V541 HydrophobicContact CG-CG2 4.29Å
540	N	75.8	Confident	61.6	Low	32 Å²	32	65.5 Å²	65.5	17%	0.171	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	139	170	-175.7	14.2	0	0	0	109.3	C349 D350 L559	C349-N540 WeakPolarHBondContact CA-O 3.47Å; D350-N540 PolarHBondContact N-O 3.08Å; D350-N540 PolarHBondContact O-N 3.16Å; N540-L559 HydrophobicContact CB-CD1 3.69Å
541	V	79.4	Confident	62.5	Low	1 Å²	1	65.5 Å²	65.5	1%	0.006	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	132.5	177.3	-179	0	0	0	0	109.4	I329 K331 L347 F348 C349 I357 I514 M539	I329-V541 HydrophobicContact CD1-CB 4.31Å; I329-V541 HydrophobicContact CD1-CG2 3.87Å; I329-V541 HydrophobicContact CG2-CB 4.43Å; K331-V541 VanDerWaalsContact CE-O 3.31Å; K331-V541 WeakPolarHBondContact CE-O 3.32Å; K331-V541 PolarHBondContact NZ-O 3.19Å; L347-V541 HydrophobicContact CD1-CG1 3.58Å; F348-V541 CarbonylContact O-C 3.58Å; F348-V541 WeakPolarHBondContact O-CA 3.25Å; C349-V541 HydrophobicContact CB-CG2 4.36Å; I357-V541 HydrophobicContact CD1-CG1 4.38Å; I357-V541 HydrophobicContact CD1-CG2 3.91Å; I514-V541 HydrophobicContact CG2-CG1 4.08Å; M539-V541 HydrophobicContact CE-CG2 3.61Å; M539-V541 HydrophobicContact CG-CG2 4.29Å
542	M	78.7	Confident	63.1	Low	10 Å²	10	64.6 Å²	64.6	5%	0.049	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	133	178.5	-62.6	164.4	63.2	0	0	108.9	L347 F348 Y548 I549 N552	L347-M542 CarbonylContact C-O 3.52Å; L347-M542 WeakPolarHBondContact CA-O 3.34Å; F348-M542 HydrophobicContact CB-CB 4.46Å; F348-M542 HydrophobicContact CD1-SD 4.16Å; F348-M542 PolarHBondContact N-O 3.04Å; F348-M542 PolarHBondContact O-N 3Å; M542-Y548 HydrophobicContact CE-CD1 3.94Å; M542-Y548 HydrophobicContact CE-CE1 3.54Å; M542-I549 HydrophobicContact CB-CG1 4.28Å; M542-I549 HydrophobicContact CE-CG1 4.44Å; M542-N552 HydrophobicContact CE-CB 3.55Å
543	L	82.5	Confident	63.9	Low	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	129.5	164.3	-178	97.9	0	0	0	107.5	Y333 H345 Y346 L347 L502 I512 I514	Y333-L543 HydrophobicContact CD1-CD2 4.13Å; Y333-L543 HydrophobicContact CD2-CB 4.34Å; Y333-L543 HydrophobicContact CD2-CD2 3.55Å; Y333-L543 HydrophobicContact CE1-CB 4.41Å; Y333-L543 HydrophobicContact CE1-CD2 4.37Å; Y333-L543 WeakPolarHBondContact CE1-O 3.37Å; Y333-L543 HydrophobicContact CE2-CB 3.73Å; Y333-L543 HydrophobicContact CE2-CD2 3.84Å; Y333-L543 HydrophobicContact CE2-CG 4.41Å; Y333-L543 HydrophobicContact CG-CD2 3.72Å; Y333-L543 PolarHBondContact OH-N 3.34Å; Y333-L543 PolarHBondContact OH-O 2.94Å; H345-L543 HydrophobicContact CB-CD1 3.83Å; H345-L543 HydrophobicContact CB-CD2 4.26Å; H345-L543 HydrophobicContact CB-CG 4.06Å; Y346-L543 VanDerWaalsContact O-CA 3.23Å; Y346-L543 WeakPolarHBondContact O-CA 3.26Å; Y346-L543 WeakPolarHBondContact O-CD1 3.28Å; L347-L543 HydrophobicContact CB-CD1 3.83Å; L347-L543 HydrophobicContact CD1-CB 4.33Å; L347-L543 HydrophobicContact CD1-CD1 4.33Å; L502-L543 HydrophobicContact CD1-CD1 4.16Å; L502-L543 HydrophobicContact CD2-CD1 3.95Å; I512-L543 HydrophobicContact CD1-CD2 3.81Å; I514-L543 HydrophobicContact CD1-CB 3.51Å; I514-L543 HydrophobicContact CD1-CD1 4.01Å; I514-L543 HydrophobicContact CD1-CD2 3.97Å; I514-L543 HydrophobicContact CD1-CG 4.02Å
544	D	80.4	Confident	64.6	Low	51 Å²	51	54.5 Å²	54.5	27%	0.273	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.9	-176.5	178.9	-135.7	-59.7	0	0	0	111.7	Y346 Y548 I549	Y346-D544 PolarHBondContact N-O 2.96Å; Y346-D544 PolarHBondContact O-N 3.26Å; Y346-D544 VanDerWaalsContact O-N 3.07Å; D544-Y548 HydrophobicContact CB-CD1 3.43Å; D544-Y548 VanDerWaalsContact CB-CD1 3.43Å; D544-Y548 HydrophobicContact CB-CE1 4.18Å; D544-Y548 HydrophobicContact CB-CG 3.98Å; D544-Y548 VanDerWaalsContact CG-CD1 3.48Å; D544-Y548 WeakPolarHBondContact OD2-CD1 3.48Å; D544-Y548 WeakPolarHBondContact OD2-CE1 3.44Å; D544-I549 HydrophobicContact CB-CD1 4.35Å; D544-I549 HydrophobicContact CB-CG1 4.33Å
545	D	76.9	Confident	64.9	Low	105 Å²	105	56 Å²	56	56%	0.561	29%	0.288	S	S	*	.			trans	-63.3	157.5	166.1	-79.2	-14.7	0	0	0	111.9	D547 Y548 I549	D545-D547 PolarHBondContact O-N 2.97Å; D545-Y548 PolarHBondContact O-N 3.26Å; D545-I549 PolarHBondContact O-N 3.39Å
546	Y	71.1	Confident	65.1	Low	24 Å²	24	50.4 Å²	50.4	9%	0.094	27%	0.265	C	S	.	.	H	α-helix	trans	-53	-51.7	-174.1	-179.9	-95	0	0	0	114	Y346 Y467 Y548 I549 L550 Y965	Y346-Y546 HydrophobicContact CD1-CD2 4.26Å; Y346-Y546 HydrophobicContact CD2-CD2 4.37Å; Y346-Y546 HydrophobicContact CE1-CD2 4.02Å; Y346-Y546 HydrophobicContact CE2-CD2 4.16Å; Y346-Y546 HydrophobicContact CE2-CG 4.43Å; Y346-Y546 HydrophobicContact CG-CD2 4.42Å; Y346-Y546 AromaticContact CZ-CD2 3.98Å; Y467-Y546 HydrophobicContact CE1-CD2 4.35Å; Y467-Y546 AromaticContact CE1-CE2 3.72Å; Y467-Y546 HydrophobicContact CE1-CE2 3.72Å; Y467-Y546 AromaticContact CZ-CE2 3.77Å; Y467-Y546 VanDerWaalsContact OH-CE2 3.22Å; Y467-Y546 WeakPolarHBondContact OH-CE2 3.31Å; Y546-Y548 PolarHBondContact O-N 3Å; Y546-I549 PolarHBondContact O-N 2.7Å; Y546-L550 HydrophobicContact CE1-CB 4.06Å; Y546-L550 HydrophobicContact CE1-CD2 3.73Å; Y546-L550 HydrophobicContact CE1-CG 4.47Å; Y546-L550 PolarHBondContact O-N 3.31Å; Y546-Y965 HydrophobicContact CD1-CD1 4.06Å; Y546-Y965 HydrophobicContact CD1-CD2 4.03Å; Y546-Y965 HydrophobicContact CD1-CE1 4.34Å; Y546-Y965 HydrophobicContact CD1-CE2 4.31Å; Y546-Y965 AromaticContact CD1-CG 3.92Å; Y546-Y965 HydrophobicContact CD1-CG 3.92Å; Y546-Y965 AromaticContact CE1-CD1 3.55Å; Y546-Y965 HydrophobicContact CE1-CD1 3.55Å; Y546-Y965 AromaticContact CE1-CD2 3.68Å; Y546-Y965 HydrophobicContact CE1-CD2 3.68Å; Y546-Y965 AromaticContact CE1-CE1 3.39Å; Y546-Y965 HydrophobicContact CE1-CE1 3.39Å; Y546-Y965 AromaticContact CE1-CE2 3.51Å; Y546-Y965 HydrophobicContact CE1-CE2 3.51Å; Y546-Y965 AromaticContact CE1-CG 3.71Å; Y546-Y965 HydrophobicContact CE1-CG 3.71Å; Y546-Y965 AromaticContact CE1-CZ 3.36Å; Y546-Y965 HydrophobicContact CE2-CD1 4.2Å; Y546-Y965 HydrophobicContact CE2-CE1 4.1Å; Y546-Y965 AromaticContact CZ-CD1 3.64Å; Y546-Y965 AromaticContact CZ-CE1 3.24Å; Y546-Y965 AromaticContact CZ-CZ 3.56Å; Y546-Y965 WeakPolarHBondContact OH-CE1 3.28Å; Y546-Y965 VanDerWaalsContact OH-CZ 3.23Å; Y546-Y965 PolarHBondContact OH-OH 2.94Å
547	D	67.1	Low	65.4	Low	60 Å²	60	45.2 Å²	45.2	32%	0.321	24%	0.237	S	C	.	.	H	α-helix	trans	-59.4	-36	-175.8	-82.8	-22.3	0	0	0	111.2	D545 L551 R938	D545-D547 PolarHBondContact O-N 2.97Å; D547-L551 WeakPolarHBondContact O-CB 3.36Å; D547-L551 PolarHBondContact O-N 2.85Å; D547-R938 IonicContact OD1-NH1 2.89Å; D547-R938 IonicContact OD1-NH2 2.78Å; D547-R938 IonicContact OD2-NH1 3.27Å; D547-R938 PolarHBondContact OD2-NH1 2.98Å
548	Y	71.2	Confident	65.6	Low	110 Å²	110	43.8 Å²	43.8	43%	0.431	23%	0.227	S	C	.	.	H	α-helix	trans	-72.7	-38.7	179.9	-177.6	-87.7	0	0	0	112.5	M542 D544 D545 Y546 N552	M542-Y548 HydrophobicContact CE-CD1 3.94Å; M542-Y548 HydrophobicContact CE-CE1 3.54Å; D544-Y548 HydrophobicContact CB-CD1 3.43Å; D544-Y548 VanDerWaalsContact CB-CD1 3.43Å; D544-Y548 HydrophobicContact CB-CE1 4.18Å; D544-Y548 HydrophobicContact CB-CG 3.98Å; D544-Y548 VanDerWaalsContact CG-CD1 3.48Å; D544-Y548 WeakPolarHBondContact OD2-CD1 3.48Å; D544-Y548 WeakPolarHBondContact OD2-CE1 3.44Å; D545-Y548 PolarHBondContact O-N 3.26Å; Y546-Y548 PolarHBondContact O-N 3Å; Y548-N552 WeakPolarHBondContact CD2-ND2 3.36Å; Y548-N552 HydrophobicContact CE1-CB 4.33Å; Y548-N552 WeakPolarHBondContact CE2-ND2 3.49Å; Y548-N552 WeakPolarHBondContact O-CB 3.41Å; Y548-N552 PolarHBondContact O-N 3.3Å
549	I	67.7	Low	65.5	Low	7 Å²	7	42.1 Å²	42.1	4%	0.036	21%	0.214	C	C	.	.	H	α-helix	trans	-72.9	-34.3	175.4	-85.4	168.7	0	0	0	112	Y346 F348 M542 D544 D545 Y546 G553 I554	Y346-I549 VanDerWaalsContact C-CD1 3.45Å; Y346-I549 WeakPolarHBondContact O-CD1 3.48Å; F348-I549 HydrophobicContact CB-CD1 4.13Å; F348-I549 HydrophobicContact CB-CG1 4.21Å; F348-I549 HydrophobicContact CB-CG2 3.89Å; M542-I549 HydrophobicContact CB-CG1 4.28Å; M542-I549 HydrophobicContact CE-CG1 4.44Å; D544-I549 HydrophobicContact CB-CD1 4.35Å; D544-I549 HydrophobicContact CB-CG1 4.33Å; D545-I549 PolarHBondContact O-N 3.39Å; Y546-I549 PolarHBondContact O-N 2.7Å; I549-G553 WeakPolarHBondContact O-CA 3.37Å; I549-G553 PolarHBondContact O-N 3.23Å; I549-I554 PolarHBondContact O-N 2.78Å
550	L	62.3	Low	64.8	Low	54 Å²	54	42.1 Å²	42.1	28%	0.283	21%	0.214	S	C	.	.	I	π-helix	trans	-62.2	-48.2	171.7	177.6	58.9	0	0	0	111.1	Y546 I554	Y546-L550 HydrophobicContact CE1-CB 4.06Å; Y546-L550 HydrophobicContact CE1-CD2 3.73Å; Y546-L550 HydrophobicContact CE1-CG 4.47Å; Y546-L550 PolarHBondContact O-N 3.31Å; L550-I554 HydrophobicContact CD1-CD1 4.05Å
551	L	58.4	Low	63.9	Low	82 Å²	82	45.2 Å²	45.2	43%	0.429	23%	0.23	S	C	.	.	I	π-helix	trans	-65.8	-64.8	178.3	-174.3	64.3	0	0	0	111.3	D547 T555	D547-L551 WeakPolarHBondContact O-CB 3.36Å; D547-L551 PolarHBondContact O-N 2.85Å; L551-T555 WeakPolarHBondContact O-CB 3.24Å; L551-T555 PolarHBondContact O-N 2.87Å; L551-T555 PolarHBondContact O-OG1 2.82Å
552	N	55.2	Low	62.8	Low	34 Å²	34	48.9 Å²	48.9	18%	0.182	24%	0.244	C	C	.	.	I	π-helix	trans	-88.2	-20.5	-167.2	-67.1	-45.3	0	0	0	114.7	M542 Y548 T556	M542-N552 HydrophobicContact CE-CB 3.55Å; Y548-N552 WeakPolarHBondContact CD2-ND2 3.36Å; Y548-N552 HydrophobicContact CE1-CB 4.33Å; Y548-N552 WeakPolarHBondContact CE2-ND2 3.49Å; Y548-N552 WeakPolarHBondContact O-CB 3.41Å; Y548-N552 PolarHBondContact O-N 3.3Å; N552-T556 WeakPolarHBondContact CA-OG1 3.3Å; N552-T556 PolarHBondContact O-OG1 3.45Å; N552-T556 VanDerWaalsContact O-OG1 3.14Å
553	G	54.3	Low	61.9	Low	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.246	C	C	.	.	I	π-helix	trans	-83.5	-37.3	177.2	0	0	0	0	0	113	F348 I549	F348-G553 VanDerWaalsContact CE1-O 3.26Å; F348-G553 WeakPolarHBondContact CE1-O 3.41Å; F348-G553 VanDerWaalsContact CZ-O 3.27Å; F348-G553 WeakPolarHBondContact CZ-O 3.46Å; I549-G553 WeakPolarHBondContact O-CA 3.37Å; I549-G553 PolarHBondContact O-N 3.23Å
554	I	52.7	Low	60.7	Low	44 Å²	44	50.3 Å²	50.3	23%	0.226	25%	0.249	C	C	.	.	I	π-helix	trans	-96.8	-36.9	-174.8	-54.6	-169.6	0	0	0	112.6	W469 I549 L550	W469-I554 HydrophobicContact CB-CD1 4Å; W469-I554 HydrophobicContact CD2-CD1 3.69Å; W469-I554 HydrophobicContact CE3-CD1 4.2Å; W469-I554 HydrophobicContact CG-CD1 3.57Å; I549-I554 PolarHBondContact O-N 2.78Å; L550-I554 HydrophobicContact CD1-CD1 4.05Å
555	T	47.7	Very low	59.3	Low	86 Å²	86	49.2 Å²	49.2	53%	0.528	25%	0.247	S	C	.	.	I	π-helix	trans	-92.4	-46.1	-172.3	76.5	0	0	0	0	114.2	L551	L551-T555 WeakPolarHBondContact O-CB 3.24Å; L551-T555 PolarHBondContact O-N 2.87Å; L551-T555 PolarHBondContact O-OG1 2.82Å
556	T	44.5	Very low	58.4	Low	40 Å²	40	46.6 Å²	46.6	25%	0.245	23%	0.233	C	C	.	.	I	π-helix	trans	-94.7	-34.1	-168.1	45.2	0	0	0	0	115.3	N552 P558	N552-T556 WeakPolarHBondContact CA-OG1 3.3Å; N552-T556 PolarHBondContact O-OG1 3.45Å; N552-T556 VanDerWaalsContact O-OG1 3.14Å; T556-P558 WeakPolarHBondContact O-CD 3.43Å
557	Y	51.7	Low	57.8	Low	93 Å²	93	46 Å²	46	37%	0.365	23%	0.231	S	C	.	.			trans	-114.7	53.5	-174.5	-69.3	-74.6	0	0	0	116.1	L559 E846	Y557-L559 VanDerWaalsContact C-N 3.26Å; Y557-L559 PolarHBondContact O-N 3.24Å; Y557-E846 VanDerWaalsContact CE1-OE1 3.3Å; Y557-E846 WeakPolarHBondContact CE1-OE1 3.44Å; Y557-E846 PolarHBondContact OH-OE1 3.32Å
558	P	58.7	Low	57.3	Low	23 Å²	23	44.8 Å²	44.8	15%	0.149	22%	0.224	C	C	.	.			trans	-81.9	59.7	-174.5	37.9	-39.6	0	0	0	113.5	R497 T556 L560 I561 R562	R497-P558 PolarHBondContact NH2-O 3.1Å; R497-P558 VanDerWaalsContact NH2-O 3.1Å; T556-P558 WeakPolarHBondContact O-CD 3.43Å; P558-L560 PolarHBondContact O-N 3.42Å; P558-I561 HydrophobicContact CB-CB 4.24Å; P558-I561 HydrophobicContact CB-CD1 4.3Å; P558-I561 PolarHBondContact O-N 3.38Å; P558-R562 PolarHBondContact O-N 2.95Å
559	L	63.9	Low	56.5	Low	15 Å²	15	40.6 Å²	40.6	8%	0.079	21%	0.209	C	C	.	.	H	α-helix	trans	-43.2	-53.2	-178.4	-80.2	177	0	0	0	114.6	D350 I352 N540 Y557 I561 R562 Y563	D350-L559 WeakPolarHBondContact OD2-CB 3.46Å; D350-L559 PolarHBondContact OD2-N 2.98Å; I352-L559 HydrophobicContact CD1-CB 4.33Å; N540-L559 HydrophobicContact CB-CD1 3.69Å; Y557-L559 VanDerWaalsContact C-N 3.26Å; Y557-L559 PolarHBondContact O-N 3.24Å; L559-I561 VanDerWaalsContact C-N 3.34Å; L559-I561 PolarHBondContact O-N 3.13Å; L559-R562 PolarHBondContact O-N 3.21Å; L559-Y563 WeakPolarHBondContact O-CB 2.92Å; L559-Y563 PolarHBondContact O-N 3.37Å
560	L	60.7	Low	56.2	Low	14 Å²	14	41.9 Å²	41.9	7%	0.073	22%	0.218	C	C	.	.	H	α-helix	trans	-66.6	-32.3	-177.3	-175.9	66.9	0	0	0	113.1	D350 I352 R497 P558 Y563 Y564	D350-L560 WeakPolarHBondContact OD1-CB 3.47Å; D350-L560 PolarHBondContact OD2-N 2.83Å; I352-L560 HydrophobicContact CG1-CD1 4.49Å; R497-L560 HydrophobicContact CG-CD2 4.42Å; P558-L560 PolarHBondContact O-N 3.42Å; L560-Y563 HydrophobicContact CD1-CD1 4.36Å; L560-Y564 HydrophobicContact CD1-CD2 4.06Å; L560-Y564 HydrophobicContact CD1-CE2 3.52Å; L560-Y564 HydrophobicContact CD2-CE2 4.11Å; L560-Y564 HydrophobicContact CG-CD2 3.9Å; L560-Y564 HydrophobicContact CG-CE2 3.57Å; L560-Y564 WeakPolarHBondContact O-CD2 2.99Å; L560-Y564 PolarHBondContact O-N 3.13Å
561	I	57.4	Low	56	Low	97 Å²	97	40 Å²	40	50%	0.497	21%	0.209	S	C	.	.	H	α-helix	trans	-70.6	-44.7	173.3	-65.1	174.7	0	0	0	110	R497 P558 L559 Y563 Y564 A565	R497-I561 VanDerWaalsContact NH1-CD1 3.35Å; P558-I561 HydrophobicContact CB-CB 4.24Å; P558-I561 HydrophobicContact CB-CD1 4.3Å; P558-I561 PolarHBondContact O-N 3.38Å; L559-I561 VanDerWaalsContact C-N 3.34Å; L559-I561 PolarHBondContact O-N 3.13Å; I561-Y563 VanDerWaalsContact C-N 3.27Å; I561-Y563 PolarHBondContact O-N 3.46Å; I561-Y564 PolarHBondContact O-N 3.4Å; I561-A565 VanDerWaalsContact O-CB 3.31Å; I561-A565 WeakPolarHBondContact O-CB 3.42Å; I561-A565 PolarHBondContact O-N 3.21Å
562	R	55.4	Low	55.9	Low	78 Å²	78	36.4 Å²	36.4	29%	0.294	19%	0.191	S	C	.	.	H	α-helix	trans	-59.4	-40.4	174.9	-173.3	175	69	163	-1.6	111.2	P558 L559 A565 N566 E839	P558-R562 PolarHBondContact O-N 2.95Å; L559-R562 PolarHBondContact O-N 3.21Å; R562-A565 PolarHBondContact O-N 3.24Å; R562-N566 WeakPolarHBondContact O-CB 3.38Å; R562-N566 VanDerWaalsContact O-CG 3.24Å; R562-N566 PolarHBondContact O-N 2.98Å; R562-E839 WeakPolarHBondContact CD-OE1 3.47Å; R562-E839 IonicContact CZ-OE1 3.75Å; R562-E839 IonicContact NE-OE1 2.74Å; R562-E839 IonicContact NH1-OE1 2.64Å; R562-E839 PolarHBondContact NH1-OE1 2.95Å
563	Y	60.5	Low	56.3	Low	27 Å²	27	36.2 Å²	36.2	11%	0.106	19%	0.191	C	C	.	.	H	α-helix	trans	-60.2	-52.4	174.4	174.3	-107.9	0	0	0	112.4	I352 M531 L559 L560 I561 A565 N566 Q567	I352-Y563 HydrophobicContact CD1-CG 4.34Å; I352-Y563 HydrophobicContact CG1-CG 4.4Å; I352-Y563 HydrophobicContact CG2-CD1 3.73Å; I352-Y563 HydrophobicContact CG2-CD2 3.87Å; I352-Y563 HydrophobicContact CG2-CE1 3.93Å; I352-Y563 HydrophobicContact CG2-CE2 4.09Å; I352-Y563 HydrophobicContact CG2-CG 3.69Å; M531-Y563 HydrophobicContact CE-CD2 4.11Å; M531-Y563 HydrophobicContact CE-CE2 3.32Å; M531-Y563 HydrophobicContact SD-CE2 4.01Å; L559-Y563 WeakPolarHBondContact O-CB 2.92Å; L559-Y563 PolarHBondContact O-N 3.37Å; L560-Y563 HydrophobicContact CD1-CD1 4.36Å; I561-Y563 VanDerWaalsContact C-N 3.27Å; I561-Y563 PolarHBondContact O-N 3.46Å; Y563-A565 VanDerWaalsContact C-N 3.34Å; Y563-A565 PolarHBondContact O-N 3.2Å; Y563-N566 PolarHBondContact O-N 3.28Å; Y563-Q567 HydrophobicContact CD2-CG 4.12Å; Y563-Q567 HydrophobicContact CE1-CG 4.27Å; Y563-Q567 HydrophobicContact CE2-CG 3.66Å; Y563-Q567 WeakPolarHBondContact O-CB 3.32Å; Y563-Q567 VanDerWaalsContact O-CG 3.27Å; Y563-Q567 WeakPolarHBondContact O-CG 3.47Å; Y563-Q567 PolarHBondContact O-N 3.31Å; Y563-Q567 PolarHBondContact OH-NE2 2.82Å
564	Y	56.2	Low	56.8	Low	13 Å²	13	37.4 Å²	37.4	5%	0.051	20%	0.199	C	C	.	.	H	α-helix	trans	-64.8	-35.3	178.2	-76.1	-58.4	0	0	0	113	L560 I561 L568 F645 W649 P650	L560-Y564 HydrophobicContact CD1-CD2 4.06Å; L560-Y564 HydrophobicContact CD1-CE2 3.52Å; L560-Y564 HydrophobicContact CD2-CE2 4.11Å; L560-Y564 HydrophobicContact CG-CD2 3.9Å; L560-Y564 HydrophobicContact CG-CE2 3.57Å; L560-Y564 WeakPolarHBondContact O-CD2 2.99Å; L560-Y564 PolarHBondContact O-N 3.13Å; I561-Y564 PolarHBondContact O-N 3.4Å; Y564-L568 WeakPolarHBondContact O-CB 3.48Å; Y564-L568 PolarHBondContact O-N 3.34Å; Y564-F645 AromaticContact CD1-CE2 3.99Å; Y564-F645 HydrophobicContact CD1-CE2 3.99Å; Y564-F645 AromaticContact CD1-CZ 3.92Å; Y564-F645 HydrophobicContact CD1-CZ 3.92Å; Y564-F645 HydrophobicContact CE1-CE2 4.46Å; Y564-W649 HydrophobicContact CD1-CD2 4.42Å; Y564-W649 HydrophobicContact CD1-CE3 4.39Å; Y564-W649 HydrophobicContact CG-CH2 4.46Å; Y564-W649 HydrophobicContact CG-CZ2 4.29Å; Y564-P650 HydrophobicContact CE2-CG 4.05Å; Y564-P650 VanDerWaalsContact OH-CD 3.29Å; Y564-P650 WeakPolarHBondContact OH-CD 3.24Å
565	A	52.2	Low	57.4	Low	28 Å²	28	35.7 Å²	35.7	23%	0.231	19%	0.19	C	C	.	.	H	α-helix	trans	-65	-48	175	0	0	0	0	0	111.7	I561 R562 Y563 Q567 L568 I569	I561-A565 VanDerWaalsContact O-CB 3.31Å; I561-A565 WeakPolarHBondContact O-CB 3.42Å; I561-A565 PolarHBondContact O-N 3.21Å; R562-A565 PolarHBondContact O-N 3.24Å; Y563-A565 VanDerWaalsContact C-N 3.34Å; Y563-A565 PolarHBondContact O-N 3.2Å; A565-Q567 VanDerWaalsContact C-N 3.35Å; A565-Q567 PolarHBondContact O-N 2.87Å; A565-L568 WeakPolarHBondContact O-CB 3.21Å; A565-L568 PolarHBondContact O-N 3.36Å; A565-I569 WeakPolarHBondContact O-CG1 3.49Å; A565-I569 PolarHBondContact O-N 3.08Å
566	N	56.7	Low	58.1	Low	49 Å²	49	31.6 Å²	31.6	26%	0.262	17%	0.165	S	C	.	.	H	α-helix	trans	-65.2	-37.9	179.1	-71.6	-2.4	0	0	0	112	R562 Y563 I569 S570	R562-N566 WeakPolarHBondContact O-CB 3.38Å; R562-N566 VanDerWaalsContact O-CG 3.24Å; R562-N566 PolarHBondContact O-N 2.98Å; Y563-N566 PolarHBondContact O-N 3.28Å; N566-I569 PolarHBondContact O-N 2.87Å; N566-S570 WeakPolarHBondContact O-CB 3.24Å; N566-S570 PolarHBondContact O-N 3.01Å
567	Q	58.4	Low	59.3	Low	13 Å²	13	34.7 Å²	34.7	6%	0.061	18%	0.177	C	C	.	.	H	α-helix	trans	-66	-42.6	173.1	-68.8	-74.8	41.4	0	0	112	Y563 A565 I569 S570 C571 F645	Y563-Q567 HydrophobicContact CD2-CG 4.12Å; Y563-Q567 HydrophobicContact CE1-CG 4.27Å; Y563-Q567 HydrophobicContact CE2-CG 3.66Å; Y563-Q567 WeakPolarHBondContact O-CB 3.32Å; Y563-Q567 VanDerWaalsContact O-CG 3.27Å; Y563-Q567 WeakPolarHBondContact O-CG 3.47Å; Y563-Q567 PolarHBondContact O-N 3.31Å; Y563-Q567 PolarHBondContact OH-NE2 2.82Å; A565-Q567 VanDerWaalsContact C-N 3.35Å; A565-Q567 PolarHBondContact O-N 2.87Å; Q567-I569 PolarHBondContact O-N 2.8Å; Q567-S570 PolarHBondContact O-N 3.41Å; Q567-C571 PolarHBondContact O-N 2.74Å; Q567-C571 PolarHBondContact O-SG 2.69Å; Q567-C571 VanDerWaalsContact O-SG 3.42Å; Q567-F645 HydrophobicContact CB-CD2 4.45Å; Q567-F645 HydrophobicContact CB-CE1 4.21Å; Q567-F645 HydrophobicContact CB-CE2 3.55Å; Q567-F645 HydrophobicContact CB-CZ 3.41Å; Q567-F645 VanDerWaalsContact CB-CZ 3.41Å; Q567-F645 HydrophobicContact CG-CE2 4.27Å; Q567-F645 HydrophobicContact CG-CZ 4.5Å
568	L	56.7	Low	60.1	Low	33 Å²	33	30.4 Å²	30.4	17%	0.173	16%	0.161	C	C	.	.	H	α-helix	trans	-58.1	-48.3	173.9	-174	77.3	0	0	0	111.3	Y564 A565 S570 C571 M572 L642 F645 L646 W649	Y564-L568 WeakPolarHBondContact O-CB 3.48Å; Y564-L568 PolarHBondContact O-N 3.34Å; A565-L568 WeakPolarHBondContact O-CB 3.21Å; A565-L568 PolarHBondContact O-N 3.36Å; L568-S570 VanDerWaalsContact C-N 3.34Å; L568-S570 PolarHBondContact O-N 2.99Å; L568-C571 PolarHBondContact O-N 2.93Å; L568-M572 HydrophobicContact CG-SD 4.49Å; L568-M572 WeakPolarHBondContact O-CG 3.41Å; L568-M572 PolarHBondContact O-N 3.22Å; L568-L642 HydrophobicContact CD1-CD1 4.28Å; L568-F645 HydrophobicContact CB-CE1 3.99Å; L568-F645 HydrophobicContact CD1-CE1 4.15Å; L568-L646 HydrophobicContact CD1-CD2 4.11Å; L568-W649 HydrophobicContact CB-CZ3 4.36Å; L568-W649 HydrophobicContact CD1-CZ3 4.31Å
569	I	55.7	Low	60.6	Low	22 Å²	22	29.7 Å²	29.7	11%	0.113	16%	0.155	C	C	.	.	H	α-helix	trans	-58.6	-47.2	176.7	-68.5	166.3	0	0	0	109.6	A565 N566 Q567 C571 M572 V573 L828 L831 Q832 Q835	A565-I569 WeakPolarHBondContact O-CG1 3.49Å; A565-I569 PolarHBondContact O-N 3.08Å; N566-I569 PolarHBondContact O-N 2.87Å; Q567-I569 PolarHBondContact O-N 2.8Å; I569-C571 PolarHBondContact O-N 2.99Å; I569-M572 CarbonylContact O-C 3.58Å; I569-M572 WeakPolarHBondContact O-CA 3.44Å; I569-M572 WeakPolarHBondContact O-CB 3.21Å; I569-M572 PolarHBondContact O-N 3.04Å; I569-V573 HydrophobicContact CG2-CG2 4.37Å; I569-V573 WeakPolarHBondContact O-CG2 3.44Å; I569-V573 PolarHBondContact O-N 2.87Å; I569-L828 HydrophobicContact CG2-CD1 4.46Å; I569-L831 HydrophobicContact CD1-CB 4.49Å; I569-L831 HydrophobicContact CG1-CB 4.36Å; I569-Q832 HydrophobicContact CG2-CG 4.08Å; I569-Q835 HydrophobicContact CD1-CB 4.37Å
570	S	60	Low	60.8	Low	34 Å²	34	33.9 Å²	33.9	24%	0.238	17%	0.174	C	C	.	.	H	α-helix	trans	-62	-41.8	-179.1	-163.9	0	0	0	0	113.5	F530 N566 Q567 L568 M572 V573 S574	F530-S570 WeakPolarHBondContact CD1-OG 3.49Å; F530-S570 VanDerWaalsContact CE1-OG 3.31Å; F530-S570 WeakPolarHBondContact CE1-OG 3.44Å; N566-S570 WeakPolarHBondContact O-CB 3.24Å; N566-S570 PolarHBondContact O-N 3.01Å; Q567-S570 PolarHBondContact O-N 3.41Å; L568-S570 VanDerWaalsContact C-N 3.34Å; L568-S570 PolarHBondContact O-N 2.99Å; S570-M572 VanDerWaalsContact C-N 3.34Å; S570-M572 PolarHBondContact O-N 2.66Å; S570-V573 PolarHBondContact O-N 2.86Å; S570-S574 PolarHBondContact O-N 3.06Å; S570-S574 PolarHBondContact O-OG 2.81Å
571	C	59.9	Low	61.5	Low	14 Å²	14	36.8 Å²	36.8	10%	0.095	19%	0.193	C	C	.	.	H	α-helix	trans	-63.5	-38.8	171.6	-66.3	0	0	0	0	112	Q567 L568 I569 S574 I575 L642	Q567-C571 PolarHBondContact O-N 2.74Å; Q567-C571 PolarHBondContact O-SG 2.69Å; Q567-C571 VanDerWaalsContact O-SG 3.42Å; L568-C571 PolarHBondContact O-N 2.93Å; I569-C571 PolarHBondContact O-N 2.99Å; C571-S574 PolarHBondContact O-N 2.8Å; C571-I575 PolarHBondContact O-N 3.23Å; C571-I575 VanDerWaalsContact O-N 3.09Å; C571-L642 HydrophobicContact CB-CB 4.39Å; C571-L642 HydrophobicContact CB-CD1 3.84Å
572	M	55.4	Low	62	Low	8 Å²	8	32.5 Å²	32.5	4%	0.039	17%	0.171	C	C	.	.	H	α-helix	trans	-69.3	-32.7	175.5	-71.8	-171.7	66.1	0	0	113.6	L568 I569 S570 G576 L759 W824 L828 L831	L568-M572 HydrophobicContact CG-SD 4.49Å; L568-M572 WeakPolarHBondContact O-CG 3.41Å; L568-M572 PolarHBondContact O-N 3.22Å; I569-M572 CarbonylContact O-C 3.58Å; I569-M572 WeakPolarHBondContact O-CA 3.44Å; I569-M572 WeakPolarHBondContact O-CB 3.21Å; I569-M572 PolarHBondContact O-N 3.04Å; S570-M572 VanDerWaalsContact C-N 3.34Å; S570-M572 PolarHBondContact O-N 2.66Å; M572-G576 PolarHBondContact O-N 3.23Å; M572-L759 HydrophobicContact CE-CD1 4.26Å; M572-L759 HydrophobicContact CE-CD2 4.28Å; M572-L759 HydrophobicContact SD-CD2 4.49Å; M572-W824 HydrophobicContact CB-CZ2 4.15Å; M572-W824 HydrophobicContact CE-CH2 4.16Å; M572-W824 HydrophobicContact CE-CZ2 3.85Å; M572-W824 HydrophobicContact CG-CZ2 4Å; M572-W824 PolarHBondContact O-NE1 2.79Å; M572-L828 HydrophobicContact CB-CD1 3.88Å; M572-L831 HydrophobicContact CE-CD1 4.29Å; M572-L831 HydrophobicContact SD-CD1 4.15Å
573	V	62.7	Low	62.7	Low	30 Å²	30	29.3 Å²	29.3	18%	0.182	16%	0.16	C	C	.	.	H	α-helix	trans	-60.6	-52.3	169.6	178.4	0	0	0	0	109.4	I569 S570 I575 G576 Q577 L828	I569-V573 HydrophobicContact CG2-CG2 4.37Å; I569-V573 WeakPolarHBondContact O-CG2 3.44Å; I569-V573 PolarHBondContact O-N 2.87Å; S570-V573 PolarHBondContact O-N 2.86Å; V573-I575 VanDerWaalsContact C-N 3.31Å; V573-I575 PolarHBondContact O-N 2.94Å; V573-G576 WeakPolarHBondContact O-CA 3.31Å; V573-G576 PolarHBondContact O-N 3.48Å; V573-Q577 HydrophobicContact CG1-CG 4.28Å; V573-Q577 WeakPolarHBondContact O-CG 3.44Å; V573-Q577 PolarHBondContact O-N 2.87Å; V573-L828 HydrophobicContact CB-CD1 4.46Å; V573-L828 HydrophobicContact CB-CD2 4.23Å; V573-L828 HydrophobicContact CG2-CD1 3.77Å; V573-L828 HydrophobicContact CG2-CD2 3.97Å; V573-L828 HydrophobicContact CG2-CG 4.21Å
574	S	65.3	Low	63.2	Low	25 Å²	25	34.2 Å²	34.2	18%	0.175	18%	0.183	C	C	.	.	H	α-helix	trans	-59	-41.4	-175.3	-55.6	0	0	0	0	112.3	S570 C571 A578	S570-S574 PolarHBondContact O-N 3.06Å; S570-S574 PolarHBondContact O-OG 2.81Å; C571-S574 PolarHBondContact O-N 2.8Å; S574-A578 PolarHBondContact O-N 2.78Å
575	I	66	Low	63.9	Low	7 Å²	7	35 Å²	35	4%	0.036	19%	0.188	C	C	.	.	H	α-helix	trans	-70.1	-39.4	174.6	-72	168.5	0	0	0	111.8	C571 V573 A578 L579 F635 K638 L642 W824	C571-I575 PolarHBondContact O-N 3.23Å; C571-I575 VanDerWaalsContact O-N 3.09Å; V573-I575 VanDerWaalsContact C-N 3.31Å; V573-I575 PolarHBondContact O-N 2.94Å; I575-A578 PolarHBondContact O-N 2.88Å; I575-L579 HydrophobicContact CG2-CD1 4.06Å; I575-L579 HydrophobicContact CG2-CG 4.49Å; I575-L579 WeakPolarHBondContact O-CG 3.45Å; I575-L579 PolarHBondContact O-N 2.84Å; I575-F635 HydrophobicContact CG2-CE2 4.03Å; I575-K638 HydrophobicContact CG1-CB 3.95Å; I575-L642 HydrophobicContact CD1-CB 3.57Å; I575-L642 HydrophobicContact CD1-CD2 3.47Å; I575-L642 VanDerWaalsContact CD1-CD2 3.47Å; I575-L642 HydrophobicContact CD1-CG 4.12Å; I575-W824 HydrophobicContact CB-CZ2 4.08Å; I575-W824 HydrophobicContact CG2-CH2 4.16Å; I575-W824 HydrophobicContact CG2-CZ2 3.65Å
576	G	62.4	Low	64.5	Low	0 Å²	0	34 Å²	34	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60.3	-45.3	177.1	0	0	0	0	0	112.4	M572 V573 L579 E580 W824	M572-G576 PolarHBondContact O-N 3.23Å; V573-G576 WeakPolarHBondContact O-CA 3.31Å; V573-G576 PolarHBondContact O-N 3.48Å; G576-L579 WeakPolarHBondContact O-CB 3.38Å; G576-L579 PolarHBondContact O-N 2.78Å; G576-E580 WeakPolarHBondContact O-CB 3.42Å; G576-E580 PolarHBondContact O-N 2.9Å; G576-W824 VanDerWaalsContact CA-CD1 3.49Å
577	Q	69.9	Low	65	Low	106 Å²	106	33.8 Å²	33.8	50%	0.495	18%	0.177	S	C	.	.	H	α-helix	trans	-64	-41.8	176.2	-69.9	173	-29.5	0	0	112.2	V573 L579 E580 V581	V573-Q577 HydrophobicContact CG1-CG 4.28Å; V573-Q577 WeakPolarHBondContact O-CG 3.44Å; V573-Q577 PolarHBondContact O-N 2.87Å; Q577-L579 VanDerWaalsContact C-N 3.34Å; Q577-L579 PolarHBondContact O-N 3Å; Q577-E580 PolarHBondContact O-N 3.09Å; Q577-V581 WeakPolarHBondContact O-CG2 3.5Å; Q577-V581 PolarHBondContact O-N 2.84Å
578	A	68.5	Low	65.6	Low	3 Å²	3	35.9 Å²	35.9	3%	0.025	19%	0.191	C	C	.	.	H	α-helix	trans	-64.6	-36.5	175.9	0	0	0	0	0	112.7	S574 I575 L582 F635	S574-A578 PolarHBondContact O-N 2.78Å; I575-A578 PolarHBondContact O-N 2.88Å; A578-L582 PolarHBondContact O-N 3.31Å; A578-F635 HydrophobicContact CB-CB 4.08Å; A578-F635 HydrophobicContact CB-CD2 4.14Å
579	L	68.2	Low	66	Low	7 Å²	7	36 Å²	36	4%	0.037	19%	0.189	C	C	.	.	H	α-helix	trans	-66.3	-39.6	171.8	-73.2	169	0	0	0	112.5	I575 G576 Q577 L582 V583 F635 M777 W824	I575-L579 HydrophobicContact CG2-CD1 4.06Å; I575-L579 HydrophobicContact CG2-CG 4.49Å; I575-L579 WeakPolarHBondContact O-CG 3.45Å; I575-L579 PolarHBondContact O-N 2.84Å; G576-L579 WeakPolarHBondContact O-CB 3.38Å; G576-L579 PolarHBondContact O-N 2.78Å; Q577-L579 VanDerWaalsContact C-N 3.34Å; Q577-L579 PolarHBondContact O-N 3Å; L579-L582 WeakPolarHBondContact O-CB 3.15Å; L579-L582 PolarHBondContact O-N 2.96Å; L579-V583 WeakPolarHBondContact O-CG2 3.31Å; L579-V583 PolarHBondContact O-N 2.82Å; L579-F635 HydrophobicContact CD1-CE2 4.23Å; L579-F635 HydrophobicContact CD2-CD2 3.89Å; L579-F635 HydrophobicContact CD2-CE2 3.35Å; L579-F635 HydrophobicContact CD2-CZ 3.85Å; L579-F635 HydrophobicContact CG-CD2 3.97Å; L579-F635 HydrophobicContact CG-CE2 3.56Å; L579-F635 HydrophobicContact CG-CZ 4.49Å; L579-M777 HydrophobicContact CD2-CE 3.57Å; L579-W824 HydrophobicContact CD1-CD2 4.42Å; L579-W824 HydrophobicContact CD1-CG 4.42Å
580	E	68.7	Low	66.4	Low	103 Å²	103	37.9 Å²	37.9	48%	0.481	20%	0.198	S	C	.	.	H	α-helix	trans	-66.4	-41.7	-179.6	-172.6	163	-146.3	0	0	111.8	G576 Q577 L582 V583 H584	G576-E580 WeakPolarHBondContact O-CB 3.42Å; G576-E580 PolarHBondContact O-N 2.9Å; Q577-E580 PolarHBondContact O-N 3.09Å; E580-L582 VanDerWaalsContact C-N 3.35Å; E580-L582 PolarHBondContact O-N 3.18Å; E580-V583 PolarHBondContact O-N 2.75Å; E580-H584 WeakPolarHBondContact O-CB 3.25Å; E580-H584 PolarHBondContact O-N 3.02Å
581	V	75.3	Confident	66.5	Low	76 Å²	76	42.1 Å²	42.1	46%	0.461	21%	0.214	S	C	.	.	H	α-helix	trans	-60.6	-41.5	172.7	172.1	0	0	0	0	112	Q577 H584 L585 A631	Q577-V581 WeakPolarHBondContact O-CG2 3.5Å; Q577-V581 PolarHBondContact O-N 2.84Å; V581-H584 PolarHBondContact O-N 2.85Å; V581-L585 HydrophobicContact CG1-CD1 4.01Å; V581-L585 WeakPolarHBondContact O-CB 3.27Å; V581-L585 PolarHBondContact O-N 3.41Å; V581-A631 HydrophobicContact CG1-CB 4.03Å
582	L	68.7	Low	66.6	Low	7 Å²	7	46.3 Å²	46.3	4%	0.037	23%	0.232	C	C	.	.	H	α-helix	trans	-62.8	-39.6	176.1	-91.9	160.7	0	0	0	113.1	A578 L579 E580 T586 L628 A631 I632 F635 L781	A578-L582 PolarHBondContact O-N 3.31Å; L579-L582 WeakPolarHBondContact O-CB 3.15Å; L579-L582 PolarHBondContact O-N 2.96Å; E580-L582 VanDerWaalsContact C-N 3.35Å; E580-L582 PolarHBondContact O-N 3.18Å; L582-T586 PolarHBondContact O-N 3.08Å; L582-T586 PolarHBondContact O-OG1 2.94Å; L582-L628 HydrophobicContact CD2-CD1 4Å; L582-A631 HydrophobicContact CD2-CB 4.39Å; L582-A631 HydrophobicContact CG-CB 4.23Å; L582-I632 HydrophobicContact CD2-CG1 3.85Å; L582-F635 HydrophobicContact CD1-CB 3.76Å; L582-F635 HydrophobicContact CD1-CD1 4.43Å; L582-F635 HydrophobicContact CD1-CG 3.98Å; L582-L781 HydrophobicContact CD2-CD1 4.2Å
583	V	68.4	Low	66.6	Low	10 Å²	10	48.6 Å²	48.6	6%	0.061	24%	0.243	C	C	.	.	H	α-helix	trans	-70.7	-45.1	175.7	171.1	0	0	0	0	111	L579 E580 L585 T586 E587 I817 K818	L579-V583 WeakPolarHBondContact O-CG2 3.31Å; L579-V583 PolarHBondContact O-N 2.82Å; E580-V583 PolarHBondContact O-N 2.75Å; V583-L585 PolarHBondContact O-N 3.03Å; V583-T586 PolarHBondContact O-N 2.85Å; V583-T586 PolarHBondContact O-OG1 3.34Å; V583-E587 HydrophobicContact CG1-CG 4.46Å; V583-E587 WeakPolarHBondContact CG1-OE1 3.35Å; V583-E587 WeakPolarHBondContact O-CG 3.46Å; V583-E587 PolarHBondContact O-N 3.45Å; V583-I817 HydrophobicContact CG2-CG2 3.77Å; V583-K818 HydrophobicContact CG1-CB 4.43Å; V583-K818 HydrophobicContact CG1-CG 4.29Å
584	H	72.9	Confident	66.1	Low	130 Å²	130	52.8 Å²	52.8	60%	0.602	26%	0.261	S	S	*	.	H	α-helix	trans	-59.9	-46.7	178.3	-169.8	-44.5	0	0	0	111.5	E580 V581 T586 E587 T588	E580-H584 WeakPolarHBondContact O-CB 3.25Å; E580-H584 PolarHBondContact O-N 3.02Å; V581-H584 PolarHBondContact O-N 2.85Å; H584-T586 VanDerWaalsContact C-N 3.32Å; H584-T586 PolarHBondContact O-N 3.22Å; H584-E587 PolarHBondContact O-N 3.01Å; H584-T588 PolarHBondContact CE1-OG1 3.2Å; H584-T588 PolarHBondContact ND1-OG1 3.47Å; H584-T588 PolarHBondContact O-N 2.82Å; H584-T588 PolarHBondContact O-OG1 3.2Å
585	L	70.1	Confident	65.4	Low	29 Å²	29	58.2 Å²	58.2	15%	0.152	28%	0.283	C	S	.	.	H	α-helix	trans	-55.5	-45.8	178	-85.4	163.8	0	0	0	112	V581 V583 T588 Y589 F624 K627 A631	V581-L585 HydrophobicContact CG1-CD1 4.01Å; V581-L585 WeakPolarHBondContact O-CB 3.27Å; V581-L585 PolarHBondContact O-N 3.41Å; V583-L585 PolarHBondContact O-N 3.03Å; L585-T588 PolarHBondContact O-N 3.02Å; L585-Y589 PolarHBondContact O-N 2.87Å; L585-Y589 VanDerWaalsContact O-N 3.14Å; L585-F624 HydrophobicContact CB-CE2 4.08Å; L585-F624 HydrophobicContact CD2-CD2 4.18Å; L585-F624 HydrophobicContact CD2-CE2 4.13Å; L585-F624 VanDerWaalsContact O-CE2 3.3Å; L585-F624 WeakPolarHBondContact O-CE2 3.49Å; L585-K627 HydrophobicContact CD2-CB 3.94Å; L585-A631 HydrophobicContact CD1-CB 3.76Å
586	T	65.1	Low	64.6	Low	7 Å²	7	61 Å²	61	4%	0.043	30%	0.303	C	S	.	.	H	α-helix	trans	-73.6	-29.3	-179.3	40.4	0	0	0	0	114	L582 V583 H584 Y589 E590 L781	L582-T586 PolarHBondContact O-N 3.08Å; L582-T586 PolarHBondContact O-OG1 2.94Å; V583-T586 PolarHBondContact O-N 2.85Å; V583-T586 PolarHBondContact O-OG1 3.34Å; H584-T586 VanDerWaalsContact C-N 3.32Å; H584-T586 PolarHBondContact O-N 3.22Å; T586-Y589 PolarHBondContact O-N 2.89Å; T586-E590 PolarHBondContact O-N 3.3Å; T586-E590 VanDerWaalsContact O-N 3.08Å; T586-L781 HydrophobicContact CG2-CD2 3.81Å
587	E	67.2	Low	63.6	Low	45 Å²	45	65.8 Å²	65.8	21%	0.21	33%	0.329	C	S	.	.	H	α-helix	trans	-70.2	-39	170.8	-71.8	-176.3	-149.5	0	0	112.7	V583 H584 Y589 E590 Q591 L814 K818	V583-E587 HydrophobicContact CG1-CG 4.46Å; V583-E587 WeakPolarHBondContact CG1-OE1 3.35Å; V583-E587 WeakPolarHBondContact O-CG 3.46Å; V583-E587 PolarHBondContact O-N 3.45Å; H584-E587 PolarHBondContact O-N 3.01Å; E587-Y589 VanDerWaalsContact C-N 3.26Å; E587-Y589 PolarHBondContact O-N 2.94Å; E587-E590 PolarHBondContact O-N 3.06Å; E587-Q591 WeakPolarHBondContact O-CG 3.31Å; E587-Q591 PolarHBondContact O-N 3.1Å; E587-Q591 VanDerWaalsContact O-N 3.08Å; E587-L814 HydrophobicContact CG-CD2 4.39Å; E587-K818 WeakPolarHBondContact OE1-CD 3.35Å; E587-K818 WeakPolarHBondContact OE1-CE 3.35Å; E587-K818 IonicContact OE1-NZ 3.71Å; E587-K818 PolarHBondContact OE1-NZ 3.14Å; E587-K818 IonicContact OE2-NZ 3.01Å; E587-K818 PolarHBondContact OE2-NZ 3.15Å
588	T	70.2	Confident	62.3	Low	58 Å²	58	65.1 Å²	65.1	36%	0.356	33%	0.331	S	S	.	.	H	α-helix	trans	-60.6	-38.2	173.3	-44.9	0	0	0	0	111.1	H584 L585 Q591 H592	H584-T588 PolarHBondContact CE1-OG1 3.2Å; H584-T588 PolarHBondContact ND1-OG1 3.47Å; H584-T588 PolarHBondContact O-N 2.82Å; H584-T588 PolarHBondContact O-OG1 3.2Å; L585-T588 PolarHBondContact O-N 3.02Å; T588-Q591 PolarHBondContact O-N 3.14Å; T588-H592 WeakPolarHBondContact O-CB 3.26Å; T588-H592 PolarHBondContact O-N 2.87Å
589	Y	66.3	Low	61	Low	35 Å²	35	70 Å²	70	14%	0.137	36%	0.361	C	S	.	.	H	α-helix	trans	-69.9	-42.1	178.6	-167.7	-105.4	0	0	0	112.9	L585 T586 E587 Q591 H592 I593 F624 I785	L585-Y589 PolarHBondContact O-N 2.87Å; L585-Y589 VanDerWaalsContact O-N 3.14Å; T586-Y589 PolarHBondContact O-N 2.89Å; E587-Y589 VanDerWaalsContact C-N 3.26Å; E587-Y589 PolarHBondContact O-N 2.94Å; Y589-Q591 VanDerWaalsContact C-N 3.31Å; Y589-Q591 PolarHBondContact O-N 2.86Å; Y589-H592 PolarHBondContact O-N 3.06Å; Y589-I593 HydrophobicContact CD1-CD1 3.87Å; Y589-I593 HydrophobicContact CE1-CD1 3.42Å; Y589-I593 VanDerWaalsContact CE1-CD1 3.42Å; Y589-I593 HydrophobicContact CE2-CD1 4.34Å; Y589-I593 HydrophobicContact CG-CD1 4.5Å; Y589-I593 PolarHBondContact O-N 2.93Å; Y589-F624 HydrophobicContact CD1-CE1 4.12Å; Y589-F624 HydrophobicContact CD1-CZ 4.37Å; Y589-F624 AromaticContact CD2-CD1 3.38Å; Y589-F624 HydrophobicContact CD2-CD1 3.38Å; Y589-F624 HydrophobicContact CD2-CD2 4.12Å; Y589-F624 AromaticContact CD2-CE1 3.43Å; Y589-F624 HydrophobicContact CD2-CE1 3.43Å; Y589-F624 VanDerWaalsContact CD2-CE1 3.43Å; Y589-F624 HydrophobicContact CD2-CE2 4.18Å; Y589-F624 AromaticContact CD2-CG 3.74Å; Y589-F624 HydrophobicContact CD2-CG 3.74Å; Y589-F624 AromaticContact CD2-CZ 3.85Å; Y589-F624 HydrophobicContact CD2-CZ 3.85Å; Y589-F624 HydrophobicContact CE1-CE1 4.39Å; Y589-F624 AromaticContact CE2-CD1 3.51Å; Y589-F624 HydrophobicContact CE2-CD1 3.51Å; Y589-F624 AromaticContact CE2-CE1 3.76Å; Y589-F624 HydrophobicContact CE2-CE1 3.76Å; Y589-F624 HydrophobicContact CE2-CG 4.17Å; Y589-F624 HydrophobicContact CG-CD1 4.08Å; Y589-F624 AromaticContact CG-CE1 3.63Å; Y589-F624 HydrophobicContact CG-CE1 3.63Å; Y589-F624 HydrophobicContact CG-CE2 4.22Å; Y589-F624 AromaticContact CG-CZ 3.72Å; Y589-F624 HydrophobicContact CG-CZ 3.72Å; Y589-I785 HydrophobicContact CE1-CG1 4.38Å
590	E	63	Low	59.7	Low	62 Å²	62	74.9 Å²	74.9	29%	0.29	39%	0.391	S	S	.	.	H	α-helix	trans	-58.3	-43.7	171.5	-92.7	-158	-179.8	0	0	111.1	T586 E587 H594 L814	T586-E590 PolarHBondContact O-N 3.3Å; T586-E590 VanDerWaalsContact O-N 3.08Å; E587-E590 PolarHBondContact O-N 3.06Å; E590-H594 WeakPolarHBondContact O-CB 3.34Å; E590-H594 PolarHBondContact O-N 3.18Å; E590-L814 HydrophobicContact CG-CD2 4.28Å
591	Q	63.3	Low	57.9	Low	123 Å²	123	75.5 Å²	75.5	58%	0.575	40%	0.402	S	S	*	.	H	α-helix	trans	-63	-48.8	179.3	-72.5	173.2	-7.5	0	0	112.3	E587 T588 Y589 I593 H594 E595	E587-Q591 WeakPolarHBondContact O-CG 3.31Å; E587-Q591 PolarHBondContact O-N 3.1Å; E587-Q591 VanDerWaalsContact O-N 3.08Å; T588-Q591 PolarHBondContact O-N 3.14Å; Y589-Q591 VanDerWaalsContact C-N 3.31Å; Y589-Q591 PolarHBondContact O-N 2.86Å; Q591-I593 PolarHBondContact O-N 3.11Å; Q591-H594 PolarHBondContact O-N 3.49Å; Q591-E595 PolarHBondContact O-N 3.08Å
592	H	61.1	Low	55.8	Low	102 Å²	102	76.8 Å²	76.8	47%	0.472	41%	0.41	S	S	.	.	H	α-helix	trans	-66.2	-25.9	-176.1	-155.3	-30.8	0	0	0	113.1	T588 Y589 N620	T588-H592 WeakPolarHBondContact O-CB 3.26Å; T588-H592 PolarHBondContact O-N 2.87Å; Y589-H592 PolarHBondContact O-N 3.06Å; H592-N620 PolarHBondContact NE2-ND2 2.98Å
593	I	55.8	Low	54	Low	55 Å²	55	83.4 Å²	83.4	28%	0.282	45%	0.451	S	S	.	.	H	α-helix	trans	-79.5	-35	169.7	-69.5	176.2	0	0	0	111.6	Y589 Q591 S596 L597	Y589-I593 HydrophobicContact CD1-CD1 3.87Å; Y589-I593 HydrophobicContact CE1-CD1 3.42Å; Y589-I593 VanDerWaalsContact CE1-CD1 3.42Å; Y589-I593 HydrophobicContact CE2-CD1 4.34Å; Y589-I593 HydrophobicContact CG-CD1 4.5Å; Y589-I593 PolarHBondContact O-N 2.93Å; Q591-I593 PolarHBondContact O-N 3.11Å; I593-S596 PolarHBondContact O-OG 3.48Å; I593-S596 VanDerWaalsContact O-OG 3.11Å; I593-L597 PolarHBondContact O-N 2.82Å
594	H	52	Low	52.2	Low	118 Å²	118	91.9 Å²	91.9	55%	0.546	49%	0.49	S	S	.	.	H	α-helix	trans	-69.6	-32.6	-179.7	-135	-57	0	0	0	112.9	E590 Q591 V598	E590-H594 WeakPolarHBondContact O-CB 3.34Å; E590-H594 PolarHBondContact O-N 3.18Å; Q591-H594 PolarHBondContact O-N 3.49Å; H594-V598 WeakPolarHBondContact O-CG2 3.29Å; H594-V598 PolarHBondContact O-N 3.28Å
595	E	51.3	Low	50.1	Low	139 Å²	139	90.9 Å²	90.9	65%	0.65	50%	0.497	S	S	*	.	H	α-helix	trans	-71	-44.8	175.2	-69.5	-174.1	142.1	0	0	112.3	Q591 L597 V598 T599	Q591-E595 PolarHBondContact O-N 3.08Å; E595-L597 PolarHBondContact O-N 2.85Å; E595-V598 PolarHBondContact O-N 3.09Å; E595-V598 VanDerWaalsContact O-N 3.09Å; E595-T599 PolarHBondContact O-N 3.48Å; E595-T599 PolarHBondContact O-OG1 3.23Å
596	S	48	Very low	48.2	Very low	66 Å²	66	96 Å²	96	46%	0.462	53%	0.525	S	S	.	.	H	α-helix	trans	-64.5	-28.5	179.4	63.5	0	0	0	0	113.2	I593 T599	I593-S596 PolarHBondContact O-OG 3.48Å; I593-S596 VanDerWaalsContact O-OG 3.11Å; S596-T599 PolarHBondContact O-OG1 2.91Å
597	L	41.4	Very low	46.5	Very low	101 Å²	101	102.2 Å²	102.2	53%	0.529	56%	0.558	S	S	.	*	H	α-helix	trans	-77.4	-24.2	175	-150.3	78.2	0	0	0	113.6	I593 E595 T600	I593-L597 PolarHBondContact O-N 2.82Å; E595-L597 PolarHBondContact O-N 2.85Å; L597-T600 PolarHBondContact O-OG1 3.31Å; L597-T600 VanDerWaalsContact O-OG1 3.09Å
598	V	42.4	Very low	44.8	Very low	91 Å²	91	106.7 Å²	106.7	55%	0.552	58%	0.583	S	S	*	*	H	α-helix	trans	-75.6	-38.6	178.2	166.8	0	0	0	0	110.8	H594 E595 T600 T601	H594-V598 WeakPolarHBondContact O-CG2 3.29Å; H594-V598 PolarHBondContact O-N 3.28Å; E595-V598 PolarHBondContact O-N 3.09Å; E595-V598 VanDerWaalsContact O-N 3.09Å; V598-T600 PolarHBondContact O-N 2.73Å; V598-T601 PolarHBondContact O-N 2.98Å; V598-T601 PolarHBondContact O-OG1 2.83Å; V598-T601 VanDerWaalsContact O-OG1 3.06Å
599	T	41.9	Very low	43	Very low	106 Å²	106	111.9 Å²	111.9	65%	0.65	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-9.9	179.7	34	0	0	0	0	115.7	E595 S596	E595-T599 PolarHBondContact O-N 3.48Å; E595-T599 PolarHBondContact O-OG1 3.23Å; S596-T599 PolarHBondContact O-OG1 2.91Å
600	T	39.6	Very low	41.3	Very low	109 Å²	109	118.5 Å²	118.5	67%	0.669	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	7.3	-179.2	55.6	0	0	0	0	114.8	L597 V598	L597-T600 PolarHBondContact O-OG1 3.31Å; L597-T600 VanDerWaalsContact O-OG1 3.09Å; V598-T600 PolarHBondContact O-N 2.73Å
601	T	32	Very low	39.6	Very low	116 Å²	116	118.3 Å²	118.3	71%	0.712	66%	0.661	S	S	*	*	S	Bend	trans	-110.8	13.3	-177.8	54.8	0	0	0	0	115.4	V598	V598-T601 PolarHBondContact O-N 2.98Å; V598-T601 PolarHBondContact O-OG1 2.83Å; V598-T601 VanDerWaalsContact O-OG1 3.06Å
602	T	30.7	Very low	38	Very low	103 Å²	103	119.6 Å²	119.6	63%	0.632	68%	0.678	S	S	*	*	S	Bend	trans	-128.4	138.8	173.9	49.5	0	0	0	0	112.5
603	T	32.2	Very low	36.6	Very low	146 Å²	146	122.6 Å²	122.6	90%	0.896	70%	0.695	S	S	*	*			trans	78.6	137.2	179.6	74.6	0	0	0	0	117
604	H	29.8	Very low	35.5	Very low	189 Å²	189	126.6 Å²	126.6	88%	0.875	72%	0.716	S	S	*	*			trans	-129.1	158.3	171.8	-112.2	-9.7	0	0	0	108
605	S	28.2	Very low	34.8	Very low	108 Å²	108	125.5 Å²	125.5	76%	0.755	71%	0.714	S	S	*	*			trans	84.9	129.5	171	78.5	0	0	0	0	119.9
606	N	30.2	Very low	34.5	Very low	138 Å²	138	125.3 Å²	125.3	74%	0.738	72%	0.718	S	S	*	*			trans	78.2	84.9	148.1	-61.9	-0.2	0	0	0	121.9
607	N	29.7	Very low	34.4	Very low	136 Å²	136	126.5 Å²	126.5	73%	0.727	73%	0.726	S	S	*	*				70.7	113.4	121.1	-64.9	1.5	0	0	0	122.2
608	N	30.7	Very low	34.6	Very low	140 Å²	140	127.6 Å²	127.6	75%	0.749	73%	0.729	S	S	*	*			trans	57	108	131	-60.1	1.8	0	0	0	120.1
609	N	32.9	Very low	34.5	Very low	167 Å²	167	128.6 Å²	128.6	89%	0.893	73%	0.73	S	S	*	*				-153.1	155.9	111.3	-102.5	-40.4	0	0	0	111.6
610	N	30.6	Very low	35.3	Very low	173 Å²	173	127.4 Å²	127.4	93%	0.925	72%	0.72	S	S	*	*			trans	-82	138.8	-174.1	-70	-29.6	0	0	0	112.5
611	G	27.2	Very low	36.2	Very low	58 Å²	58	125.9 Å²	125.9	60%	0.598	71%	0.705	S	S	*	*			trans	173.9	97.6	170.1	0	0	0	0	0	114.9	I613	G611-I613 PolarHBondContact O-N 2.88Å
612	T	29.7	Very low	37.8	Very low	150 Å²	150	125.6 Å²	125.6	92%	0.92	70%	0.698	S	S	*	*			trans	32.3	80.1	154.7	52.4	0	0	0	0	118
613	I	31.4	Very low	39.6	Very low	165 Å²	165	125.2 Å²	125.2	85%	0.846	69%	0.69	S	S	*	*			trans	-127.7	82.7	156.9	-53.4	-178.8	0	0	0	109.1	G611	G611-I613 PolarHBondContact O-N 2.88Å
614	I	33.1	Very low	41.4	Very low	139 Å²	139	119.3 Å²	119.3	71%	0.713	65%	0.651	S	S	*	*			trans	-136.5	151.8	165.3	-49.8	180	0	0	0	106
615	N	38.5	Very low	43.1	Very low	95 Å²	95	116.7 Å²	116.7	51%	0.508	64%	0.638	S	S	.	*	S	Bend	trans	103.6	-29.1	173.9	-54.4	-8	0	0	0	118.2	S617 L619	N615-S617 PolarHBondContact O-N 2.83Å; N615-L619 WeakPolarHBondContact O-CB 3.27Å; N615-L619 PolarHBondContact O-N 3.29Å
616	N	43.5	Very low	45.3	Very low	136 Å²	136	117.9 Å²	117.9	73%	0.727	63%	0.631	S	S	*	*	H	α-helix	trans	-72.7	-27.1	-174.1	-81.3	13.3	0	0	0	115.1
617	S	46.7	Very low	47.5	Very low	91 Å²	91	115.8 Å²	115.8	64%	0.636	62%	0.616	S	S	*	*	H	α-helix	trans	-79	-45.1	176.1	48.7	0	0	0	0	112.3	N615 L619 N620 E621	N615-S617 PolarHBondContact O-N 2.83Å; S617-L619 PolarHBondContact O-N 3.18Å; S617-N620 PolarHBondContact O-N 3.01Å; S617-E621 PolarHBondContact O-N 2.88Å; S617-E621 VanDerWaalsContact O-N 3.1Å
618	E	44.8	Very low	49.4	Very low	124 Å²	124	109.6 Å²	109.6	58%	0.579	58%	0.582	S	S	*	*	H	α-helix	trans	-68	-35.1	-175.7	-62.9	-177.2	141.4	0	0	112.3	E621 L622	E618-E621 PolarHBondContact O-N 3.35Å; E618-L622 WeakPolarHBondContact O-CB 3.45Å; E618-L622 PolarHBondContact O-N 3.34Å
619	L	41.7	Very low	51.4	Low	112 Å²	112	107 Å²	107	59%	0.586	57%	0.572	S	S	*	*	H	α-helix	trans	-61.7	-45.7	173.8	-104.2	147.2	0	0	0	112.1	N615 S617 E621 L622 E623	N615-L619 WeakPolarHBondContact O-CB 3.27Å; N615-L619 PolarHBondContact O-N 3.29Å; S617-L619 PolarHBondContact O-N 3.18Å; L619-E621 VanDerWaalsContact C-N 3.34Å; L619-E621 PolarHBondContact O-N 3.01Å; L619-L622 PolarHBondContact O-N 3Å; L619-E623 WeakPolarHBondContact O-CB 3.43Å; L619-E623 PolarHBondContact O-N 3.42Å
620	N	58.4	Low	53.7	Low	80 Å²	80	103 Å²	103	43%	0.428	56%	0.557	S	S	.	*	H	α-helix	trans	-64.9	-37.3	176.7	-77.7	13.2	0	0	0	111.9	H592 S617 F624	H592-N620 PolarHBondContact NE2-ND2 2.98Å; S617-N620 PolarHBondContact O-N 3.01Å; N620-F624 VanDerWaalsContact O-CB 3.23Å; N620-F624 WeakPolarHBondContact O-CB 3.09Å; N620-F624 PolarHBondContact O-N 2.79Å
621	E	57.8	Low	55.7	Low	78 Å²	78	95.2 Å²	95.2	36%	0.364	52%	0.516	S	S	.	.	H	α-helix	trans	-70	-39.4	177.9	-161.1	-176.3	159.6	0	0	112.2	S617 E618 L619 K625 N789	S617-E621 PolarHBondContact O-N 2.88Å; S617-E621 VanDerWaalsContact O-N 3.1Å; E618-E621 PolarHBondContact O-N 3.35Å; L619-E621 VanDerWaalsContact C-N 3.34Å; L619-E621 PolarHBondContact O-N 3.01Å; E621-K625 WeakPolarHBondContact O-CB 3.17Å; E621-K625 PolarHBondContact O-N 2.85Å; E621-N789 PolarHBondContact OE1-ND2 2.95Å
622	L	65.4	Low	57.8	Low	109 Å²	109	93.4 Å²	93.4	57%	0.571	49%	0.493	S	S	*	.	H	α-helix	trans	-66.1	-47.6	175.8	-157.3	81.9	0	0	0	111.4	E618 L619 F624 K625 E626	E618-L622 WeakPolarHBondContact O-CB 3.45Å; E618-L622 PolarHBondContact O-N 3.34Å; L619-L622 PolarHBondContact O-N 3Å; L622-F624 VanDerWaalsContact C-N 3.33Å; L622-F624 PolarHBondContact O-N 3.38Å; L622-K625 WeakPolarHBondContact O-CB 3.14Å; L622-K625 PolarHBondContact O-N 3.08Å; L622-K625 VanDerWaalsContact O-N 3.13Å; L622-E626 PolarHBondContact O-N 3.25Å
623	E	69.4	Low	60.1	Low	96 Å²	96	92.9 Å²	92.9	45%	0.449	48%	0.478	S	S	.	.	H	α-helix	trans	-63.6	-38.4	178.5	-160.7	-155.2	-171.5	0	0	111.6	L619 E626 K627	L619-E623 WeakPolarHBondContact O-CB 3.43Å; L619-E623 PolarHBondContact O-N 3.42Å; E623-E626 PolarHBondContact O-N 3.39Å; E623-K627 VanDerWaalsContact CD-CE 3.4Å; E623-K627 HydrophobicContact CG-CD 4.34Å; E623-K627 WeakPolarHBondContact O-CB 3.45Å; E623-K627 VanDerWaalsContact O-CG 3.29Å; E623-K627 WeakPolarHBondContact O-CG 3.33Å; E623-K627 PolarHBondContact O-N 2.82Å; E623-K627 WeakPolarHBondContact OE1-CE 3.4Å; E623-K627 IonicContact OE1-NZ 2.63Å; E623-K627 PolarHBondContact OE1-NZ 3.5Å; E623-K627 IonicContact OE2-NZ 2.8Å; E623-K627 PolarHBondContact OE2-NZ 2.87Å
624	F	69	Low	62.3	Low	21 Å²	21	88.6 Å²	88.6	9%	0.092	46%	0.457	C	S	.	.	H	α-helix	trans	-60.3	-44.8	171.7	174	-108.9	0	0	0	111.9	L585 Y589 N620 L622 E626 K627 L628 I785	L585-F624 HydrophobicContact CB-CE2 4.08Å; L585-F624 HydrophobicContact CD2-CD2 4.18Å; L585-F624 HydrophobicContact CD2-CE2 4.13Å; L585-F624 VanDerWaalsContact O-CE2 3.3Å; L585-F624 WeakPolarHBondContact O-CE2 3.49Å; Y589-F624 HydrophobicContact CD1-CE1 4.12Å; Y589-F624 HydrophobicContact CD1-CZ 4.37Å; Y589-F624 AromaticContact CD2-CD1 3.38Å; Y589-F624 HydrophobicContact CD2-CD1 3.38Å; Y589-F624 HydrophobicContact CD2-CD2 4.12Å; Y589-F624 AromaticContact CD2-CE1 3.43Å; Y589-F624 HydrophobicContact CD2-CE1 3.43Å; Y589-F624 VanDerWaalsContact CD2-CE1 3.43Å; Y589-F624 HydrophobicContact CD2-CE2 4.18Å; Y589-F624 AromaticContact CD2-CG 3.74Å; Y589-F624 HydrophobicContact CD2-CG 3.74Å; Y589-F624 AromaticContact CD2-CZ 3.85Å; Y589-F624 HydrophobicContact CD2-CZ 3.85Å; Y589-F624 HydrophobicContact CE1-CE1 4.39Å; Y589-F624 AromaticContact CE2-CD1 3.51Å; Y589-F624 HydrophobicContact CE2-CD1 3.51Å; Y589-F624 AromaticContact CE2-CE1 3.76Å; Y589-F624 HydrophobicContact CE2-CE1 3.76Å; Y589-F624 HydrophobicContact CE2-CG 4.17Å; Y589-F624 HydrophobicContact CG-CD1 4.08Å; Y589-F624 AromaticContact CG-CE1 3.63Å; Y589-F624 HydrophobicContact CG-CE1 3.63Å; Y589-F624 HydrophobicContact CG-CE2 4.22Å; Y589-F624 AromaticContact CG-CZ 3.72Å; Y589-F624 HydrophobicContact CG-CZ 3.72Å; N620-F624 VanDerWaalsContact O-CB 3.23Å; N620-F624 WeakPolarHBondContact O-CB 3.09Å; N620-F624 PolarHBondContact O-N 2.79Å; L622-F624 VanDerWaalsContact C-N 3.33Å; L622-F624 PolarHBondContact O-N 3.38Å; F624-E626 PolarHBondContact O-N 3.02Å; F624-K627 PolarHBondContact O-N 2.71Å; F624-L628 HydrophobicContact CE1-CD2 4.3Å; F624-L628 HydrophobicContact CZ-CD2 4.35Å; F624-L628 VanDerWaalsContact O-CB 3.29Å; F624-L628 WeakPolarHBondContact O-CB 3.2Å; F624-L628 PolarHBondContact O-N 2.88Å; F624-I785 HydrophobicContact CE1-CD1 3.98Å; F624-I785 HydrophobicContact CE1-CG1 4.47Å; F624-I785 HydrophobicContact CZ-CD1 4.43Å
625	K	66.8	Low	64.3	Low	134 Å²	134	82.1 Å²	82.1	58%	0.583	42%	0.423	S	S	*	.	H	α-helix	trans	-63.7	-38	179.9	-169.4	176.6	-177	177.3	0	112.4	E621 L622 T629	E621-K625 WeakPolarHBondContact O-CB 3.17Å; E621-K625 PolarHBondContact O-N 2.85Å; L622-K625 WeakPolarHBondContact O-CB 3.14Å; L622-K625 PolarHBondContact O-N 3.08Å; L622-K625 VanDerWaalsContact O-N 3.13Å; K625-T629 WeakPolarHBondContact O-CB 3.01Å; K625-T629 PolarHBondContact O-N 2.74Å; K625-T629 PolarHBondContact O-OG1 3.11Å
626	E	73.9	Confident	65.9	Low	134 Å²	134	79.8 Å²	79.8	63%	0.626	41%	0.411	S	S	*	.	H	α-helix	trans	-67.2	-49.3	172.8	-69.4	-166.3	154	0	0	112.1	L622 E623 F624 L628 T629 S630	L622-E626 PolarHBondContact O-N 3.25Å; E623-E626 PolarHBondContact O-N 3.39Å; F624-E626 PolarHBondContact O-N 3.02Å; E626-L628 VanDerWaalsContact C-N 3.31Å; E626-L628 PolarHBondContact O-N 2.91Å; E626-T629 PolarHBondContact O-N 3.32Å; E626-T629 VanDerWaalsContact O-N 3.16Å; E626-S630 WeakPolarHBondContact O-CB 3.22Å; E626-S630 PolarHBondContact O-N 3.42Å
627	K	75.5	Confident	67.4	Low	94 Å²	94	77.2 Å²	77.2	41%	0.409	40%	0.397	S	S	.	.	H	α-helix	trans	-56.7	-44.2	177	-74.1	168.7	180	169.2	0	111.8	L585 E623 F624 S630 A631	L585-K627 HydrophobicContact CD2-CB 3.94Å; E623-K627 VanDerWaalsContact CD-CE 3.4Å; E623-K627 HydrophobicContact CG-CD 4.34Å; E623-K627 WeakPolarHBondContact O-CB 3.45Å; E623-K627 VanDerWaalsContact O-CG 3.29Å; E623-K627 WeakPolarHBondContact O-CG 3.33Å; E623-K627 PolarHBondContact O-N 2.82Å; E623-K627 WeakPolarHBondContact OE1-CE 3.4Å; E623-K627 IonicContact OE1-NZ 2.63Å; E623-K627 PolarHBondContact OE1-NZ 3.5Å; E623-K627 IonicContact OE2-NZ 2.8Å; E623-K627 PolarHBondContact OE2-NZ 2.87Å; F624-K627 PolarHBondContact O-N 2.71Å; K627-S630 PolarHBondContact O-N 3.5Å; K627-A631 WeakPolarHBondContact O-CB 3.4Å; K627-A631 PolarHBondContact O-N 3.24Å
628	L	71.5	Confident	68.7	Low	5 Å²	5	75.3 Å²	75.3	3%	0.026	38%	0.377	C	S	.	.	H	α-helix	trans	-62.9	-46.2	175.6	-175.3	71.3	0	0	0	111.8	L582 F624 E626 S630 A631 I632 I785	L582-L628 HydrophobicContact CD2-CD1 4Å; F624-L628 HydrophobicContact CE1-CD2 4.3Å; F624-L628 HydrophobicContact CZ-CD2 4.35Å; F624-L628 VanDerWaalsContact O-CB 3.29Å; F624-L628 WeakPolarHBondContact O-CB 3.2Å; F624-L628 PolarHBondContact O-N 2.88Å; E626-L628 VanDerWaalsContact C-N 3.31Å; E626-L628 PolarHBondContact O-N 2.91Å; L628-S630 VanDerWaalsContact C-N 3.33Å; L628-S630 PolarHBondContact O-N 2.86Å; L628-A631 PolarHBondContact O-N 2.89Å; L628-I632 HydrophobicContact CD1-CD1 4.49Å; L628-I632 HydrophobicContact CG-CD1 3.97Å; L628-I632 VanDerWaalsContact O-CG1 3.27Å; L628-I632 WeakPolarHBondContact O-CG1 3.21Å; L628-I632 PolarHBondContact O-N 2.82Å; L628-I785 HydrophobicContact CD2-CD1 3.34Å
629	T	72.8	Confident	69.8	Low	87 Å²	87	70.4 Å²	70.4	53%	0.534	35%	0.354	S	S	.	.	H	α-helix	trans	-63	-40	179.6	-57.5	0	0	0	0	111.5	K625 E626 I632 K633	K625-T629 WeakPolarHBondContact O-CB 3.01Å; K625-T629 PolarHBondContact O-N 2.74Å; K625-T629 PolarHBondContact O-OG1 3.11Å; E626-T629 PolarHBondContact O-N 3.32Å; E626-T629 VanDerWaalsContact O-N 3.16Å; T629-I632 PolarHBondContact O-N 2.91Å; T629-K633 PolarHBondContact O-N 2.94Å
630	S	79.3	Confident	71.1	Confident	82 Å²	82	69 Å²	69	57%	0.573	35%	0.345	S	S	*	.	H	α-helix	trans	-63.8	-44.9	174	-171.3	0	0	0	0	112.2	E626 K627 L628 I632 K633 N634	E626-S630 WeakPolarHBondContact O-CB 3.22Å; E626-S630 PolarHBondContact O-N 3.42Å; K627-S630 PolarHBondContact O-N 3.5Å; L628-S630 VanDerWaalsContact C-N 3.33Å; L628-S630 PolarHBondContact O-N 2.86Å; S630-I632 PolarHBondContact O-N 2.87Å; S630-K633 PolarHBondContact O-N 2.87Å; S630-N634 PolarHBondContact O-N 2.67Å
631	A	73.7	Confident	71.6	Confident	9 Å²	9	68.7 Å²	68.7	7%	0.074	34%	0.341	C	S	.	.	H	α-helix	trans	-63.2	-40.8	176.4	0	0	0	0	0	112.7	V581 L582 L585 K627 L628 N634 F635	V581-A631 HydrophobicContact CG1-CB 4.03Å; L582-A631 HydrophobicContact CD2-CB 4.39Å; L582-A631 HydrophobicContact CG-CB 4.23Å; L585-A631 HydrophobicContact CD1-CB 3.76Å; K627-A631 WeakPolarHBondContact O-CB 3.4Å; K627-A631 PolarHBondContact O-N 3.24Å; L628-A631 PolarHBondContact O-N 2.89Å; A631-N634 PolarHBondContact O-N 2.89Å; A631-F635 PolarHBondContact O-N 2.89Å
632	I	72.1	Confident	71.9	Confident	21 Å²	21	66 Å²	66	11%	0.108	33%	0.329	C	S	.	.	H	α-helix	trans	-59.8	-46	173.7	-71.8	167.7	0	0	0	111	L582 L628 T629 S630 F635 N636 I778	L582-I632 HydrophobicContact CD2-CG1 3.85Å; L628-I632 HydrophobicContact CD1-CD1 4.49Å; L628-I632 HydrophobicContact CG-CD1 3.97Å; L628-I632 VanDerWaalsContact O-CG1 3.27Å; L628-I632 WeakPolarHBondContact O-CG1 3.21Å; L628-I632 PolarHBondContact O-N 2.82Å; T629-I632 PolarHBondContact O-N 2.91Å; S630-I632 PolarHBondContact O-N 2.87Å; I632-F635 PolarHBondContact O-N 2.85Å; I632-N636 PolarHBondContact O-N 3.04Å; I632-N636 VanDerWaalsContact O-N 3.09Å; I632-N636 PolarHBondContact O-ND2 2.79Å; I632-I778 HydrophobicContact CD1-CG2 4.13Å; I632-I778 HydrophobicContact CG1-CG1 4.34Å; I632-I778 HydrophobicContact CG2-CD1 3.54Å; I632-I778 HydrophobicContact CG2-CG1 3.86Å; I632-I778 HydrophobicContact CG2-CG2 4.42Å
633	K	76.6	Confident	71.5	Confident	138 Å²	138	64.3 Å²	64.3	60%	0.6	32%	0.317	S	S	*	.	H	α-helix	trans	-60.9	-50.9	178.2	-175.7	-178.3	174.4	-175.5	0	111.2	T629 S630 F635 N636 D637	T629-K633 PolarHBondContact O-N 2.94Å; S630-K633 PolarHBondContact O-N 2.87Å; K633-F635 VanDerWaalsContact C-N 3.32Å; K633-F635 PolarHBondContact O-N 2.76Å; K633-N636 PolarHBondContact O-N 2.85Å; K633-N636 VanDerWaalsContact O-N 3.11Å; K633-D637 PolarHBondContact O-N 2.71Å
634	N	78.3	Confident	71.2	Confident	75 Å²	75	65.2 Å²	65.2	40%	0.401	32%	0.321	S	S	.	.	H	α-helix	trans	-57.3	-42.5	178.2	-177.3	31.7	0	0	0	112.2	S630 A631 N636 D637 K638	S630-N634 PolarHBondContact O-N 2.67Å; A631-N634 PolarHBondContact O-N 2.89Å; N634-N636 PolarHBondContact O-N 2.87Å; N634-D637 PolarHBondContact O-N 3.11Å; N634-K638 WeakPolarHBondContact O-CG 3.09Å; N634-K638 PolarHBondContact O-N 3.41Å
635	F	73.8	Confident	70.7	Confident	4 Å²	4	65 Å²	65	2%	0.018	32%	0.32	C	S	.	.	H	α-helix	trans	-60.9	-44.2	175.2	173.4	-103.2	0	0	0	112.6	I575 A578 L579 L582 A631 I632 K633 K638 H639 P774 M777	I575-F635 HydrophobicContact CG2-CE2 4.03Å; A578-F635 HydrophobicContact CB-CB 4.08Å; A578-F635 HydrophobicContact CB-CD2 4.14Å; L579-F635 HydrophobicContact CD1-CE2 4.23Å; L579-F635 HydrophobicContact CD2-CD2 3.89Å; L579-F635 HydrophobicContact CD2-CE2 3.35Å; L579-F635 HydrophobicContact CD2-CZ 3.85Å; L579-F635 HydrophobicContact CG-CD2 3.97Å; L579-F635 HydrophobicContact CG-CE2 3.56Å; L579-F635 HydrophobicContact CG-CZ 4.49Å; L582-F635 HydrophobicContact CD1-CB 3.76Å; L582-F635 HydrophobicContact CD1-CD1 4.43Å; L582-F635 HydrophobicContact CD1-CG 3.98Å; A631-F635 PolarHBondContact O-N 2.89Å; I632-F635 PolarHBondContact O-N 2.85Å; K633-F635 VanDerWaalsContact C-N 3.32Å; K633-F635 PolarHBondContact O-N 2.76Å; F635-K638 PolarHBondContact O-N 2.92Å; F635-H639 WeakPolarHBondContact O-CB 3.32Å; F635-H639 PolarHBondContact O-N 2.93Å; F635-P774 HydrophobicContact CE1-CB 3.99Å; F635-M777 HydrophobicContact CZ-CE 4.48Å
636	N	72.2	Confident	70.1	Confident	45 Å²	45	62.3 Å²	62.3	24%	0.241	31%	0.312	C	S	.	.	H	α-helix	trans	-64.6	-43.9	176.5	-75.3	-27.9	0	0	0	112	I632 K633 N634 K638 H639 E640 P774	I632-N636 PolarHBondContact O-N 3.04Å; I632-N636 VanDerWaalsContact O-N 3.09Å; I632-N636 PolarHBondContact O-ND2 2.79Å; K633-N636 PolarHBondContact O-N 2.85Å; K633-N636 VanDerWaalsContact O-N 3.11Å; N634-N636 PolarHBondContact O-N 2.87Å; N636-K638 VanDerWaalsContact C-N 3.33Å; N636-K638 PolarHBondContact O-N 2.92Å; N636-H639 WeakPolarHBondContact O-CB 3.41Å; N636-H639 PolarHBondContact O-N 3.03Å; N636-E640 PolarHBondContact O-N 2.84Å; N636-P774 VanDerWaalsContact OD1-CB 3.26Å; N636-P774 WeakPolarHBondContact OD1-CB 3.36Å
637	D	76.3	Confident	69.2	Low	82 Å²	82	60.4 Å²	60.4	44%	0.439	31%	0.313	S	S	.	.	H	α-helix	trans	-59.4	-43.2	177.4	-68.6	-26.5	0	0	0	111	K633 N634 E640 E641	K633-D637 PolarHBondContact O-N 2.71Å; N634-D637 PolarHBondContact O-N 3.11Å; D637-E640 PolarHBondContact O-N 3.32Å; D637-E641 PolarHBondContact O-N 3.18Å
638	K	72.6	Confident	68	Low	51 Å²	51	60 Å²	60	22%	0.222	31%	0.314	C	S	.	.	H	α-helix	trans	-71.4	-30.6	176.2	-64.3	-45	-175	-174.7	0	114.2	I575 N634 F635 N636 E641 L642	I575-K638 HydrophobicContact CG1-CB 3.95Å; N634-K638 WeakPolarHBondContact O-CG 3.09Å; N634-K638 PolarHBondContact O-N 3.41Å; F635-K638 PolarHBondContact O-N 2.92Å; N636-K638 VanDerWaalsContact C-N 3.33Å; N636-K638 PolarHBondContact O-N 2.92Å; K638-E641 WeakPolarHBondContact CD-OE2 3.13Å; K638-E641 IonicContact NZ-OE1 3.9Å; K638-E641 PolarHBondContact NZ-OE1 3.15Å; K638-E641 IonicContact NZ-OE2 2.67Å; K638-E641 PolarHBondContact NZ-OE2 3.12Å; K638-L642 PolarHBondContact O-N 3.24Å; K638-L642 VanDerWaalsContact O-N 3.16Å
639	H	68.2	Low	67	Low	22 Å²	22	62.9 Å²	62.9	10%	0.102	33%	0.325	C	S	.	.	H	α-helix	trans	-66.4	-40.7	172.1	176.8	-123.6	0	0	0	112.2	F635 N636 L642 K643	F635-H639 WeakPolarHBondContact O-CB 3.32Å; F635-H639 PolarHBondContact O-N 2.93Å; N636-H639 WeakPolarHBondContact O-CB 3.41Å; N636-H639 PolarHBondContact O-N 3.03Å; H639-L642 PolarHBondContact O-N 2.69Å; H639-K643 WeakPolarHBondContact CE1-CE 3.44Å; H639-K643 PolarHBondContact CE1-NZ 2.81Å; H639-K643 PolarHBondContact O-N 3.48Å
640	E	69.5	Low	65.3	Low	82 Å²	82	61 Å²	61	38%	0.383	31%	0.314	S	S	.	.	H	α-helix	trans	-73.1	-32.2	175.3	-63.6	-53.7	135.9	0	0	112.8	N636 D637 L642 K643 Q644	N636-E640 PolarHBondContact O-N 2.84Å; D637-E640 PolarHBondContact O-N 3.32Å; E640-L642 PolarHBondContact O-N 2.88Å; E640-K643 VanDerWaalsContact CD-CD 3.46Å; E640-K643 PolarHBondContact O-N 2.73Å; E640-K643 VanDerWaalsContact OE1-CD 3.28Å; E640-K643 WeakPolarHBondContact OE1-CD 3.41Å; E640-K643 WeakPolarHBondContact OE1-CE 2.89Å; E640-K643 IonicContact OE1-NZ 2.67Å; E640-K643 PolarHBondContact OE1-NZ 2.83Å; E640-K643 WeakPolarHBondContact OE2-CD 3.13Å; E640-K643 IonicContact OE2-NZ 2.7Å; E640-Q644 WeakPolarHBondContact O-CG 3.39Å; E640-Q644 PolarHBondContact O-N 3.35Å
641	E	68.1	Low	63.5	Low	74 Å²	74	62.2 Å²	62.2	35%	0.346	31%	0.314	S	S	.	.	H	α-helix	trans	-56.7	-46.7	167.9	-79.1	178.4	-164.6	0	0	111.6	D637 K638 Q644 F645	D637-E641 PolarHBondContact O-N 3.18Å; K638-E641 WeakPolarHBondContact CD-OE2 3.13Å; K638-E641 IonicContact NZ-OE1 3.9Å; K638-E641 PolarHBondContact NZ-OE1 3.15Å; K638-E641 IonicContact NZ-OE2 2.67Å; K638-E641 PolarHBondContact NZ-OE2 3.12Å; E641-Q644 PolarHBondContact O-N 3.26Å; E641-F645 WeakPolarHBondContact O-CB 3.39Å; E641-F645 PolarHBondContact O-N 3.46Å
642	L	63.9	Low	61.9	Low	21 Å²	21	67.7 Å²	67.7	11%	0.11	34%	0.338	C	S	.	.	H	α-helix	trans	-64.1	-40.8	176	176.2	65.3	0	0	0	112.1	L568 C571 I575 K638 H639 E640 F645 L646	L568-L642 HydrophobicContact CD1-CD1 4.28Å; C571-L642 HydrophobicContact CB-CB 4.39Å; C571-L642 HydrophobicContact CB-CD1 3.84Å; I575-L642 HydrophobicContact CD1-CB 3.57Å; I575-L642 HydrophobicContact CD1-CD2 3.47Å; I575-L642 VanDerWaalsContact CD1-CD2 3.47Å; I575-L642 HydrophobicContact CD1-CG 4.12Å; K638-L642 PolarHBondContact O-N 3.24Å; K638-L642 VanDerWaalsContact O-N 3.16Å; H639-L642 PolarHBondContact O-N 2.69Å; E640-L642 PolarHBondContact O-N 2.88Å; L642-F645 PolarHBondContact O-N 3.45Å; L642-L646 HydrophobicContact CD1-CD1 3.98Å; L642-L646 HydrophobicContact CD1-CG 4.02Å; L642-L646 HydrophobicContact CD2-CD1 4.39Å; L642-L646 HydrophobicContact CG-CD1 3.85Å; L642-L646 HydrophobicContact CG-CG 4.31Å; L642-L646 WeakPolarHBondContact O-CB 3.49Å; L642-L646 VanDerWaalsContact O-CG 3.29Å; L642-L646 WeakPolarHBondContact O-CG 3.26Å; L642-L646 PolarHBondContact O-N 2.67Å
643	K	58.4	Low	60.3	Low	73 Å²	73	75.3 Å²	75.3	32%	0.317	37%	0.37	S	S	.	.	H	α-helix	trans	-61.9	-42.6	176.1	-80.6	168.7	167.1	179.4	0	112.4	H639 E640 L646 S647 N772	H639-K643 WeakPolarHBondContact CE1-CE 3.44Å; H639-K643 PolarHBondContact CE1-NZ 2.81Å; H639-K643 PolarHBondContact O-N 3.48Å; E640-K643 VanDerWaalsContact CD-CD 3.46Å; E640-K643 PolarHBondContact O-N 2.73Å; E640-K643 VanDerWaalsContact OE1-CD 3.28Å; E640-K643 WeakPolarHBondContact OE1-CD 3.41Å; E640-K643 WeakPolarHBondContact OE1-CE 2.89Å; E640-K643 IonicContact OE1-NZ 2.67Å; E640-K643 PolarHBondContact OE1-NZ 2.83Å; E640-K643 WeakPolarHBondContact OE2-CD 3.13Å; E640-K643 IonicContact OE2-NZ 2.7Å; K643-L646 PolarHBondContact O-N 3.02Å; K643-S647 PolarHBondContact O-N 2.81Å; K643-S647 PolarHBondContact O-OG 2.75Å; K643-N772 WeakPolarHBondContact CE-OD1 3.47Å
644	Q	63.6	Low	58.4	Low	116 Å²	116	73.9 Å²	73.9	54%	0.542	37%	0.368	S	S	.	.	H	α-helix	trans	-65.1	-41.4	176	-70.8	179.4	25.7	0	0	111.3	E640 E641 L646 S647 I648	E640-Q644 WeakPolarHBondContact O-CG 3.39Å; E640-Q644 PolarHBondContact O-N 3.35Å; E641-Q644 PolarHBondContact O-N 3.26Å; Q644-L646 PolarHBondContact O-N 2.92Å; Q644-S647 PolarHBondContact O-N 3.21Å; Q644-S647 PolarHBondContact O-OG 3.21Å; Q644-I648 WeakPolarHBondContact O-CB 3.32Å; Q644-I648 WeakPolarHBondContact O-CD1 3.34Å; Q644-I648 VanDerWaalsContact O-CG1 3.22Å; Q644-I648 WeakPolarHBondContact O-CG1 3.12Å; Q644-I648 PolarHBondContact O-N 3.05Å
645	F	58.4	Low	56.4	Low	17 Å²	17	73.3 Å²	73.3	8%	0.075	37%	0.365	C	S	.	.	H	α-helix	trans	-62.1	-42.5	174	179.2	-109.4	0	0	0	112.4	Y564 Q567 L568 E641 L642 S647 I648 W649	Y564-F645 AromaticContact CD1-CE2 3.99Å; Y564-F645 HydrophobicContact CD1-CE2 3.99Å; Y564-F645 AromaticContact CD1-CZ 3.92Å; Y564-F645 HydrophobicContact CD1-CZ 3.92Å; Y564-F645 HydrophobicContact CE1-CE2 4.46Å; Q567-F645 HydrophobicContact CB-CD2 4.45Å; Q567-F645 HydrophobicContact CB-CE1 4.21Å; Q567-F645 HydrophobicContact CB-CE2 3.55Å; Q567-F645 HydrophobicContact CB-CZ 3.41Å; Q567-F645 VanDerWaalsContact CB-CZ 3.41Å; Q567-F645 HydrophobicContact CG-CE2 4.27Å; Q567-F645 HydrophobicContact CG-CZ 4.5Å; L568-F645 HydrophobicContact CB-CE1 3.99Å; L568-F645 HydrophobicContact CD1-CE1 4.15Å; E641-F645 WeakPolarHBondContact O-CB 3.39Å; E641-F645 PolarHBondContact O-N 3.46Å; L642-F645 PolarHBondContact O-N 3.45Å; F645-S647 VanDerWaalsContact C-N 3.33Å; F645-S647 PolarHBondContact O-N 2.93Å; F645-I648 PolarHBondContact O-N 2.86Å; F645-W649 AromaticContact CE1-CE3 3.86Å; F645-W649 HydrophobicContact CE1-CE3 3.86Å; F645-W649 AromaticContact CE1-CZ3 3.72Å; F645-W649 HydrophobicContact CE1-CZ3 3.72Å; F645-W649 HydrophobicContact CZ-CE3 4.05Å; F645-W649 AromaticContact CZ-CZ3 3.97Å; F645-W649 HydrophobicContact CZ-CZ3 3.97Å; F645-W649 PolarHBondContact O-N 3.3Å
646	L	53.1	Low	54.8	Low	77 Å²	77	78.8 Å²	78.8	40%	0.403	39%	0.388	S	S	.	.	H	α-helix	trans	-70.1	-22.9	177.4	-72	172.7	0	0	0	114.1	L568 L642 K643 Q644	L568-L646 HydrophobicContact CD1-CD2 4.11Å; L642-L646 HydrophobicContact CD1-CD1 3.98Å; L642-L646 HydrophobicContact CD1-CG 4.02Å; L642-L646 HydrophobicContact CD2-CD1 4.39Å; L642-L646 HydrophobicContact CG-CD1 3.85Å; L642-L646 HydrophobicContact CG-CG 4.31Å; L642-L646 WeakPolarHBondContact O-CB 3.49Å; L642-L646 VanDerWaalsContact O-CG 3.29Å; L642-L646 WeakPolarHBondContact O-CG 3.26Å; L642-L646 PolarHBondContact O-N 2.67Å; K643-L646 PolarHBondContact O-N 3.02Å; Q644-L646 PolarHBondContact O-N 2.92Å
647	S	55.6	Low	53.1	Low	93 Å²	93	79.9 Å²	79.9	65%	0.65	40%	0.398	S	S	*	.	H	α-helix	trans	-86.7	-27.7	174.5	69.8	0	0	0	0	113.3	K643 Q644 F645 W649	K643-S647 PolarHBondContact O-N 2.81Å; K643-S647 PolarHBondContact O-OG 2.75Å; Q644-S647 PolarHBondContact O-N 3.21Å; Q644-S647 PolarHBondContact O-OG 3.21Å; F645-S647 VanDerWaalsContact C-N 3.33Å; F645-S647 PolarHBondContact O-N 2.93Å; S647-W649 VanDerWaalsContact C-N 3.32Å
648	I	50.1	Low	51.3	Low	85 Å²	85	77.7 Å²	77.7	44%	0.436	39%	0.388	S	S	.	.	H	α-helix	trans	-75.6	-19.9	174.7	-69.2	166.2	0	0	0	112.1	Y527 Q644 F645	Y527-I648 WeakPolarHBondContact OH-CD1 3.35Å; Q644-I648 WeakPolarHBondContact O-CB 3.32Å; Q644-I648 WeakPolarHBondContact O-CD1 3.34Å; Q644-I648 VanDerWaalsContact O-CG1 3.22Å; Q644-I648 WeakPolarHBondContact O-CG1 3.12Å; Q644-I648 PolarHBondContact O-N 3.05Å; F645-I648 PolarHBondContact O-N 2.86Å
649	W	49.6	Very low	49.6	Very low	67 Å²	67	80.1 Å²	80.1	25%	0.254	40%	0.403	S	S	.	.	S	Bend	trans	-56.8	119.8	-179.2	-160.4	-58.5	0	0	0	111.7	Y564 L568 F645 S647 N651	Y564-W649 HydrophobicContact CD1-CD2 4.42Å; Y564-W649 HydrophobicContact CD1-CE3 4.39Å; Y564-W649 HydrophobicContact CG-CH2 4.46Å; Y564-W649 HydrophobicContact CG-CZ2 4.29Å; L568-W649 HydrophobicContact CB-CZ3 4.36Å; L568-W649 HydrophobicContact CD1-CZ3 4.31Å; F645-W649 AromaticContact CE1-CE3 3.86Å; F645-W649 HydrophobicContact CE1-CE3 3.86Å; F645-W649 AromaticContact CE1-CZ3 3.72Å; F645-W649 HydrophobicContact CE1-CZ3 3.72Å; F645-W649 HydrophobicContact CZ-CE3 4.05Å; F645-W649 AromaticContact CZ-CZ3 3.97Å; F645-W649 HydrophobicContact CZ-CZ3 3.97Å; F645-W649 PolarHBondContact O-N 3.3Å; S647-W649 VanDerWaalsContact C-N 3.32Å; W649-N651 PolarHBondContact O-N 3.35Å; W649-N651 VanDerWaalsContact O-N 3.08Å
650	P	38.7	Very low	48.2	Very low	46 Å²	46	83.5 Å²	83.5	30%	0.299	42%	0.421	S	S	.	.	S	Bend	trans	-66.1	114	-165	23.1	-34	0	0	0	112.6	Y564 I655	Y564-P650 HydrophobicContact CE2-CG 4.05Å; Y564-P650 VanDerWaalsContact OH-CD 3.29Å; Y564-P650 WeakPolarHBondContact OH-CD 3.24Å; P650-I655 HydrophobicContact CG-CD1 4.16Å
651	N	39.9	Very low	46.7	Very low	108 Å²	108	81.1 Å²	81.1	58%	0.578	41%	0.413	S	S	*	.			trans	39.1	96.8	171.4	-91.7	-48	0	0	0	115.8	W649 K653 I654	W649-N651 PolarHBondContact O-N 3.35Å; W649-N651 VanDerWaalsContact O-N 3.08Å; N651-K653 PolarHBondContact O-N 2.87Å; N651-I654 HydrophobicContact CB-CD1 4.27Å; N651-I654 HydrophobicContact CB-CG1 4.34Å; N651-I654 PolarHBondContact O-N 2.97Å
652	Q	40.9	Very low	45.3	Very low	124 Å²	124	81.2 Å²	81.2	58%	0.579	42%	0.416	S	S	*	.	H	α-helix	trans	-52.9	-17	168.7	-66	-164.6	24.8	0	0	114.1	I654 K656	Q652-I654 VanDerWaalsContact C-N 3.31Å; Q652-I654 PolarHBondContact O-N 3.32Å; Q652-K656 WeakPolarHBondContact O-CB 3.32Å
653	K	37.8	Very low	43.9	Very low	181 Å²	181	82.2 Å²	82.2	79%	0.787	42%	0.421	S	S	*	.	H	α-helix	trans	-69.3	-19.1	172.9	-69.9	-174.9	176	-178.6	0	114.6	N651 P657	N651-K653 PolarHBondContact O-N 2.87Å; K653-P657 VanDerWaalsContact O-CD 3.31Å; K653-P657 WeakPolarHBondContact O-CD 3.32Å; K653-P657 WeakPolarHBondContact O-CG 3.13Å
654	I	37	Very low	42.9	Very low	108 Å²	108	83.1 Å²	83.1	55%	0.554	43%	0.426	S	S	*	.	H	α-helix	trans	-107.3	-57.1	-174.7	-58	175.9	0	0	0	111	N651 Q652 K656 P657 T658	N651-I654 HydrophobicContact CB-CD1 4.27Å; N651-I654 HydrophobicContact CB-CG1 4.34Å; N651-I654 PolarHBondContact O-N 2.97Å; Q652-I654 VanDerWaalsContact C-N 3.31Å; Q652-I654 PolarHBondContact O-N 3.32Å; I654-K656 VanDerWaalsContact C-N 3.28Å; I654-K656 PolarHBondContact O-N 3.14Å; I654-P657 WeakPolarHBondContact O-CD 3.48Å; I654-T658 PolarHBondContact O-N 2.93Å; I654-T658 VanDerWaalsContact O-N 3.16Å; I654-T658 PolarHBondContact O-OG1 3.38Å; I654-T658 VanDerWaalsContact O-OG1 3.08Å
655	I	37.1	Very low	41.5	Very low	64 Å²	64	85.8 Å²	85.8	33%	0.328	43%	0.431	S	S	.	.	H	α-helix	trans	-66.6	-31.3	-175.6	-67.2	172.8	0	0	0	111.6	P650 T658 L659	P650-I655 HydrophobicContact CG-CD1 4.16Å; I655-T658 PolarHBondContact O-N 3.41Å; I655-L659 VanDerWaalsContact O-CB 3.29Å; I655-L659 WeakPolarHBondContact O-CB 3.45Å; I655-L659 PolarHBondContact O-N 3.5Å
656	K	40.1	Very low	40.3	Very low	118 Å²	118	90.7 Å²	90.7	51%	0.513	46%	0.457	S	S	.	.	H	α-helix	trans	-71.1	-44.9	-176.6	-150.3	175.1	-162.2	166.8	0	111.8	Q652 I654 L660	Q652-K656 WeakPolarHBondContact O-CB 3.32Å; I654-K656 VanDerWaalsContact C-N 3.28Å; I654-K656 PolarHBondContact O-N 3.14Å; K656-L660 WeakPolarHBondContact O-CB 3.11Å; K656-L660 PolarHBondContact O-N 3.4Å
657	P	36.3	Very low	39.6	Very low	69 Å²	69	91 Å²	91	45%	0.448	46%	0.463	S	S	.	.	H	α-helix	trans	-64.6	-35	166.4	-26.5	37.1	0	0	0	114.8	K653 I654 L660 S661	K653-P657 VanDerWaalsContact O-CD 3.31Å; K653-P657 WeakPolarHBondContact O-CD 3.32Å; K653-P657 WeakPolarHBondContact O-CG 3.13Å; I654-P657 WeakPolarHBondContact O-CD 3.48Å; P657-L660 PolarHBondContact O-N 3.14Å; P657-S661 VanDerWaalsContact O-CB 3.23Å; P657-S661 WeakPolarHBondContact O-CB 3.33Å; P657-S661 PolarHBondContact O-N 2.81Å
658	T	37.2	Very low	38.5	Very low	35 Å²	35	92.4 Å²	92.4	22%	0.215	46%	0.459	C	S	.	.	H	α-helix	trans	-67.8	-44.9	177.5	-55.5	0	0	0	0	111.8	I654 I655 L660 S661 I662	I654-T658 PolarHBondContact O-N 2.93Å; I654-T658 VanDerWaalsContact O-N 3.16Å; I654-T658 PolarHBondContact O-OG1 3.38Å; I654-T658 VanDerWaalsContact O-OG1 3.08Å; I655-T658 PolarHBondContact O-N 3.41Å; T658-L660 VanDerWaalsContact C-N 3.34Å; T658-S661 PolarHBondContact O-N 3.23Å; T658-I662 HydrophobicContact CG2-CD1 4.11Å; T658-I662 WeakPolarHBondContact O-CG1 3.42Å; T658-I662 PolarHBondContact O-N 3.07Å
659	L	37.6	Very low	37.7	Very low	102 Å²	102	96.1 Å²	96.1	53%	0.534	48%	0.48	S	S	.	.	H	α-helix	trans	-64.2	-39.9	174.4	-167.1	76.5	0	0	0	111.1	I655 I662 L663	I655-L659 VanDerWaalsContact O-CB 3.29Å; I655-L659 WeakPolarHBondContact O-CB 3.45Å; I655-L659 PolarHBondContact O-N 3.5Å; L659-I662 PolarHBondContact O-N 2.98Å; L659-L663 HydrophobicContact CD2-CD1 4.46Å; L659-L663 HydrophobicContact CG-CD1 4.09Å; L659-L663 WeakPolarHBondContact O-CB 3.49Å; L659-L663 VanDerWaalsContact O-CG 3.27Å; L659-L663 WeakPolarHBondContact O-CG 3.42Å; L659-L663 PolarHBondContact O-N 3.41Å
660	L	39.6	Very low	37	Very low	94 Å²	94	97.2 Å²	97.2	49%	0.492	50%	0.497	S	S	.	.	H	α-helix	trans	-63	-43	174.5	-175.4	65.9	0	0	0	111.7	K656 P657 T658 L663 Q664	K656-L660 WeakPolarHBondContact O-CB 3.11Å; K656-L660 PolarHBondContact O-N 3.4Å; P657-L660 PolarHBondContact O-N 3.14Å; T658-L660 VanDerWaalsContact C-N 3.34Å; L660-L663 PolarHBondContact O-N 3.09Å; L660-Q664 HydrophobicContact CD1-CG 4.42Å; L660-Q664 HydrophobicContact CG-CG 4.39Å; L660-Q664 WeakPolarHBondContact O-CB 3.26Å; L660-Q664 VanDerWaalsContact O-CG 3.25Å; L660-Q664 WeakPolarHBondContact O-CG 3.25Å; L660-Q664 PolarHBondContact O-N 2.91Å
661	S	37.4	Very low	36.8	Very low	32 Å²	32	98.1 Å²	98.1	22%	0.224	52%	0.516	C	S	.	.	H	α-helix	trans	-64.8	-37.5	177	171.7	0	0	0	0	112.8	P657 T658 R665	P657-S661 VanDerWaalsContact O-CB 3.23Å; P657-S661 WeakPolarHBondContact O-CB 3.33Å; P657-S661 PolarHBondContact O-N 2.81Å; T658-S661 PolarHBondContact O-N 3.23Å; S661-R665 WeakPolarHBondContact O-CB 3.5Å; S661-R665 WeakPolarHBondContact O-CG 3.43Å; S661-R665 PolarHBondContact O-N 3.08Å; S661-R665 VanDerWaalsContact O-N 3.1Å
662	I	38	Very low	36.8	Very low	76 Å²	76	97 Å²	97	39%	0.39	51%	0.512	S	S	.	.	H	α-helix	trans	-67.6	-45.3	173.1	-68.5	164.5	0	0	0	110.1	T658 L659 R665 L666	T658-I662 HydrophobicContact CG2-CD1 4.11Å; T658-I662 WeakPolarHBondContact O-CG1 3.42Å; T658-I662 PolarHBondContact O-N 3.07Å; L659-I662 PolarHBondContact O-N 2.98Å; I662-R665 PolarHBondContact O-N 2.94Å; I662-L666 HydrophobicContact CG2-CD1 3.94Å; I662-L666 VanDerWaalsContact O-CG 3.28Å; I662-L666 WeakPolarHBondContact O-CG 3.46Å; I662-L666 PolarHBondContact O-N 2.89Å; I662-L666 VanDerWaalsContact O-N 3.08Å
663	L	35	Very low	36.7	Very low	42 Å²	42	95.2 Å²	95.2	22%	0.22	51%	0.514	C	S	.	.	H	α-helix	trans	-66.3	-38.1	177.7	-73	166.9	0	0	0	112.7	L659 L660 L666 T667 I753	L659-L663 HydrophobicContact CD2-CD1 4.46Å; L659-L663 HydrophobicContact CG-CD1 4.09Å; L659-L663 WeakPolarHBondContact O-CB 3.49Å; L659-L663 VanDerWaalsContact O-CG 3.27Å; L659-L663 WeakPolarHBondContact O-CG 3.42Å; L659-L663 PolarHBondContact O-N 3.41Å; L660-L663 PolarHBondContact O-N 3.09Å; L663-L666 CarbonylContact O-C 3.34Å; L663-L666 PolarHBondContact O-N 2.95Å; L663-T667 WeakPolarHBondContact O-CG2 3.42Å; L663-T667 PolarHBondContact O-N 2.82Å; L663-T667 VanDerWaalsContact O-N 3.14Å; L663-T667 PolarHBondContact O-OG1 2.97Å; L663-I753 HydrophobicContact CD2-CG2 4.14Å
664	Q	38	Very low	36.7	Very low	91 Å²	91	92.2 Å²	92.2	43%	0.425	51%	0.507	S	S	.	.	H	α-helix	trans	-61.5	-50.8	174	-77	178.1	-75.8	0	0	110.5	L660 L666 T667 E668	L660-Q664 HydrophobicContact CD1-CG 4.42Å; L660-Q664 HydrophobicContact CG-CG 4.39Å; L660-Q664 WeakPolarHBondContact O-CB 3.26Å; L660-Q664 VanDerWaalsContact O-CG 3.25Å; L660-Q664 WeakPolarHBondContact O-CG 3.25Å; L660-Q664 PolarHBondContact O-N 2.91Å; Q664-L666 PolarHBondContact O-N 3.37Å; Q664-L666 VanDerWaalsContact O-N 3.07Å; Q664-T667 CarbonylContact O-C 3.57Å; Q664-T667 PolarHBondContact O-N 2.88Å; Q664-T667 PolarHBondContact O-OG1 2.9Å; Q664-E668 WeakPolarHBondContact O-CG 3.47Å; Q664-E668 PolarHBondContact O-N 3.17Å
665	R	34.9	Very low	36.8	Very low	173 Å²	173	90.4 Å²	90.4	65%	0.653	50%	0.497	S	S	*	.	H	α-helix	trans	-58.7	-20.9	172.9	-80.1	178.7	163.1	166.7	-5.4	115	S661 I662	S661-R665 WeakPolarHBondContact O-CB 3.5Å; S661-R665 WeakPolarHBondContact O-CG 3.43Å; S661-R665 PolarHBondContact O-N 3.08Å; S661-R665 VanDerWaalsContact O-N 3.1Å; I662-R665 PolarHBondContact O-N 2.94Å
666	L	33	Very low	36.9	Very low	119 Å²	119	92.1 Å²	92.1	62%	0.623	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-1.7	174.5	-70.3	169	0	0	0	113.8	I662 L663 Q664	I662-L666 HydrophobicContact CG2-CD1 3.94Å; I662-L666 VanDerWaalsContact O-CG 3.28Å; I662-L666 WeakPolarHBondContact O-CG 3.46Å; I662-L666 PolarHBondContact O-N 2.89Å; I662-L666 VanDerWaalsContact O-N 3.08Å; L663-L666 CarbonylContact O-C 3.34Å; L663-L666 PolarHBondContact O-N 2.95Å; Q664-L666 PolarHBondContact O-N 3.37Å; Q664-L666 VanDerWaalsContact O-N 3.07Å
667	T	37.5	Very low	36.8	Very low	85 Å²	85	94.5 Å²	94.5	52%	0.521	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.5	-4.2	-176.7	56.1	0	0	0	0	114.4	L663 Q664 N669	L663-T667 WeakPolarHBondContact O-CG2 3.42Å; L663-T667 PolarHBondContact O-N 2.82Å; L663-T667 VanDerWaalsContact O-N 3.14Å; L663-T667 PolarHBondContact O-OG1 2.97Å; Q664-T667 CarbonylContact O-C 3.57Å; Q664-T667 PolarHBondContact O-N 2.88Å; Q664-T667 PolarHBondContact O-OG1 2.9Å; T667-N669 PolarHBondContact O-N 3.17Å
668	E	32.9	Very low	36.8	Very low	122 Å²	122	93 Å²	93	57%	0.57	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	101.2	172.7	-81.1	160.2	-159.5	0	0	110.2	Q664	Q664-E668 WeakPolarHBondContact O-CG 3.47Å; Q664-E668 PolarHBondContact O-N 3.17Å
669	N	32.5	Very low	36.7	Very low	163 Å²	163	97.4 Å²	97.4	87%	0.872	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.5	12.7	158.4	-51.6	-9.5	0	0	0	119.6	T667	T667-N669 PolarHBondContact O-N 3.17Å
670	S	34.7	Very low	36.5	Very low	89 Å²	89	95.3 Å²	95.3	62%	0.622	51%	0.513	S	S	*	.			trans	-145.9	93.4	167	56.4	0	0	0	0	114.8
671	G	35.6	Very low	36.4	Very low	66 Å²	66	95.6 Å²	95.6	68%	0.68	51%	0.514	S	S	*	.			trans	-101.7	109.2	172.5	0	0	0	0	0	112
672	T	39.6	Very low	36	Very low	83 Å²	83	99 Å²	99	51%	0.509	53%	0.529	S	S	.	.			trans	-79.8	168.1	176.6	59.1	0	0	0	0	112.5	D674 M675 N676	T672-D674 PolarHBondContact O-N 3.26Å; T672-D674 VanDerWaalsContact O-N 3.09Å; T672-M675 PolarHBondContact O-N 2.89Å; T672-M675 VanDerWaalsContact O-N 3.16Å; T672-N676 PolarHBondContact O-N 3.42Å; T672-N676 VanDerWaalsContact O-N 3.14Å
673	S	39	Very low	35.8	Very low	88 Å²	88	102.1 Å²	102.1	62%	0.615	54%	0.542	S	S	*	.	H	α-helix	trans	-52	-33.6	177	54	0	0	0	0	113.2	N676 Y677	S673-N676 CarbonylContact O-C 3.52Å; S673-N676 WeakPolarHBondContact O-CB 3.37Å; S673-N676 PolarHBondContact O-N 2.95Å; S673-Y677 PolarHBondContact O-N 3.3Å
674	D	37.6	Very low	35.7	Very low	118 Å²	118	107.6 Å²	107.6	63%	0.631	56%	0.564	S	S	*	*	H	α-helix	trans	-82.1	-29.4	-173	-63	2.9	0	0	0	111.5	T672 N676 Y677 A678	T672-D674 PolarHBondContact O-N 3.26Å; T672-D674 VanDerWaalsContact O-N 3.09Å; D674-N676 VanDerWaalsContact C-N 3.34Å; D674-Y677 PolarHBondContact O-N 2.93Å; D674-A678 WeakPolarHBondContact O-CB 3.38Å; D674-A678 PolarHBondContact O-N 3.34Å
675	M	38.5	Very low	35.2	Very low	70 Å²	70	106.5 Å²	106.5	35%	0.345	56%	0.561	S	S	.	*	H	α-helix	trans	-63.6	-42	164.3	-73.8	171.4	60.1	0	0	110.6	T672 A678 W679	T672-M675 PolarHBondContact O-N 2.89Å; T672-M675 VanDerWaalsContact O-N 3.16Å; M675-A678 PolarHBondContact O-N 2.93Å; M675-W679 WeakPolarHBondContact O-CB 3.02Å; M675-W679 PolarHBondContact O-N 2.82Å
676	N	39.3	Very low	34.7	Very low	100 Å²	100	107.6 Å²	107.6	54%	0.535	57%	0.571	S	S	.	*	H	α-helix	trans	-63.2	-41.3	173.5	-112	-16.6	0	0	0	111.9	T672 S673 D674 W679 C680	T672-N676 PolarHBondContact O-N 3.42Å; T672-N676 VanDerWaalsContact O-N 3.14Å; S673-N676 CarbonylContact O-C 3.52Å; S673-N676 WeakPolarHBondContact O-CB 3.37Å; S673-N676 PolarHBondContact O-N 2.95Å; D674-N676 VanDerWaalsContact C-N 3.34Å; N676-W679 PolarHBondContact O-N 2.8Å; N676-C680 WeakPolarHBondContact O-CB 3.45Å; N676-C680 PolarHBondContact O-N 3.01Å; N676-C680 PolarHBondContact O-SG 3.04Å; N676-C680 VanDerWaalsContact O-SG 3.36Å
677	Y	38.7	Very low	34.5	Very low	168 Å²	168	109.3 Å²	109.3	66%	0.659	58%	0.579	S	S	*	*	H	α-helix	trans	-63.7	-43.9	176.5	-168.8	-108.1	0	0	0	111.9	S673 D674 W679 C680 I681	S673-Y677 PolarHBondContact O-N 3.3Å; D674-Y677 PolarHBondContact O-N 2.93Å; Y677-W679 VanDerWaalsContact C-N 3.31Å; Y677-W679 PolarHBondContact O-N 3Å; Y677-C680 PolarHBondContact O-N 3.27Å; Y677-I681 HydrophobicContact CD1-CD1 3.79Å; Y677-I681 HydrophobicContact CE1-CD1 3.62Å; Y677-I681 WeakPolarHBondContact O-CG1 3.49Å; Y677-I681 PolarHBondContact O-N 3.2Å
678	A	35.6	Very low	34.1	Very low	38 Å²	38	109.2 Å²	109.2	31%	0.314	58%	0.579	S	S	.	*	H	α-helix	trans	-61.9	-37.3	173	0	0	0	0	0	112.5	D674 M675 I681 L682	D674-A678 WeakPolarHBondContact O-CB 3.38Å; D674-A678 PolarHBondContact O-N 3.34Å; M675-A678 PolarHBondContact O-N 2.93Å; A678-I681 PolarHBondContact O-N 3.41Å; A678-L682 PolarHBondContact O-N 2.97Å
679	W	36.2	Very low	33.9	Very low	126 Å²	126	110 Å²	110	48%	0.477	59%	0.585	S	S	.	*	H	α-helix	trans	-70.8	-38.7	176.4	-158.7	-107.3	0	0	0	112.7	M675 N676 Y677 I681 L682 Q683	M675-W679 WeakPolarHBondContact O-CB 3.02Å; M675-W679 PolarHBondContact O-N 2.82Å; N676-W679 PolarHBondContact O-N 2.8Å; Y677-W679 VanDerWaalsContact C-N 3.31Å; Y677-W679 PolarHBondContact O-N 3Å; W679-I681 VanDerWaalsContact C-N 3.33Å; W679-I681 PolarHBondContact O-N 2.91Å; W679-L682 HydrophobicContact CE3-CD1 4.05Å; W679-L682 HydrophobicContact CZ3-CD1 4.48Å; W679-L682 WeakPolarHBondContact O-CB 3.43Å; W679-L682 PolarHBondContact O-N 2.93Å; W679-Q683 PolarHBondContact O-N 2.9Å
680	C	34.1	Very low	34	Very low	58 Å²	58	106.1 Å²	106.1	39%	0.392	57%	0.565	S	S	.	*	H	α-helix	trans	-66.6	-32.2	172	-71.7	0	0	0	0	112.8	N676 Y677 Q683 K684	N676-C680 WeakPolarHBondContact O-CB 3.45Å; N676-C680 PolarHBondContact O-N 3.01Å; N676-C680 PolarHBondContact O-SG 3.04Å; N676-C680 VanDerWaalsContact O-SG 3.36Å; Y677-C680 PolarHBondContact O-N 3.27Å; C680-Q683 PolarHBondContact O-N 3.07Å; C680-K684 PolarHBondContact O-N 2.73Å
681	I	36.1	Very low	33.7	Very low	101 Å²	101	107.1 Å²	107.1	52%	0.518	57%	0.569	S	S	.	*	H	α-helix	trans	-64.9	-43.3	169.9	-72.4	166.3	0	0	0	110.3	Y677 A678 W679 Q683 K684	Y677-I681 HydrophobicContact CD1-CD1 3.79Å; Y677-I681 HydrophobicContact CE1-CD1 3.62Å; Y677-I681 WeakPolarHBondContact O-CG1 3.49Å; Y677-I681 PolarHBondContact O-N 3.2Å; A678-I681 PolarHBondContact O-N 3.41Å; W679-I681 VanDerWaalsContact C-N 3.33Å; W679-I681 PolarHBondContact O-N 2.91Å; I681-Q683 VanDerWaalsContact C-N 3.29Å; I681-Q683 PolarHBondContact O-N 2.89Å; I681-K684 PolarHBondContact O-N 2.79Å
682	L	30.3	Very low	33.4	Very low	102 Å²	102	109.1 Å²	109.1	53%	0.534	56%	0.559	S	S	.	*	H	α-helix	trans	-62.6	-30.9	175	-76.6	164	0	0	0	113.4	A678 W679	A678-L682 PolarHBondContact O-N 2.97Å; W679-L682 HydrophobicContact CE3-CD1 4.05Å; W679-L682 HydrophobicContact CZ3-CD1 4.48Å; W679-L682 WeakPolarHBondContact O-CB 3.43Å; W679-L682 PolarHBondContact O-N 2.93Å
683	Q	33.2	Very low	32.9	Very low	143 Å²	143	115.9 Å²	115.9	67%	0.668	58%	0.575	S	S	*	*	H	α-helix	trans	-76.2	-25.8	175.7	-80.5	-175	-25.4	0	0	114.5	W679 C680 I681 D685	W679-Q683 PolarHBondContact O-N 2.9Å; C680-Q683 PolarHBondContact O-N 3.07Å; I681-Q683 VanDerWaalsContact C-N 3.29Å; I681-Q683 PolarHBondContact O-N 2.89Å; Q683-D685 VanDerWaalsContact C-N 3.35Å; Q683-D685 PolarHBondContact O-N 2.92Å
684	K	31.6	Very low	32.5	Very low	156 Å²	156	116.9 Å²	116.9	68%	0.678	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	2.8	-175.4	-77	-177.5	176.2	179.2	0	114.9	C680 I681 F686	C680-K684 PolarHBondContact O-N 2.73Å; I681-K684 PolarHBondContact O-N 2.79Å; K684-F686 VanDerWaalsContact C-N 3.32Å; K684-F686 WeakPolarHBondContact O-CD2 3.37Å; K684-F686 PolarHBondContact O-N 2.91Å
685	D	27.7	Very low	32.2	Very low	69 Å²	69	117.4 Å²	117.4	37%	0.369	59%	0.585	S	S	.	*			trans	-83.4	76.8	177	-145.3	39.9	0	0	0	110.5	Q683 I687 R766	Q683-D685 VanDerWaalsContact C-N 3.35Å; Q683-D685 PolarHBondContact O-N 2.92Å; D685-I687 PolarHBondContact O-N 3.17Å; D685-R766 IonicContact OD2-CZ 2.93Å; D685-R766 IonicContact OD2-NE 3.78Å; D685-R766 IonicContact OD2-NH2 3.69Å; D685-R766 PolarHBondContact OD2-NH2 3.46Å
686	F	25.1	Very low	31.6	Very low	195 Å²	195	123 Å²	123	86%	0.855	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.7	5.3	-162.9	-86.2	-81.9	0	0	0	120.3	K684	K684-F686 VanDerWaalsContact C-N 3.32Å; K684-F686 WeakPolarHBondContact O-CD2 3.37Å; K684-F686 PolarHBondContact O-N 2.91Å
687	I	28	Very low	31	Very low	156 Å²	156	121.3 Å²	121.3	80%	0.8	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.9	17.9	-165.2	-22.6	179.7	0	0	0	114.9	D685	D685-I687 PolarHBondContact O-N 3.17Å
688	T	29.5	Very low	30.6	Very low	83 Å²	83	120.4 Å²	120.4	51%	0.509	61%	0.611	S	S	.	*			trans	-144.3	130.1	168.5	46.8	0	0	0	0	115.2	R766	T688-R766 PolarHBondContact OG1-NH1 3.29Å; T688-R766 PolarHBondContact OG1-NH2 2.87Å
689	I	29.3	Very low	30.1	Very low	138 Å²	138	127.4 Å²	127.4	71%	0.708	64%	0.638	S	S	*	*			trans	-60.3	138.8	166.1	-61.4	167.3	0	0	0	109.9	P691	I689-P691 WeakPolarHBondContact O-CD 3.44Å
690	N	33.5	Very low	29.7	Very low	82 Å²	82	127.1 Å²	127.1	44%	0.439	65%	0.65	S	S	.	*			trans	-61.5	108.9	173.5	174.6	-2.1	0	0	0	110.6	F692 R693 V694	N690-F692 PolarHBondContact O-N 3.02Å; N690-F692 VanDerWaalsContact O-N 3.16Å; N690-F692 PolarHBondContact OD1-N 2.81Å; N690-R693 PolarHBondContact OD1-N 2.82Å; N690-V694 PolarHBondContact ND2-O 2.84Å
691	P	29.9	Very low	29.5	Very low	109 Å²	109	131 Å²	131	71%	0.708	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	6	-172.7	33.8	-33.3	0	0	0	113.5	I689	I689-P691 WeakPolarHBondContact O-CD 3.44Å
692	F	29.2	Very low	29.1	Very low	108 Å²	108	130.6 Å²	130.6	47%	0.474	68%	0.678	S	S	.	*	T	Hydrogen-bonded Turn	trans	-115.2	-5	179.2	-62.5	-78.4	0	0	0	113.6	N690 V694	N690-F692 PolarHBondContact O-N 3.02Å; N690-F692 VanDerWaalsContact O-N 3.16Å; N690-F692 PolarHBondContact OD1-N 2.81Å; F692-V694 HydrophobicContact CB-CG2 4.48Å; F692-V694 PolarHBondContact O-N 2.83Å
693	R	29.1	Very low	29	Very low	226 Å²	226	132.8 Å²	132.8	85%	0.853	69%	0.69	S	S	*	*			trans	50.8	13.9	-179.6	-75.6	-170	173.8	-173.1	-1	116.8	N690 T695	N690-R693 PolarHBondContact OD1-N 2.82Å; R693-T695 PolarHBondContact O-N 2.85Å
694	V	30	Very low	28.9	Very low	109 Å²	109	131.3 Å²	131.3	66%	0.661	69%	0.692	S	S	*	*			trans	-73.9	114.2	171.7	-176.3	0	0	0	0	109.3	N690 F692	N690-V694 PolarHBondContact ND2-O 2.84Å; F692-V694 HydrophobicContact CB-CG2 4.48Å; F692-V694 PolarHBondContact O-N 2.83Å
695	T	30.7	Very low	28.8	Very low	128 Å²	128	129.5 Å²	129.5	79%	0.785	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-89.4	127.6	167.6	46.1	0	0	0	0	109.5	R693 G697	R693-T695 PolarHBondContact O-N 2.85Å; T695-G697 PolarHBondContact O-N 2.95Å
696	Y	26.4	Very low	29	Very low	187 Å²	187	132.5 Å²	132.5	73%	0.733	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-76.4	116.6	169.2	-160.8	-86	0	0	0	108.2
697	G	27.5	Very low	29.2	Very low	65 Å²	65	129.3 Å²	129.3	67%	0.67	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-73.5	127.7	176.9	0	0	0	0	0	110.3	T695	T695-G697 PolarHBondContact O-N 2.95Å
698	H	29.9	Very low	29.2	Very low	150 Å²	150	126.8 Å²	126.8	69%	0.694	71%	0.713	S	S	*	*			trans	-107.3	110.5	170.9	-171.8	-38.5	0	0	0	107.6	T700	H698-T700 PolarHBondContact O-N 2.85Å
699	E	24.6	Very low	29.1	Very low	185 Å²	185	129.6 Å²	129.6	86%	0.864	72%	0.723	S	S	*	*			trans	-72.1	118.8	164.4	-69.8	-165.6	137.8	0	0	108.2	V701	E699-V701 PolarHBondContact O-N 2.7Å
700	T	27.4	Very low	29	Very low	119 Å²	119	129 Å²	129	73%	0.73	73%	0.726	S	S	*	*			trans	-92.1	88.6	-173.2	51.3	0	0	0	0	110.8	H698	H698-T700 PolarHBondContact O-N 2.85Å
701	V	30.6	Very low	28.6	Very low	140 Å²	140	134.9 Å²	134.9	85%	0.848	75%	0.747	S	S	*	*			trans	-93.4	150.9	155.2	-172.7	0	0	0	0	108.2	E699	E699-V701 PolarHBondContact O-N 2.7Å
702	S	28.5	Very low	28.8	Very low	93 Å²	93	138.9 Å²	138.9	65%	0.65	76%	0.757	S	S	*	*			trans	-116.1	174.3	-133.7	56.1	0	0	0	0	117.2
703	N	27.5	Very low	28.6	Very low	148 Å²	148	143.5 Å²	143.5	79%	0.791	78%	0.777	S	S	*	*			trans	87.4	149.1	162.8	-62	-20.9	0	0	0	118.5
704	P	30.7	Very low	28.7	Very low	111 Å²	111	138.3 Å²	138.3	72%	0.721	78%	0.775	S	S	*	*			trans	-104.7	156.3	-154.1	39	-33.8	0	0	0	114.6
705	P	29.7	Very low	28.5	Very low	118 Å²	118	142.6 Å²	142.6	77%	0.766	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-76.5	144.3	168.8	32.4	-34	0	0	0	111.7
706	P	31.2	Very low	28.5	Very low	132 Å²	132	142.4 Å²	142.4	86%	0.857	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-72.8	168.5	173.6	31.1	-35.1	0	0	0	112.8
707	V	29.2	Very low	28.7	Very low	129 Å²	129	141.1 Å²	141.1	78%	0.782	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-98.4	143.1	-164	162.9	0	0	0	0	112.6
708	S	28.3	Very low	28.7	Very low	103 Å²	103	142.3 Å²	142.3	72%	0.72	79%	0.786	S	S	*	*			trans	74.7	159.1	156.9	85.3	0	0	0	0	118.2
709	I	28	Very low	28.8	Very low	141 Å²	141	140.3 Å²	140.3	72%	0.723	79%	0.789	S	S	*	*			cis	-156.7	150.5	-15.9	-121.9	169.7	0	0	0	111.3
710	T	27.9	Very low	28.9	Very low	125 Å²	125	141.8 Å²	141.8	77%	0.767	79%	0.787	S	S	*	*			trans	47.3	139.1	164.5	56.6	0	0	0	0	122.5
711	K	25.1	Very low	29.2	Very low	206 Å²	206	139.2 Å²	139.2	90%	0.896	78%	0.783	S	S	*	*			trans	-108	130.9	146.2	-76.1	-178.5	176.6	176.1	0	110.2
712	Q	32.7	Very low	29.1	Very low	194 Å²	194	137.9 Å²	137.9	91%	0.907	77%	0.768	S	S	*	*			trans	-125.8	171.4	149.6	-82.5	-154.9	0.5	0	0	110.1
713	K	25.8	Very low	29.2	Very low	205 Å²	205	141.6 Å²	141.6	89%	0.891	77%	0.773	S	S	*	*			trans	-112.4	127.7	-154.2	-56.9	170.2	-177.9	172.3	0	113.7
714	S	30.7	Very low	29.3	Very low	117 Å²	117	138.4 Å²	138.4	82%	0.818	77%	0.767	S	S	*	*				-177.9	136.3	128.6	27.7	0	0	0	0	107.9
715	K	27.1	Very low	29.2	Very low	198 Å²	198	140.4 Å²	140.4	86%	0.861	77%	0.771	S	S	*	*			cis	103.1	133.5	29.5	-171.4	-172.9	-178	-171.1	0	110.2
716	V	30.4	Very low	29.3	Very low	124 Å²	124	144.4 Å²	144.4	75%	0.752	78%	0.78	S	S	*	*			trans	107.7	122.8	174.1	-177.3	0	0	0	0	115.5
717	L	30.4	Very low	29.1	Very low	160 Å²	160	143.3 Å²	143.3	84%	0.838	78%	0.775	S	S	*	*			trans	-6.4	166	155.5	-74	73.4	0	0	0	120.8
718	S	27.2	Very low	29.1	Very low	90 Å²	90	143.8 Å²	143.8	63%	0.629	78%	0.778	S	S	*	*			cis	174.8	145.7	-19.1	173.8	0	0	0	0	109.6
719	S	31.2	Very low	29	Very low	108 Å²	108	148.1 Å²	148.1	76%	0.755	78%	0.784	S	S	*	*			trans	60.7	153.9	156.8	41.6	0	0	0	0	119.3
720	R	27.8	Very low	28.9	Very low	217 Å²	217	148 Å²	148	82%	0.819	78%	0.783	S	S	*	*			cis	-167.8	145.3	-15.4	163	178	175.9	171	-1.2	109.7	E722	R720-E722 IonicContact CZ-OE1 2.66Å; R720-E722 VanDerWaalsContact CZ-OE1 3.22Å; R720-E722 IonicContact NE-OE1 3.83Å; R720-E722 PolarHBondContact NE-OE1 2.67Å; R720-E722 IonicContact NH2-OE1 3.48Å; R720-E722 PolarHBondContact NH2-OE1 2.73Å
721	G	33.2	Very low	28.9	Very low	64 Å²	64	147.4 Å²	147.4	66%	0.66	78%	0.776	S	S	*	*			trans	157.6	109.1	165.5	0	0	0	0	0	109.6
722	E	28.7	Very low	29	Very low	112 Å²	112	143.3 Å²	143.3	52%	0.523	77%	0.77	S	S	.	*				59.9	120.6	67.7	-63.9	-174.8	-137.8	0	0	112	R720	R720-E722 IonicContact CZ-OE1 2.66Å; R720-E722 VanDerWaalsContact CZ-OE1 3.22Å; R720-E722 IonicContact NE-OE1 3.83Å; R720-E722 PolarHBondContact NE-OE1 2.67Å; R720-E722 IonicContact NH2-OE1 3.48Å; R720-E722 PolarHBondContact NH2-OE1 2.73Å
723	K	31.4	Very low	28.8	Very low	172 Å²	172	138.9 Å²	138.9	75%	0.748	75%	0.751	S	S	*	*			cis	-159.6	154.4	24.1	-116	150.2	179.2	136.7	0	113.1
724	A	28.9	Very low	28.9	Very low	81 Å²	81	134.7 Å²	134.7	67%	0.669	74%	0.735	S	S	*	*			trans	40.8	142.2	133.7	0	0	0	0	0	121.3
725	N	27.8	Very low	28.7	Very low	153 Å²	153	137.4 Å²	137.4	82%	0.818	74%	0.735	S	S	*	*			cis	-159.8	144	10	-98.5	-25.3	0	0	0	110.7
726	Q	32.9	Very low	28.9	Very low	202 Å²	202	132.2 Å²	132.2	94%	0.944	72%	0.72	S	S	*	*				-165.6	151.7	122.2	-108.9	-179	16	0	0	110.6
727	S	26.7	Very low	28.7	Very low	109 Å²	109	130.5 Å²	130.5	76%	0.762	71%	0.706	S	S	*	*			trans	-119.4	129	-161.9	58.2	0	0	0	0	113.7
728	V	29	Very low	28.7	Very low	138 Å²	138	129.1 Å²	129.1	84%	0.836	70%	0.698	S	S	*	*			trans	-107	136.8	157	178.5	0	0	0	0	108	I730	V728-I730 PolarHBondContact O-N 3.02Å
729	K	25.7	Very low	28.8	Very low	195 Å²	195	128.7 Å²	128.7	85%	0.848	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-77	120.6	179.1	-66	176.5	179.7	176.3	0	109.8
730	I	26.7	Very low	28.7	Very low	138 Å²	138	132.8 Å²	132.8	71%	0.708	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-95.5	139.3	162.7	-61.8	176.2	0	0	0	107.5	V728	V728-I730 PolarHBondContact O-N 3.02Å
731	N	26.8	Very low	28.6	Very low	113 Å²	113	131.9 Å²	131.9	60%	0.604	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-81.9	145.9	-175.4	-74.9	-40.8	0	0	0	111.5	I733	N731-I733 PolarHBondContact O-N 2.62Å
732	P	27.5	Very low	28.4	Very low	120 Å²	120	135 Å²	135	78%	0.779	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	54.2	-177.9	35.3	-38.1	0	0	0	112.3
733	I	29.3	Very low	28.5	Very low	101 Å²	101	137.1 Å²	137.1	52%	0.518	70%	0.702	S	S	.	*	T	Hydrogen-bonded Turn	trans	-129.6	-31.8	-175.5	-62.9	179.5	0	0	0	111.2	N731 T736 I737	N731-I733 PolarHBondContact O-N 2.62Å; I733-T736 PolarHBondContact O-OG1 2.99Å; I733-I737 HydrophobicContact CG2-CD1 4.05Å; I733-I737 WeakPolarHBondContact O-CG1 3.45Å
734	E	27.3	Very low	28.5	Very low	116 Å²	116	133.5 Å²	133.5	54%	0.542	70%	0.695	S	S	.	*	S	Bend	trans	-77.1	-32.1	-173.5	-64.5	178.2	128.7	0	0	113.3	T736 I737 I738	E734-T736 VanDerWaalsContact C-N 3.28Å; E734-T736 PolarHBondContact O-N 2.87Å; E734-I737 PolarHBondContact O-N 3.09Å; E734-I738 PolarHBondContact O-N 2.63Å
735	E	27.1	Very low	28.7	Very low	174 Å²	174	134.2 Å²	134.2	81%	0.813	69%	0.687	S	S	*	*	H	α-helix	trans	-66.2	-28.5	175.5	-67.5	-169.2	125.1	0	0	112.8	I737 S739	E735-I737 VanDerWaalsContact C-N 3.26Å; E735-I737 PolarHBondContact O-N 3.42Å; E735-S739 WeakPolarHBondContact O-CB 3.4Å; E735-S739 PolarHBondContact O-N 3.01Å; E735-S739 PolarHBondContact O-OG 3.11Å
736	T	30.9	Very low	29.2	Very low	89 Å²	89	130 Å²	130	55%	0.546	67%	0.665	S	S	.	*	H	α-helix	trans	-75.6	-9.4	170.7	31.7	0	0	0	0	114.4	I733 E734	I733-T736 PolarHBondContact O-OG1 2.99Å; E734-T736 VanDerWaalsContact C-N 3.28Å; E734-T736 PolarHBondContact O-N 2.87Å
737	I	27.1	Very low	29.5	Very low	89 Å²	89	124.1 Å²	124.1	46%	0.456	64%	0.644	S	S	.	*	H	α-helix	trans	-101.7	-40.8	-179.7	-65.7	172	0	0	0	110.2	I733 E734 E735 S739 R740	I733-I737 HydrophobicContact CG2-CD1 4.05Å; I733-I737 WeakPolarHBondContact O-CG1 3.45Å; E734-I737 PolarHBondContact O-N 3.09Å; E735-I737 VanDerWaalsContact C-N 3.26Å; E735-I737 PolarHBondContact O-N 3.42Å; I737-S739 VanDerWaalsContact C-N 3.33Å; I737-S739 PolarHBondContact O-N 3.36Å; I737-R740 PolarHBondContact O-N 2.77Å
738	I	29.6	Very low	30	Very low	131 Å²	131	122 Å²	122	67%	0.672	62%	0.624	S	S	*	*	H	α-helix	trans	-73.1	-26.5	178.1	-62.2	175	0	0	0	112.2	E734 N742	E734-I738 PolarHBondContact O-N 2.63Å; I738-N742 PolarHBondContact O-ND2 2.96Å
739	S	30	Very low	30.5	Very low	81 Å²	81	119.9 Å²	119.9	57%	0.566	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-15.7	176.6	53.6	0	0	0	0	114.9	E735 I737	E735-S739 WeakPolarHBondContact O-CB 3.4Å; E735-S739 PolarHBondContact O-N 3.01Å; E735-S739 PolarHBondContact O-OG 3.11Å; I737-S739 VanDerWaalsContact C-N 3.33Å; I737-S739 PolarHBondContact O-N 3.36Å
740	R	28.4	Very low	31.1	Very low	194 Å²	194	113.2 Å²	113.2	73%	0.732	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	-17	-170.6	-152.4	167.5	-173.6	164.2	-1.4	114.7	I737 N742	I737-R740 PolarHBondContact O-N 2.77Å; R740-N742 PolarHBondContact O-N 3.15Å
741	W	26.7	Very low	31.8	Very low	198 Å²	198	109.1 Å²	109.1	75%	0.75	56%	0.562	S	S	*	*	S	Bend	trans	-88	13.8	174.4	-67	65	0	0	0	112.7	I1006	W741-I1006 HydrophobicContact CZ2-CD1 4.12Å
742	N	27.6	Very low	32.4	Very low	128 Å²	128	105 Å²	105	68%	0.684	54%	0.544	S	S	*	.			trans	-109.4	33.6	171	-75.5	-66.2	0	0	0	111.9	I738 R740 P744	I738-N742 PolarHBondContact O-ND2 2.96Å; R740-N742 PolarHBondContact O-N 3.15Å; N742-P744 VanDerWaalsContact O-CD 3.27Å; N742-P744 WeakPolarHBondContact O-CD 3.31Å
743	Q	30.4	Very low	33	Very low	158 Å²	158	102 Å²	102	74%	0.738	52%	0.52	S	S	*	.			trans	-79	110.1	151.8	-75.1	-162.2	-12	0	0	107.3
744	P	31.8	Very low	33.6	Very low	95 Å²	95	100.6 Å²	100.6	62%	0.617	52%	0.516	S	S	*	.			trans	-64.5	143.2	171.2	30.1	-34.4	0	0	0	108.3	N742 D746	N742-P744 VanDerWaalsContact O-CD 3.27Å; N742-P744 WeakPolarHBondContact O-CD 3.31Å; P744-D746 VanDerWaalsContact C-N 3.34Å; P744-D746 PolarHBondContact O-N 3.1Å
745	I	33.2	Very low	34.2	Very low	96 Å²	96	99.3 Å²	99.3	49%	0.492	51%	0.507	S	S	.	.	S	Bend	trans	-53.3	114.3	143.4	-59.1	167.4	0	0	0	103.5	P747 I749 L750	I745-P747 VanDerWaalsContact O-N 3.08Å; I745-I749 HydrophobicContact CG2-CG2 4.39Å; I745-L750 HydrophobicContact CB-CB 4.37Å; I745-L750 HydrophobicContact CB-CD1 4.18Å; I745-L750 HydrophobicContact CB-CG 4.32Å; I745-L750 HydrophobicContact CD1-CD1 4.24Å; I745-L750 HydrophobicContact CD1-CG 4.48Å; I745-L750 HydrophobicContact CG2-CB 3.87Å; I745-L750 HydrophobicContact CG2-CD1 4.44Å; I745-L750 HydrophobicContact CG2-CG 4.02Å
746	D	39.6	Very low	34.8	Very low	65 Å²	65	94.4 Å²	94.4	35%	0.348	49%	0.485	S	S	.	.			trans	-38.5	121.2	-171.8	173.8	-3.2	0	0	0	108.8	P744 D748 I749 L750	P744-D746 VanDerWaalsContact C-N 3.34Å; P744-D746 PolarHBondContact O-N 3.1Å; D746-D748 PolarHBondContact O-N 3.5Å; D746-D748 PolarHBondContact OD1-N 3.43Å; D746-I749 HydrophobicContact CB-CB 4.06Å; D746-I749 HydrophobicContact CB-CD1 3.92Å; D746-I749 HydrophobicContact CB-CG1 3.87Å; D746-I749 CarbonylContact O-C 3.57Å; D746-I749 WeakPolarHBondContact O-CA 3.35Å; D746-I749 PolarHBondContact O-N 2.98Å; D746-L750 PolarHBondContact O-N 3.15Å
747	P	38.7	Very low	35.2	Very low	78 Å²	78	93.5 Å²	93.5	51%	0.506	48%	0.475	S	S	.	.	H	α-helix	trans	-53.9	-31.5	-176.3	21.4	-33.2	0	0	0	110.9	I745 V751	I745-P747 VanDerWaalsContact O-N 3.08Å; P747-V751 WeakPolarHBondContact O-CA 3.32Å; P747-V751 WeakPolarHBondContact O-CB 3.34Å; P747-V751 WeakPolarHBondContact O-CG2 3.46Å; P747-V751 PolarHBondContact O-N 3.35Å
748	D	36.8	Very low	35.8	Very low	65 Å²	65	91.2 Å²	91.2	35%	0.348	47%	0.466	S	S	.	.	H	α-helix	trans	-69.9	-31.9	173.5	-78.2	-19.4	0	0	0	113.4	D746 A752 Q837	D746-D748 PolarHBondContact O-N 3.5Å; D746-D748 PolarHBondContact OD1-N 3.43Å; D748-A752 WeakPolarHBondContact O-CA 3.35Å; D748-A752 WeakPolarHBondContact O-CB 3.37Å; D748-A752 PolarHBondContact O-N 2.97Å; D748-Q837 PolarHBondContact OD2-NE2 3.11Å
749	I	39.3	Very low	36.1	Very low	93 Å²	93	86.4 Å²	86.4	48%	0.477	44%	0.442	S	S	.	.	H	α-helix	trans	-74.4	-48.6	173.6	-64.7	178.6	0	0	0	111.4	I745 D746 V751 A752 I753	I745-I749 HydrophobicContact CG2-CG2 4.39Å; D746-I749 HydrophobicContact CB-CB 4.06Å; D746-I749 HydrophobicContact CB-CD1 3.92Å; D746-I749 HydrophobicContact CB-CG1 3.87Å; D746-I749 CarbonylContact O-C 3.57Å; D746-I749 WeakPolarHBondContact O-CA 3.35Å; D746-I749 PolarHBondContact O-N 2.98Å; I749-V751 VanDerWaalsContact C-N 3.31Å; I749-V751 PolarHBondContact O-N 3.45Å; I749-A752 PolarHBondContact O-N 2.8Å; I749-A752 VanDerWaalsContact O-N 3.17Å; I749-I753 HydrophobicContact CG2-CD1 4.12Å; I749-I753 WeakPolarHBondContact O-CG1 3.47Å; I749-I753 PolarHBondContact O-N 2.65Å
750	L	39	Very low	36.4	Very low	55 Å²	55	88.3 Å²	88.3	29%	0.288	44%	0.44	S	S	.	.	H	α-helix	trans	-63.6	-43	178.7	-144.1	-177.4	0	0	0	109.5	I745 D746 I753 V754	I745-L750 HydrophobicContact CB-CB 4.37Å; I745-L750 HydrophobicContact CB-CD1 4.18Å; I745-L750 HydrophobicContact CB-CG 4.32Å; I745-L750 HydrophobicContact CD1-CD1 4.24Å; I745-L750 HydrophobicContact CD1-CG 4.48Å; I745-L750 HydrophobicContact CG2-CB 3.87Å; I745-L750 HydrophobicContact CG2-CD1 4.44Å; I745-L750 HydrophobicContact CG2-CG 4.02Å; D746-L750 PolarHBondContact O-N 3.15Å; L750-I753 PolarHBondContact O-N 3.48Å; L750-V754 HydrophobicContact CD2-CG2 3.92Å; L750-V754 WeakPolarHBondContact O-CB 3.25Å; L750-V754 WeakPolarHBondContact O-CG2 3.34Å; L750-V754 PolarHBondContact O-N 2.93Å
751	V	41.9	Very low	36.8	Very low	52 Å²	52	84.4 Å²	84.4	32%	0.315	43%	0.425	S	S	.	.	H	α-helix	trans	-73.7	-25.6	175.3	-176.9	0	0	0	0	111.7	P747 I749 R755	P747-V751 WeakPolarHBondContact O-CA 3.32Å; P747-V751 WeakPolarHBondContact O-CB 3.34Å; P747-V751 WeakPolarHBondContact O-CG2 3.46Å; P747-V751 PolarHBondContact O-N 3.35Å; I749-V751 VanDerWaalsContact C-N 3.31Å; I749-V751 PolarHBondContact O-N 3.45Å; V751-R755 HydrophobicContact CG1-CG 3.85Å; V751-R755 WeakPolarHBondContact O-CA 3.31Å; V751-R755 WeakPolarHBondContact O-CB 3.22Å; V751-R755 WeakPolarHBondContact O-CD 3.29Å; V751-R755 WeakPolarHBondContact O-CG 3.23Å; V751-R755 PolarHBondContact O-N 3.44Å
752	A	38.2	Very low	37.2	Very low	28 Å²	28	75.9 Å²	75.9	23%	0.231	40%	0.399	C	S	.	.	H	α-helix	trans	-67.2	-45	168.1	0	0	0	0	0	111.2	D748 I749 V754 R755 I756	D748-A752 WeakPolarHBondContact O-CA 3.35Å; D748-A752 WeakPolarHBondContact O-CB 3.37Å; D748-A752 PolarHBondContact O-N 2.97Å; I749-A752 PolarHBondContact O-N 2.8Å; I749-A752 VanDerWaalsContact O-N 3.17Å; A752-V754 PolarHBondContact O-N 3.05Å; A752-R755 PolarHBondContact O-N 3.28Å; A752-I756 VanDerWaalsContact O-CB 3.26Å; A752-I756 WeakPolarHBondContact O-CB 3.48Å; A752-I756 WeakPolarHBondContact O-CD1 3.43Å; A752-I756 WeakPolarHBondContact O-CG1 3.22Å; A752-I756 PolarHBondContact O-N 3.27Å
753	I	40.5	Very low	37.7	Very low	56 Å²	56	76.6 Å²	76.6	29%	0.287	39%	0.393	S	S	.	.	H	α-helix	trans	-60.9	-46.6	174.9	-67.8	167.3	0	0	0	110.1	L663 I749 L750 Q757	L663-I753 HydrophobicContact CD2-CG2 4.14Å; I749-I753 HydrophobicContact CG2-CD1 4.12Å; I749-I753 WeakPolarHBondContact O-CG1 3.47Å; I749-I753 PolarHBondContact O-N 2.65Å; L750-I753 PolarHBondContact O-N 3.48Å; I753-Q757 WeakPolarHBondContact O-CB 3.44Å; I753-Q757 WeakPolarHBondContact O-CG 3.24Å; I753-Q757 PolarHBondContact O-N 3.22Å
754	V	41.5	Very low	37.9	Very low	71 Å²	71	74.8 Å²	74.8	43%	0.43	38%	0.38	S	S	.	.	H	α-helix	trans	-66.6	-38.3	176.3	170.3	0	0	0	0	112	L750 A752 Q757 S758	L750-V754 HydrophobicContact CD2-CG2 3.92Å; L750-V754 WeakPolarHBondContact O-CB 3.25Å; L750-V754 WeakPolarHBondContact O-CG2 3.34Å; L750-V754 PolarHBondContact O-N 2.93Å; A752-V754 PolarHBondContact O-N 3.05Å; V754-Q757 PolarHBondContact O-N 3.37Å; V754-S758 WeakPolarHBondContact O-CB 3.48Å; V754-S758 PolarHBondContact O-N 2.91Å
755	R	40	Very low	38.2	Very low	90 Å²	90	72.9 Å²	72.9	34%	0.34	36%	0.364	S	S	.	.	H	α-helix	trans	-69.2	-43.7	177	-77.7	170.7	-179.5	146	-1.9	111	V751 A752 S758 L759 L830	V751-R755 HydrophobicContact CG1-CG 3.85Å; V751-R755 WeakPolarHBondContact O-CA 3.31Å; V751-R755 WeakPolarHBondContact O-CB 3.22Å; V751-R755 WeakPolarHBondContact O-CD 3.29Å; V751-R755 WeakPolarHBondContact O-CG 3.23Å; V751-R755 PolarHBondContact O-N 3.44Å; A752-R755 PolarHBondContact O-N 3.28Å; R755-S758 WeakPolarHBondContact CA-OG 3.3Å; R755-S758 CarbonylContact O-C 3.51Å; R755-S758 WeakPolarHBondContact O-CA 3.47Å; R755-S758 WeakPolarHBondContact O-CB 3.48Å; R755-S758 PolarHBondContact O-N 3.32Å; R755-S758 VanDerWaalsContact O-N 3.1Å; R755-S758 PolarHBondContact O-OG 2.88Å; R755-L759 WeakPolarHBondContact O-CB 3.39Å; R755-L759 PolarHBondContact O-N 2.97Å; R755-L830 VanDerWaalsContact CZ-CD1 3.45Å
756	I	39.9	Very low	38.5	Very low	71 Å²	71	72 Å²	72	36%	0.364	35%	0.354	S	S	.	.	H	α-helix	trans	-61.6	-42.7	173	-69.8	165.3	0	0	0	110.3	A752 S758 L759 F760 L831	A752-I756 VanDerWaalsContact O-CB 3.26Å; A752-I756 WeakPolarHBondContact O-CB 3.48Å; A752-I756 WeakPolarHBondContact O-CD1 3.43Å; A752-I756 WeakPolarHBondContact O-CG1 3.22Å; A752-I756 PolarHBondContact O-N 3.27Å; I756-S758 PolarHBondContact O-N 2.82Å; I756-L759 VanDerWaalsContact O-CB 3.29Å; I756-L759 WeakPolarHBondContact O-CB 3.43Å; I756-L759 PolarHBondContact O-N 3Å; I756-F760 HydrophobicContact CG2-CD2 4.04Å; I756-F760 HydrophobicContact CG2-CE2 4.33Å; I756-F760 WeakPolarHBondContact O-CD2 3.41Å; I756-F760 PolarHBondContact O-N 3.45Å; I756-L831 HydrophobicContact CD1-CD2 4.33Å; I756-L831 HydrophobicContact CG1-CD2 3.99Å
757	Q	39.7	Very low	38.4	Very low	70 Å²	70	70.3 Å²	70.3	33%	0.327	35%	0.345	S	S	.	.	H	α-helix	trans	-63.5	-38.2	171.1	-74.3	-157.4	37.8	0	0	112.4	I753 V754 L759 F760 R761	I753-Q757 WeakPolarHBondContact O-CB 3.44Å; I753-Q757 WeakPolarHBondContact O-CG 3.24Å; I753-Q757 PolarHBondContact O-N 3.22Å; V754-Q757 PolarHBondContact O-N 3.37Å; Q757-L759 PolarHBondContact O-N 2.79Å; Q757-F760 CarbonylContact O-C 3.55Å; Q757-F760 PolarHBondContact O-N 2.75Å; Q757-R761 WeakPolarHBondContact O-CA 3.25Å; Q757-R761 WeakPolarHBondContact O-CB 3.23Å; Q757-R761 PolarHBondContact O-N 3.35Å
758	S	38.7	Very low	38.2	Very low	40 Å²	40	68 Å²	68	28%	0.28	33%	0.333	S	S	.	.	H	α-helix	trans	-69.1	-23.2	174.6	85	0	0	0	0	113.6	V754 R755 I756 R761	V754-S758 WeakPolarHBondContact O-CB 3.48Å; V754-S758 PolarHBondContact O-N 2.91Å; R755-S758 WeakPolarHBondContact CA-OG 3.3Å; R755-S758 CarbonylContact O-C 3.51Å; R755-S758 WeakPolarHBondContact O-CA 3.47Å; R755-S758 WeakPolarHBondContact O-CB 3.48Å; R755-S758 PolarHBondContact O-N 3.32Å; R755-S758 VanDerWaalsContact O-N 3.1Å; R755-S758 PolarHBondContact O-OG 2.88Å; I756-S758 PolarHBondContact O-N 2.82Å; S758-R761 CarbonylContact C-O 3.58Å; S758-R761 VanDerWaalsContact CA-O 3.29Å; S758-R761 WeakPolarHBondContact CA-O 3.17Å
759	L	35.9	Very low	38.2	Very low	31 Å²	31	70 Å²	70	16%	0.162	34%	0.343	C	S	.	.	H	α-helix	trans	-75.8	-41.1	173.7	-142.4	152.1	0	0	0	109.5	M572 R755 I756 Q757 I765 C827 L831	M572-L759 HydrophobicContact CE-CD1 4.26Å; M572-L759 HydrophobicContact CE-CD2 4.28Å; M572-L759 HydrophobicContact SD-CD2 4.49Å; R755-L759 WeakPolarHBondContact O-CB 3.39Å; R755-L759 PolarHBondContact O-N 2.97Å; I756-L759 VanDerWaalsContact O-CB 3.29Å; I756-L759 WeakPolarHBondContact O-CB 3.43Å; I756-L759 PolarHBondContact O-N 3Å; Q757-L759 PolarHBondContact O-N 2.79Å; L759-I765 WeakPolarHBondContact O-CB 3.44Å; L759-I765 VanDerWaalsContact O-CD1 3.26Å; L759-I765 WeakPolarHBondContact O-CD1 3.48Å; L759-I765 WeakPolarHBondContact O-CG1 3.5Å; L759-C827 HydrophobicContact CD1-CB 4.38Å; L759-L831 HydrophobicContact CD1-CD1 3.99Å
760	F	35.9	Very low	38.2	Very low	121 Å²	121	74.4 Å²	74.4	53%	0.531	35%	0.353	S	S	.	.	H	α-helix	trans	-89	-15.5	178.1	-80.2	-73.6	0	0	0	116	I756 Q757 I765	I756-F760 HydrophobicContact CG2-CD2 4.04Å; I756-F760 HydrophobicContact CG2-CE2 4.33Å; I756-F760 WeakPolarHBondContact O-CD2 3.41Å; I756-F760 PolarHBondContact O-N 3.45Å; Q757-F760 CarbonylContact O-C 3.55Å; Q757-F760 PolarHBondContact O-N 2.75Å; F760-I765 HydrophobicContact CD1-CD1 4.44Å
761	R	36.8	Very low	38.1	Very low	111 Å²	111	72.4 Å²	72.4	42%	0.419	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.4	145.4	-177.7	-66.8	175.7	167.8	163.8	-8.2	111.1	Q757 S758	Q757-R761 WeakPolarHBondContact O-CA 3.25Å; Q757-R761 WeakPolarHBondContact O-CB 3.23Å; Q757-R761 PolarHBondContact O-N 3.35Å; S758-R761 CarbonylContact C-O 3.58Å; S758-R761 VanDerWaalsContact CA-O 3.29Å; S758-R761 WeakPolarHBondContact CA-O 3.17Å
762	G	36.5	Very low	38	Very low	19 Å²	19	74.2 Å²	74.2	20%	0.196	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	107.1	-65.2	157.8	0	0	0	0	0	116.6	R766	G762-R766 PolarHBondContact O-NE 3.23Å; G762-R766 PolarHBondContact O-NH2 2.75Å
763	Y	37	Very low	38.4	Very low	144 Å²	144	78.8 Å²	78.8	57%	0.565	37%	0.367	S	S	*	.	S	Bend	trans	-143.4	-48.3	-173.6	-166.5	-94.6	0	0	0	114.1	R766 N767	Y763-R766 WeakPolarHBondContact O-CB 3.47Å; Y763-R766 PolarHBondContact O-N 3.44Å; Y763-R766 VanDerWaalsContact O-N 3.09Å; Y763-N767 VanDerWaalsContact CE1-ND2 3.31Å; Y763-N767 WeakPolarHBondContact CE1-ND2 3.3Å; Y763-N767 PolarHBondContact O-N 2.7Å
764	R	35.1	Very low	38.8	Very low	120 Å²	120	76.9 Å²	76.9	45%	0.453	36%	0.358	S	S	.	.	H	α-helix	trans	-69.5	-40.2	-177	-65.3	-174.6	-179.8	-169.9	-0.2	111.5	N767 A768 C827	R764-N767 PolarHBondContact O-N 2.83Å; R764-A768 PolarHBondContact O-N 2.96Å; R764-C827 PolarHBondContact NH1-SG 3.15Å
765	I	37.3	Very low	39.3	Very low	54 Å²	54	78 Å²	78	28%	0.277	36%	0.362	S	S	.	.	H	α-helix	trans	-70.4	-26	167.6	-111.7	-176	0	0	0	113.9	L759 F760 N767 A768 I769	L759-I765 WeakPolarHBondContact O-CB 3.44Å; L759-I765 VanDerWaalsContact O-CD1 3.26Å; L759-I765 WeakPolarHBondContact O-CD1 3.48Å; L759-I765 WeakPolarHBondContact O-CG1 3.5Å; F760-I765 HydrophobicContact CD1-CD1 4.44Å; I765-N767 VanDerWaalsContact C-N 3.3Å; I765-N767 PolarHBondContact O-N 3.02Å; I765-A768 HydrophobicContact CG1-CB 4.31Å; I765-A768 CarbonylContact O-C 3.41Å; I765-A768 PolarHBondContact O-N 2.78Å; I765-I769 HydrophobicContact CG2-CD1 3.83Å; I765-I769 HydrophobicContact CG2-CG1 4.46Å; I765-I769 VanDerWaalsContact O-CB 3.29Å; I765-I769 WeakPolarHBondContact O-CB 3.3Å; I765-I769 VanDerWaalsContact O-CG1 3.23Å; I765-I769 WeakPolarHBondContact O-CG1 3.15Å; I765-I769 PolarHBondContact O-N 2.94Å
766	R	39.7	Very low	39.7	Very low	77 Å²	77	80.2 Å²	80.2	29%	0.291	37%	0.371	S	S	.	.	H	α-helix	trans	-66	-36.2	171.2	-78.8	-157.3	-95.2	-100.8	14.4	111.4	D685 T688 G762 Y763 I769 R770	D685-R766 IonicContact OD2-CZ 2.93Å; D685-R766 IonicContact OD2-NE 3.78Å; D685-R766 IonicContact OD2-NH2 3.69Å; D685-R766 PolarHBondContact OD2-NH2 3.46Å; T688-R766 PolarHBondContact OG1-NH1 3.29Å; T688-R766 PolarHBondContact OG1-NH2 2.87Å; G762-R766 PolarHBondContact O-NE 3.23Å; G762-R766 PolarHBondContact O-NH2 2.75Å; Y763-R766 WeakPolarHBondContact O-CB 3.47Å; Y763-R766 PolarHBondContact O-N 3.44Å; Y763-R766 VanDerWaalsContact O-N 3.09Å; R766-I769 PolarHBondContact O-N 3.5Å; R766-R770 PolarHBondContact O-N 2.92Å
767	N	38.1	Very low	40.3	Very low	30 Å²	30	77.6 Å²	77.6	16%	0.16	36%	0.358	C	S	.	.	H	α-helix	trans	-74.2	-35.5	171.6	-71	-20.9	0	0	0	112.3	Y763 R764 I765 I769 R770 L771 L820	Y763-N767 VanDerWaalsContact CE1-ND2 3.31Å; Y763-N767 WeakPolarHBondContact CE1-ND2 3.3Å; Y763-N767 PolarHBondContact O-N 2.7Å; R764-N767 PolarHBondContact O-N 2.83Å; I765-N767 VanDerWaalsContact C-N 3.3Å; I765-N767 PolarHBondContact O-N 3.02Å; N767-I769 VanDerWaalsContact C-N 3.3Å; N767-I769 PolarHBondContact O-N 2.81Å; N767-R770 CarbonylContact O-C 3.25Å; N767-R770 WeakPolarHBondContact O-CA 3.44Å; N767-R770 WeakPolarHBondContact O-CB 3.43Å; N767-R770 PolarHBondContact O-N 2.89Å; N767-R770 VanDerWaalsContact O-N 3.14Å; N767-L771 WeakPolarHBondContact O-CG 3.45Å; N767-L771 PolarHBondContact O-N 2.84Å; N767-L820 HydrophobicContact CB-CD1 4.42Å
768	A	34	Very low	41	Very low	30 Å²	30	75.4 Å²	75.4	25%	0.248	35%	0.348	C	S	.	.	H	α-helix	trans	-67.8	-26.7	170.8	0	0	0	0	0	113.3	R764 I765 L771 N772	R764-A768 PolarHBondContact O-N 2.96Å; I765-A768 HydrophobicContact CG1-CB 4.31Å; I765-A768 CarbonylContact O-C 3.41Å; I765-A768 PolarHBondContact O-N 2.78Å; A768-L771 CarbonylContact O-C 3.39Å; A768-L771 WeakPolarHBondContact O-CA 3.16Å; A768-L771 WeakPolarHBondContact O-CB 3.2Å; A768-L771 PolarHBondContact O-N 3.47Å; A768-N772 PolarHBondContact O-N 3.31Å
769	I	37	Very low	41.8	Very low	108 Å²	108	78.9 Å²	78.9	55%	0.554	36%	0.36	S	S	*	.	H	α-helix	trans	-79.7	-23.9	171.2	-71.3	171.1	0	0	0	111.2	I765 R766 N767 N772	I765-I769 HydrophobicContact CG2-CD1 3.83Å; I765-I769 HydrophobicContact CG2-CG1 4.46Å; I765-I769 VanDerWaalsContact O-CB 3.29Å; I765-I769 WeakPolarHBondContact O-CB 3.3Å; I765-I769 VanDerWaalsContact O-CG1 3.23Å; I765-I769 WeakPolarHBondContact O-CG1 3.15Å; I765-I769 PolarHBondContact O-N 2.94Å; R766-I769 PolarHBondContact O-N 3.5Å; N767-I769 VanDerWaalsContact C-N 3.3Å; N767-I769 PolarHBondContact O-N 2.81Å; I769-N772 WeakPolarHBondContact O-CB 3.24Å; I769-N772 PolarHBondContact O-N 2.87Å
770	R	38.5	Very low	42.6	Very low	184 Å²	184	78.8 Å²	78.8	69%	0.694	36%	0.361	S	S	*	.	H	α-helix	trans	-69.5	-35.9	161.3	-74.8	173.9	164.9	167.2	-6.8	111.5	R766 N767 N772 Q773	R766-R770 PolarHBondContact O-N 2.92Å; N767-R770 CarbonylContact O-C 3.25Å; N767-R770 WeakPolarHBondContact O-CA 3.44Å; N767-R770 WeakPolarHBondContact O-CB 3.43Å; N767-R770 PolarHBondContact O-N 2.89Å; N767-R770 VanDerWaalsContact O-N 3.14Å; R770-N772 PolarHBondContact O-N 2.87Å; R770-Q773 PolarHBondContact O-N 2.68Å
771	L	37	Very low	43.7	Very low	14 Å²	14	73.2 Å²	73.2	7%	0.073	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-10.1	167.2	-63	176.5	0	0	0	113.8	N767 A768 Q773 P774 M777 L820	N767-L771 WeakPolarHBondContact O-CG 3.45Å; N767-L771 PolarHBondContact O-N 2.84Å; A768-L771 CarbonylContact O-C 3.39Å; A768-L771 WeakPolarHBondContact O-CA 3.16Å; A768-L771 WeakPolarHBondContact O-CB 3.2Å; A768-L771 PolarHBondContact O-N 3.47Å; L771-Q773 CarbonylContact O-C 3.2Å; L771-Q773 VanDerWaalsContact O-C 3.3Å; L771-Q773 PolarHBondContact O-N 3.04Å; L771-P774 VanDerWaalsContact O-CD 3.27Å; L771-P774 WeakPolarHBondContact O-CD 3.47Å; L771-M777 HydrophobicContact CD2-CE 3.66Å; L771-M777 HydrophobicContact CD2-CG 3.57Å; L771-M777 HydrophobicContact CD2-SD 3.5Å; L771-M777 VanDerWaalsContact CD2-SD 3.5Å; L771-L820 HydrophobicContact CD1-CD2 4.05Å
772	N	39.7	Very low	44.7	Very low	89 Å²	89	70.9 Å²	70.9	48%	0.476	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-6.4	167.5	-160.4	33.4	0	0	0	112	K643 A768 I769 R770 P774	K643-N772 WeakPolarHBondContact CE-OD1 3.47Å; A768-N772 PolarHBondContact O-N 3.31Å; I769-N772 WeakPolarHBondContact O-CB 3.24Å; I769-N772 PolarHBondContact O-N 2.87Å; R770-N772 PolarHBondContact O-N 2.87Å; N772-P774 VanDerWaalsContact C-CD 3.47Å; N772-P774 WeakPolarHBondContact O-CD 3.5Å
773	Q	47	Very low	45.7	Very low	125 Å²	125	72.7 Å²	72.7	58%	0.584	34%	0.342	S	S	*	.			trans	-101.9	87	145.1	-69.9	-173	-28.7	0	0	108.4	R770 L771 N775 Y776	R770-Q773 PolarHBondContact O-N 2.68Å; L771-Q773 CarbonylContact O-C 3.2Å; L771-Q773 VanDerWaalsContact O-C 3.3Å; L771-Q773 PolarHBondContact O-N 3.04Å; Q773-N775 PolarHBondContact O-N 2.76Å; Q773-Y776 WeakPolarHBondContact O-CB 3.13Å; Q773-Y776 PolarHBondContact O-N 3.07Å
774	P	49.8	Very low	46.6	Very low	15 Å²	15	66.7 Å²	66.7	10%	0.097	32%	0.319	C	S	.	.	H	α-helix	trans	-58.9	-35	169.3	25.9	-33.2	0	0	0	109.2	F635 N636 L771 N772 Y776 M777 I778	F635-P774 HydrophobicContact CE1-CB 3.99Å; N636-P774 VanDerWaalsContact OD1-CB 3.26Å; N636-P774 WeakPolarHBondContact OD1-CB 3.36Å; L771-P774 VanDerWaalsContact O-CD 3.27Å; L771-P774 WeakPolarHBondContact O-CD 3.47Å; N772-P774 VanDerWaalsContact C-CD 3.47Å; N772-P774 WeakPolarHBondContact O-CD 3.5Å; P774-Y776 PolarHBondContact O-N 2.86Å; P774-Y776 VanDerWaalsContact O-N 3.1Å; P774-M777 PolarHBondContact O-N 2.82Å; P774-I778 HydrophobicContact CB-CD1 4.21Å; P774-I778 VanDerWaalsContact O-CG1 3.3Å; P774-I778 WeakPolarHBondContact O-CG1 3.36Å; P774-I778 PolarHBondContact O-N 2.79Å
775	N	50.8	Low	47.6	Very low	96 Å²	96	61.9 Å²	61.9	51%	0.513	30%	0.302	S	S	.	.	H	α-helix	trans	-45.9	-34.6	167.5	-64.2	32.5	0	0	0	113.7	Q773 I778 E779	Q773-N775 PolarHBondContact O-N 2.76Å; N775-I778 PolarHBondContact O-N 2.88Å; N775-E779 WeakPolarHBondContact O-CB 3.23Å; N775-E779 WeakPolarHBondContact O-CG 3.36Å; N775-E779 PolarHBondContact O-N 2.95Å
776	Y	49.2	Very low	48.4	Very low	135 Å²	135	65.2 Å²	65.2	53%	0.529	32%	0.316	S	S	.	.	H	α-helix	trans	-76	-33.9	-179.6	-173	-101.4	0	0	0	112.9	Q773 P774 T780	Q773-Y776 WeakPolarHBondContact O-CB 3.13Å; Q773-Y776 PolarHBondContact O-N 3.07Å; P774-Y776 PolarHBondContact O-N 2.86Å; P774-Y776 VanDerWaalsContact O-N 3.1Å; Y776-T780 HydrophobicContact CE1-CG2 4.32Å; Y776-T780 WeakPolarHBondContact O-CB 3.23Å; Y776-T780 PolarHBondContact O-N 2.84Å; Y776-T780 PolarHBondContact O-OG1 2.91Å
777	M	52.6	Low	49.1	Very low	16 Å²	16	63.4 Å²	63.4	8%	0.079	32%	0.316	C	S	.	.	H	α-helix	trans	-70.7	-42.5	166.7	-82.7	-147.6	-38.8	0	0	111.4	L579 F635 L771 P774 E779 T780 L781 I817	L579-M777 HydrophobicContact CD2-CE 3.57Å; F635-M777 HydrophobicContact CZ-CE 4.48Å; L771-M777 HydrophobicContact CD2-CE 3.66Å; L771-M777 HydrophobicContact CD2-CG 3.57Å; L771-M777 HydrophobicContact CD2-SD 3.5Å; L771-M777 VanDerWaalsContact CD2-SD 3.5Å; P774-M777 PolarHBondContact O-N 2.82Å; M777-E779 VanDerWaalsContact C-N 3.33Å; M777-E779 PolarHBondContact O-N 3.46Å; M777-T780 WeakPolarHBondContact CA-OG1 3.46Å; M777-T780 PolarHBondContact O-N 3.29Å; M777-T780 PolarHBondContact O-OG1 2.83Å; M777-L781 WeakPolarHBondContact O-CB 3.37Å; M777-L781 WeakPolarHBondContact O-CD1 3.35Å; M777-L781 WeakPolarHBondContact O-CG 3.41Å; M777-L781 PolarHBondContact O-N 3.17Å; M777-I817 HydrophobicContact SD-CD1 4.37Å; M777-I817 HydrophobicContact SD-CG1 4.13Å; M777-I817 HydrophobicContact SD-CG2 4.02Å
778	I	55.3	Low	49.6	Very low	24 Å²	24	64.6 Å²	64.6	12%	0.123	32%	0.32	C	S	.	.	H	α-helix	trans	-61.1	-43.1	178.8	-66.4	161.3	0	0	0	110.2	I632 P774 N775 L781 L782	I632-I778 HydrophobicContact CD1-CG2 4.13Å; I632-I778 HydrophobicContact CG1-CG1 4.34Å; I632-I778 HydrophobicContact CG2-CD1 3.54Å; I632-I778 HydrophobicContact CG2-CG1 3.86Å; I632-I778 HydrophobicContact CG2-CG2 4.42Å; P774-I778 HydrophobicContact CB-CD1 4.21Å; P774-I778 VanDerWaalsContact O-CG1 3.3Å; P774-I778 WeakPolarHBondContact O-CG1 3.36Å; P774-I778 PolarHBondContact O-N 2.79Å; N775-I778 PolarHBondContact O-N 2.88Å; I778-L781 PolarHBondContact O-N 3.09Å; I778-L782 HydrophobicContact CG2-CD1 3.65Å; I778-L782 HydrophobicContact CG2-CG 4.23Å; I778-L782 WeakPolarHBondContact O-CB 3.11Å; I778-L782 WeakPolarHBondContact O-CG 3.25Å; I778-L782 PolarHBondContact O-N 2.89Å
779	E	54.5	Low	50.1	Low	114 Å²	114	66.1 Å²	66.1	53%	0.533	32%	0.324	S	S	.	.	H	α-helix	trans	-69.7	-35	175.3	-77	170.4	-154.5	0	0	112.8	N775 M777 S783	N775-E779 WeakPolarHBondContact O-CB 3.23Å; N775-E779 WeakPolarHBondContact O-CG 3.36Å; N775-E779 PolarHBondContact O-N 2.95Å; M777-E779 VanDerWaalsContact C-N 3.33Å; M777-E779 PolarHBondContact O-N 3.46Å; E779-S783 WeakPolarHBondContact O-CB 3.24Å; E779-S783 PolarHBondContact O-N 2.9Å; E779-S783 PolarHBondContact O-OG 2.8Å
780	T	53.2	Low	50.4	Low	29 Å²	29	68.9 Å²	68.9	18%	0.178	33%	0.332	C	S	.	.	H	α-helix	trans	-70.9	-37.5	173.4	42.6	0	0	0	0	112.2	Y776 M777 S783 I784	Y776-T780 HydrophobicContact CE1-CG2 4.32Å; Y776-T780 WeakPolarHBondContact O-CB 3.23Å; Y776-T780 PolarHBondContact O-N 2.84Å; Y776-T780 PolarHBondContact O-OG1 2.91Å; M777-T780 WeakPolarHBondContact CA-OG1 3.46Å; M777-T780 PolarHBondContact O-N 3.29Å; M777-T780 PolarHBondContact O-OG1 2.83Å; T780-S783 WeakPolarHBondContact CA-OG 3.34Å; T780-S783 PolarHBondContact O-OG 3.44Å; T780-I784 WeakPolarHBondContact O-CD1 3.35Å; T780-I784 WeakPolarHBondContact O-CG1 3.23Å; T780-I784 PolarHBondContact O-N 2.92Å
781	L	57.7	Low	50.6	Low	3 Å²	3	63.3 Å²	63.3	2%	0.016	32%	0.321	C	S	.	.	H	α-helix	trans	-67.9	-45.9	172.4	-66.4	163.2	0	0	0	111.5	L582 T586 M777 I778 S783 I784 I785 I817	L582-L781 HydrophobicContact CD2-CD1 4.2Å; T586-L781 HydrophobicContact CG2-CD2 3.81Å; M777-L781 WeakPolarHBondContact O-CB 3.37Å; M777-L781 WeakPolarHBondContact O-CD1 3.35Å; M777-L781 WeakPolarHBondContact O-CG 3.41Å; M777-L781 PolarHBondContact O-N 3.17Å; I778-L781 PolarHBondContact O-N 3.09Å; L781-S783 VanDerWaalsContact C-N 3.35Å; L781-S783 PolarHBondContact O-N 3.23Å; L781-I784 WeakPolarHBondContact O-CB 3.38Å; L781-I784 PolarHBondContact O-N 3.17Å; L781-I785 WeakPolarHBondContact O-CG1 3.38Å; L781-I785 PolarHBondContact O-N 2.85Å; L781-I817 HydrophobicContact CD2-CD1 3.77Å; L781-I817 HydrophobicContact CG-CD1 4.01Å
782	L	58.5	Low	50.9	Low	63 Å²	63	69 Å²	69	33%	0.33	35%	0.352	S	S	.	.	H	α-helix	trans	-65.4	-35.1	176.2	-73.5	172.6	0	0	0	112.1	I778 I785 H786	I778-L782 HydrophobicContact CG2-CD1 3.65Å; I778-L782 HydrophobicContact CG2-CG 4.23Å; I778-L782 WeakPolarHBondContact O-CB 3.11Å; I778-L782 WeakPolarHBondContact O-CG 3.25Å; I778-L782 PolarHBondContact O-N 2.89Å; L782-I785 PolarHBondContact O-N 2.89Å; L782-H786 WeakPolarHBondContact O-CB 3.35Å; L782-H786 PolarHBondContact O-N 3.39Å; L782-H786 PolarHBondContact O-ND1 3.14Å
783	S	56.8	Low	51.1	Low	57 Å²	57	71.1 Å²	71.1	40%	0.399	36%	0.361	S	S	.	.	H	α-helix	trans	-77.2	-25.9	176.4	56.8	0	0	0	0	113.5	E779 T780 L781 I785 S787	E779-S783 WeakPolarHBondContact O-CB 3.24Å; E779-S783 PolarHBondContact O-N 2.9Å; E779-S783 PolarHBondContact O-OG 2.8Å; T780-S783 WeakPolarHBondContact CA-OG 3.34Å; T780-S783 PolarHBondContact O-OG 3.44Å; L781-S783 VanDerWaalsContact C-N 3.35Å; L781-S783 PolarHBondContact O-N 3.23Å; S783-I785 VanDerWaalsContact C-N 3.28Å; S783-S787 WeakPolarHBondContact O-CB 3.37Å; S783-S787 PolarHBondContact O-N 2.81Å; S783-S787 PolarHBondContact O-OG 2.91Å
784	I	56.3	Low	50.5	Low	18 Å²	18	71.8 Å²	71.8	9%	0.092	37%	0.369	C	S	.	.	H	α-helix	trans	-60.5	-40	164.1	-71.1	160.1	0	0	0	110.5	T780 L781 S787 H810	T780-I784 WeakPolarHBondContact O-CD1 3.35Å; T780-I784 WeakPolarHBondContact O-CG1 3.23Å; T780-I784 PolarHBondContact O-N 2.92Å; L781-I784 WeakPolarHBondContact O-CB 3.38Å; L781-I784 PolarHBondContact O-N 3.17Å; I784-S787 PolarHBondContact O-OG 2.78Å; I784-S787 VanDerWaalsContact O-OG 3.12Å; I784-H810 HydrophobicContact CG1-CB 3.96Å; I784-H810 VanDerWaalsContact CG1-ND1 3.33Å; I784-H810 WeakPolarHBondContact CG1-ND1 3.38Å; I784-H810 HydrophobicContact CG2-CB 4.45Å
785	I	55.6	Low	49.7	Very low	19 Å²	19	79.2 Å²	79.2	10%	0.097	40%	0.402	C	S	.	.	H	α-helix	trans	-74.5	-49.9	179.3	-64.6	161.2	0	0	0	111.2	Y589 F624 L628 L781 L782 S783 S787 H788 N789	Y589-I785 HydrophobicContact CE1-CG1 4.38Å; F624-I785 HydrophobicContact CE1-CD1 3.98Å; F624-I785 HydrophobicContact CE1-CG1 4.47Å; F624-I785 HydrophobicContact CZ-CD1 4.43Å; L628-I785 HydrophobicContact CD2-CD1 3.34Å; L781-I785 WeakPolarHBondContact O-CG1 3.38Å; L781-I785 PolarHBondContact O-N 2.85Å; L782-I785 PolarHBondContact O-N 2.89Å; S783-I785 VanDerWaalsContact C-N 3.28Å; I785-S787 PolarHBondContact O-N 2.85Å; I785-H788 PolarHBondContact O-N 3.4Å; I785-N789 PolarHBondContact O-N 2.87Å; I785-N789 PolarHBondContact O-OD1 3.11Å
786	H	55.8	Low	48.9	Very low	123 Å²	123	83 Å²	83	57%	0.569	42%	0.417	S	S	*	.	H	α-helix	trans	-69.2	-28.3	-176.9	-74.5	79.5	0	0	0	113.6	L782 K790	L782-H786 WeakPolarHBondContact O-CB 3.35Å; L782-H786 PolarHBondContact O-N 3.39Å; L782-H786 PolarHBondContact O-ND1 3.14Å; H786-K790 WeakPolarHBondContact O-CB 3.27Å; H786-K790 PolarHBondContact O-N 3.13Å
787	S	52.8	Low	48	Very low	40 Å²	40	82.4 Å²	82.4	28%	0.28	43%	0.428	S	S	.	.	H	α-helix	trans	-68.2	-40.8	175	64.1	0	0	0	0	111.8	S783 I784 I785 K790 S791 H810	S783-S787 WeakPolarHBondContact O-CB 3.37Å; S783-S787 PolarHBondContact O-N 2.81Å; S783-S787 PolarHBondContact O-OG 2.91Å; I784-S787 PolarHBondContact O-OG 2.78Å; I784-S787 VanDerWaalsContact O-OG 3.12Å; I785-S787 PolarHBondContact O-N 2.85Å; S787-K790 PolarHBondContact O-N 3.03Å; S787-S791 PolarHBondContact O-N 3.32Å; S787-H810 VanDerWaalsContact CB-NE2 3.35Å; S787-H810 WeakPolarHBondContact CB-NE2 3.29Å; S787-H810 PolarHBondContact OG-CD2 2.65Å; S787-H810 PolarHBondContact OG-CE1 2.9Å; S787-H810 PolarHBondContact OG-NE2 3.29Å
788	H	49.4	Very low	47	Very low	54 Å²	54	87.6 Å²	87.6	25%	0.25	46%	0.46	C	S	.	.	H	α-helix	trans	-64.2	-47.2	176.5	-102.1	-68.1	0	0	0	111.7	I785 K790 S791	I785-H788 PolarHBondContact O-N 3.4Å; H788-K790 PolarHBondContact O-N 3.12Å; H788-S791 WeakPolarHBondContact O-CB 3.47Å; H788-S791 PolarHBondContact O-N 3.37Å; H788-S791 PolarHBondContact O-OG 3.33Å
789	N	45.8	Very low	46	Very low	63 Å²	63	91.6 Å²	91.6	34%	0.337	49%	0.486	S	S	.	.	H	α-helix	trans	-63.7	-28.3	178.9	-70.4	26.8	0	0	0	112.6	E621 I785 S791	E621-N789 PolarHBondContact OE1-ND2 2.95Å; I785-N789 PolarHBondContact O-N 2.87Å; I785-N789 PolarHBondContact O-OD1 3.11Å; N789-S791 VanDerWaalsContact C-N 3.31Å; N789-S791 PolarHBondContact O-N 3.13Å
790	K	41.7	Very low	45.1	Very low	166 Å²	166	93 Å²	93	72%	0.722	50%	0.497	S	S	*	.	H	α-helix	trans	-74.8	-17.4	174.4	-150.1	170.6	-170.1	177	0	113.7	H786 S787 H788	H786-K790 WeakPolarHBondContact O-CB 3.27Å; H786-K790 PolarHBondContact O-N 3.13Å; S787-K790 PolarHBondContact O-N 3.03Å; H788-K790 PolarHBondContact O-N 3.12Å
791	S	43.9	Very low	44.6	Very low	67 Å²	67	96.4 Å²	96.4	47%	0.469	52%	0.518	S	S	.	.	H	α-helix	trans	-76.9	-19.5	179.3	72.1	0	0	0	0	114.4	S787 H788 N789	S787-S791 PolarHBondContact O-N 3.32Å; H788-S791 WeakPolarHBondContact O-CB 3.47Å; H788-S791 PolarHBondContact O-N 3.37Å; H788-S791 PolarHBondContact O-OG 3.33Å; N789-S791 VanDerWaalsContact C-N 3.31Å; N789-S791 PolarHBondContact O-N 3.13Å
792	N	42.8	Very low	43.8	Very low	134 Å²	134	100.1 Å²	100.1	72%	0.717	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-8.4	179.1	-77.3	-8.5	0	0	0	114.6
793	I	43.8	Very low	43.1	Very low	132 Å²	132	100.5 Å²	100.5	68%	0.677	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-26.8	-172.4	-65	175.8	0	0	0	112.7
794	N	35.3	Very low	42.5	Very low	139 Å²	139	103 Å²	103	74%	0.743	55%	0.554	S	S	*	*			trans	-110.7	65.5	-175.5	-75.7	16.3	0	0	0	112.8	H796	N794-H796 PolarHBondContact O-N 3.05Å
795	Q	32.8	Very low	42.1	Very low	171 Å²	171	107.4 Å²	107.4	80%	0.799	58%	0.577	S	S	*	*			trans	-87.4	81	161.3	-72.4	-164.1	10.6	0	0	111
796	H	32.6	Very low	41.6	Very low	176 Å²	176	110.6 Å²	110.6	82%	0.815	59%	0.594	S	S	*	*	S	Bend	trans	-167.9	153.4	145.3	-99.3	-67.2	0	0	0	110.1	N794	N794-H796 PolarHBondContact O-N 3.05Å
797	T	31.4	Very low	41.3	Very low	123 Å²	123	110.9 Å²	110.9	76%	0.755	59%	0.591	S	S	*	*	S	Bend	trans	58.6	92.4	174.3	52.2	0	0	0	0	118.5
798	T	31.8	Very low	41.3	Very low	125 Å²	125	115.6 Å²	115.6	77%	0.767	61%	0.606	S	S	*	*			trans	52.5	94.8	133.7	56.1	0	0	0	0	120.4
799	T	34.3	Very low	41.3	Very low	107 Å²	107	118.2 Å²	118.2	66%	0.656	62%	0.621	S	S	*	*				177.4	126.6	108.8	29.2	0	0	0	0	111.3	T801	T799-T801 PolarHBondContact O-N 3.12Å
800	N	35.7	Very low	41.7	Very low	144 Å²	144	116.3 Å²	116.3	77%	0.77	61%	0.61	S	S	*	*	S	Bend	trans	-89.6	19.3	-164.2	-76.7	-5.2	0	0	0	116.4
801	T	42.8	Very low	42.4	Very low	101 Å²	101	113.6 Å²	113.6	62%	0.62	60%	0.599	S	S	*	*	S	Bend	trans	-97.4	-38.2	-176.3	46.2	0	0	0	0	114	T799 T803	T799-T801 PolarHBondContact O-N 3.12Å; T801-T803 PolarHBondContact O-N 3.44Å
802	T	40.8	Very low	43.1	Very low	81 Å²	81	112.3 Å²	112.3	50%	0.497	59%	0.588	S	S	.	*	H	α-helix	trans	-76.2	-17.3	-171.1	56.2	0	0	0	0	115	I804 N806	T802-I804 VanDerWaalsContact C-N 3.34Å; T802-N806 PolarHBondContact O-ND2 2.86Å
803	T	42.9	Very low	43.6	Very low	71 Å²	71	107.1 Å²	107.1	44%	0.436	56%	0.562	S	S	.	*	H	α-helix	trans	-84.8	-7.6	-179.5	60.2	0	0	0	0	113.9	T801 R807	T801-T803 PolarHBondContact O-N 3.44Å; T803-R807 PolarHBondContact O-NE 3.22Å
804	I	44.9	Very low	44.4	Very low	109 Å²	109	101.5 Å²	101.5	56%	0.559	53%	0.533	S	S	*	.	H	α-helix	trans	-89.6	-49.7	174.8	-61.8	175.8	0	0	0	109.7	T802 N806 R807 F808	T802-I804 VanDerWaalsContact C-N 3.34Å; I804-N806 PolarHBondContact O-N 3.44Å; I804-R807 PolarHBondContact O-N 3.45Å; I804-F808 PolarHBondContact O-N 3Å
805	D	47.1	Very low	45.6	Very low	110 Å²	110	99.3 Å²	99.3	59%	0.588	52%	0.521	S	S	*	.	H	α-helix	trans	-57.9	-43.4	-179.6	-80.9	-29.2	0	0	0	112.9	F808 L809	D805-F808 PolarHBondContact O-N 3.23Å; D805-L809 WeakPolarHBondContact O-CB 3.46Å; D805-L809 PolarHBondContact O-N 2.81Å
806	N	45.2	Very low	46.5	Very low	86 Å²	86	99.3 Å²	99.3	46%	0.46	51%	0.514	S	S	.	.	H	α-helix	trans	-61.6	-47.2	177.5	-75.7	-54.2	0	0	0	111.7	T802 I804 F808 L809 H810	T802-N806 PolarHBondContact O-ND2 2.86Å; I804-N806 PolarHBondContact O-N 3.44Å; N806-F808 VanDerWaalsContact C-N 3.29Å; N806-F808 PolarHBondContact O-N 3.46Å; N806-L809 PolarHBondContact O-N 3.24Å; N806-L809 VanDerWaalsContact O-N 3.14Å; N806-H810 PolarHBondContact O-CD2 3.42Å; N806-H810 VanDerWaalsContact O-CG 3.3Å; N806-H810 PolarHBondContact O-N 3.36Å
807	R	50.8	Low	47.8	Very low	130 Å²	130	91.7 Å²	91.7	49%	0.491	48%	0.479	S	S	.	.	H	α-helix	trans	-61.3	-36.8	175.7	-86.7	-174	-77.5	-169.5	-6.2	112.2	T803 I804 K811	T803-R807 PolarHBondContact O-NE 3.22Å; I804-R807 PolarHBondContact O-N 3.45Å; R807-K811 WeakPolarHBondContact O-CB 3.35Å; R807-K811 PolarHBondContact O-N 3.15Å
808	F	51.4	Low	49.1	Very low	139 Å²	139	89.3 Å²	89.3	61%	0.61	46%	0.458	S	S	*	.	H	α-helix	trans	-64.7	-44.7	172.9	-171	-101.5	0	0	0	111.9	I804 D805 N806 H810 K811 V812	I804-F808 PolarHBondContact O-N 3Å; D805-F808 PolarHBondContact O-N 3.23Å; N806-F808 VanDerWaalsContact C-N 3.29Å; N806-F808 PolarHBondContact O-N 3.46Å; F808-H810 PolarHBondContact O-N 3.2Å; F808-K811 PolarHBondContact O-N 3.32Å; F808-V812 HydrophobicContact CD1-CG2 4.08Å; F808-V812 HydrophobicContact CE1-CG2 3.79Å; F808-V812 HydrophobicContact CE2-CG2 4.44Å; F808-V812 HydrophobicContact CZ-CG2 3.99Å; F808-V812 WeakPolarHBondContact O-CB 3.33Å; F808-V812 VanDerWaalsContact O-CG2 3.26Å; F808-V812 WeakPolarHBondContact O-CG2 3.48Å; F808-V812 PolarHBondContact O-N 3.43Å
809	L	48.7	Very low	50.2	Low	108 Å²	108	92.9 Å²	92.9	57%	0.565	46%	0.458	S	S	*	.	H	α-helix	trans	-62.9	-41.7	177.8	-123.5	71.5	0	0	0	112.9	D805 N806 S813	D805-L809 WeakPolarHBondContact O-CB 3.46Å; D805-L809 PolarHBondContact O-N 2.81Å; N806-L809 PolarHBondContact O-N 3.24Å; N806-L809 VanDerWaalsContact O-N 3.14Å; L809-S813 WeakPolarHBondContact O-CB 3.05Å; L809-S813 PolarHBondContact O-N 3.4Å; L809-S813 PolarHBondContact O-OG 2.83Å
810	H	54.7	Low	51.1	Low	23 Å²	23	90.1 Å²	90.1	11%	0.106	44%	0.439	C	S	.	.	H	α-helix	trans	-64.8	-47.7	175.9	-65.2	-46.5	0	0	0	111.1	I784 S787 N806 F808 V812 S813 L814	I784-H810 HydrophobicContact CG1-CB 3.96Å; I784-H810 VanDerWaalsContact CG1-ND1 3.33Å; I784-H810 WeakPolarHBondContact CG1-ND1 3.38Å; I784-H810 HydrophobicContact CG2-CB 4.45Å; S787-H810 VanDerWaalsContact CB-NE2 3.35Å; S787-H810 WeakPolarHBondContact CB-NE2 3.29Å; S787-H810 PolarHBondContact OG-CD2 2.65Å; S787-H810 PolarHBondContact OG-CE1 2.9Å; S787-H810 PolarHBondContact OG-NE2 3.29Å; N806-H810 PolarHBondContact O-CD2 3.42Å; N806-H810 VanDerWaalsContact O-CG 3.3Å; N806-H810 PolarHBondContact O-N 3.36Å; F808-H810 PolarHBondContact O-N 3.2Å; H810-V812 PolarHBondContact O-N 3.26Å; H810-S813 CarbonylContact O-C 3.59Å; H810-S813 WeakPolarHBondContact O-CA 3.41Å; H810-S813 WeakPolarHBondContact O-CB 3.1Å; H810-S813 PolarHBondContact O-N 3.21Å; H810-L814 PolarHBondContact O-N 2.77Å
811	K	57.8	Low	52.1	Low	110 Å²	110	84 Å²	84	48%	0.478	41%	0.407	S	S	.	.	H	α-helix	trans	-63.6	-39.2	177.9	-159.4	158	-166.4	151.6	0	112.6	R807 F808 S813 L815	R807-K811 WeakPolarHBondContact O-CB 3.35Å; R807-K811 PolarHBondContact O-N 3.15Å; F808-K811 PolarHBondContact O-N 3.32Å; K811-S813 VanDerWaalsContact C-N 3.29Å; K811-S813 PolarHBondContact O-N 2.71Å; K811-L815 HydrophobicContact CG-CD1 4.49Å; K811-L815 VanDerWaalsContact O-CB 3.29Å; K811-L815 WeakPolarHBondContact O-CB 3.19Å; K811-L815 WeakPolarHBondContact O-CD1 3.26Å; K811-L815 WeakPolarHBondContact O-CG 3.28Å; K811-L815 PolarHBondContact O-N 2.87Å
812	V	56.8	Low	52.9	Low	39 Å²	39	83.3 Å²	83.3	24%	0.236	40%	0.398	C	S	.	.	H	α-helix	trans	-63.4	-34.4	171.4	166.5	0	0	0	0	111.8	F808 H810 R816	F808-V812 HydrophobicContact CD1-CG2 4.08Å; F808-V812 HydrophobicContact CE1-CG2 3.79Å; F808-V812 HydrophobicContact CE2-CG2 4.44Å; F808-V812 HydrophobicContact CZ-CG2 3.99Å; F808-V812 WeakPolarHBondContact O-CB 3.33Å; F808-V812 VanDerWaalsContact O-CG2 3.26Å; F808-V812 WeakPolarHBondContact O-CG2 3.48Å; F808-V812 PolarHBondContact O-N 3.43Å; H810-V812 PolarHBondContact O-N 3.26Å; V812-R816 WeakPolarHBondContact O-CD 3.41Å; V812-R816 VanDerWaalsContact O-CG 3.23Å; V812-R816 WeakPolarHBondContact O-CG 3.45Å; V812-R816 PolarHBondContact O-N 3.41Å
813	S	54.2	Low	53.2	Low	25 Å²	25	80.2 Å²	80.2	18%	0.175	38%	0.383	C	S	.	.	H	α-helix	trans	-73.8	-45.2	178.1	-59.4	0	0	0	0	111.9	L809 H810 K811 L815 R816 I817	L809-S813 WeakPolarHBondContact O-CB 3.05Å; L809-S813 PolarHBondContact O-N 3.4Å; L809-S813 PolarHBondContact O-OG 2.83Å; H810-S813 CarbonylContact O-C 3.59Å; H810-S813 WeakPolarHBondContact O-CA 3.41Å; H810-S813 WeakPolarHBondContact O-CB 3.1Å; H810-S813 PolarHBondContact O-N 3.21Å; K811-S813 VanDerWaalsContact C-N 3.29Å; K811-S813 PolarHBondContact O-N 2.71Å; S813-L815 VanDerWaalsContact C-N 3.35Å; S813-L815 PolarHBondContact O-N 2.81Å; S813-R816 WeakPolarHBondContact O-CB 3.45Å; S813-R816 PolarHBondContact O-N 3.22Å; S813-R816 VanDerWaalsContact O-N 3.08Å; S813-I817 WeakPolarHBondContact O-CG1 3.44Å; S813-I817 PolarHBondContact O-N 3.2Å
814	L	61.4	Low	53.7	Low	14 Å²	14	78.8 Å²	78.8	7%	0.073	37%	0.37	C	S	.	.	H	α-helix	trans	-59.8	-44.6	173.3	-168.3	68.4	0	0	0	111.1	E587 E590 H810 R816 I817 K818	E587-L814 HydrophobicContact CG-CD2 4.39Å; E590-L814 HydrophobicContact CG-CD2 4.28Å; H810-L814 PolarHBondContact O-N 2.77Å; L814-R816 VanDerWaalsContact C-N 3.28Å; L814-R816 PolarHBondContact O-N 3.23Å; L814-I817 PolarHBondContact O-N 3.19Å; L814-I817 VanDerWaalsContact O-N 3.16Å; L814-K818 WeakPolarHBondContact O-CB 3.49Å; L814-K818 PolarHBondContact O-N 2.89Å
815	L	59.4	Low	54.3	Low	94 Å²	94	75.6 Å²	75.6	49%	0.492	35%	0.353	S	S	.	.	H	α-helix	trans	-61.1	-32.1	173.7	-75.4	168.9	0	0	0	113.4	K811 S813 R819	K811-L815 HydrophobicContact CG-CD1 4.49Å; K811-L815 VanDerWaalsContact O-CB 3.29Å; K811-L815 WeakPolarHBondContact O-CB 3.19Å; K811-L815 WeakPolarHBondContact O-CD1 3.26Å; K811-L815 WeakPolarHBondContact O-CG 3.28Å; K811-L815 PolarHBondContact O-N 2.87Å; S813-L815 VanDerWaalsContact C-N 3.35Å; S813-L815 PolarHBondContact O-N 2.81Å; L815-R819 WeakPolarHBondContact O-CB 3.3Å; L815-R819 VanDerWaalsContact O-CG 3.23Å; L815-R819 WeakPolarHBondContact O-CG 3.41Å; L815-R819 PolarHBondContact O-N 2.85Å; L815-R819 VanDerWaalsContact O-N 3.1Å
816	R	51.8	Low	54.4	Low	171 Å²	171	74.3 Å²	74.3	65%	0.645	35%	0.346	S	S	*	.	H	α-helix	trans	-69.2	-44.5	173	-76.8	165.3	-179.8	-177.5	2.3	111.3	V812 S813 L814 R819 L820	V812-R816 WeakPolarHBondContact O-CD 3.41Å; V812-R816 VanDerWaalsContact O-CG 3.23Å; V812-R816 WeakPolarHBondContact O-CG 3.45Å; V812-R816 PolarHBondContact O-N 3.41Å; S813-R816 WeakPolarHBondContact O-CB 3.45Å; S813-R816 PolarHBondContact O-N 3.22Å; S813-R816 VanDerWaalsContact O-N 3.08Å; L814-R816 VanDerWaalsContact C-N 3.28Å; L814-R816 PolarHBondContact O-N 3.23Å; R816-R819 PolarHBondContact O-N 2.97Å; R816-L820 WeakPolarHBondContact O-CB 3.28Å; R816-L820 PolarHBondContact O-N 2.9Å; R816-L820 VanDerWaalsContact O-N 3.11Å
817	I	59.1	Low	54.3	Low	15 Å²	15	70.8 Å²	70.8	8%	0.077	33%	0.328	C	S	.	.	H	α-helix	trans	-65.9	-45.6	178.5	-61.3	172.9	0	0	0	110.5	V583 M777 L781 S813 L814 R819 L820 S821	V583-I817 HydrophobicContact CG2-CG2 3.77Å; M777-I817 HydrophobicContact SD-CD1 4.37Å; M777-I817 HydrophobicContact SD-CG1 4.13Å; M777-I817 HydrophobicContact SD-CG2 4.02Å; L781-I817 HydrophobicContact CD2-CD1 3.77Å; L781-I817 HydrophobicContact CG-CD1 4.01Å; S813-I817 WeakPolarHBondContact O-CG1 3.44Å; S813-I817 PolarHBondContact O-N 3.2Å; L814-I817 PolarHBondContact O-N 3.19Å; L814-I817 VanDerWaalsContact O-N 3.16Å; I817-R819 PolarHBondContact O-N 2.92Å; I817-L820 CarbonylContact O-C 3.3Å; I817-L820 WeakPolarHBondContact O-CA 3.39Å; I817-L820 WeakPolarHBondContact O-CB 3.45Å; I817-L820 PolarHBondContact O-N 3.45Å; I817-S821 PolarHBondContact O-N 2.94Å
818	K	59.7	Low	54.3	Low	74 Å²	74	64.8 Å²	64.8	32%	0.322	31%	0.306	S	S	.	.	H	α-helix	trans	-60.7	-39.8	176	-168.6	175.2	-164	152.1	0	112.8	V583 E587 L814 L820 S821 I822	V583-K818 HydrophobicContact CG1-CB 4.43Å; V583-K818 HydrophobicContact CG1-CG 4.29Å; E587-K818 WeakPolarHBondContact OE1-CD 3.35Å; E587-K818 WeakPolarHBondContact OE1-CE 3.35Å; E587-K818 IonicContact OE1-NZ 3.71Å; E587-K818 PolarHBondContact OE1-NZ 3.14Å; E587-K818 IonicContact OE2-NZ 3.01Å; E587-K818 PolarHBondContact OE2-NZ 3.15Å; L814-K818 WeakPolarHBondContact O-CB 3.49Å; L814-K818 PolarHBondContact O-N 2.89Å; K818-L820 PolarHBondContact O-N 2.61Å; K818-S821 PolarHBondContact O-OG 3.2Å; K818-S821 VanDerWaalsContact O-OG 3.11Å; K818-I822 HydrophobicContact CG-CD1 3.88Å; K818-I822 WeakPolarHBondContact O-CB 3.21Å; K818-I822 WeakPolarHBondContact O-CD1 2.99Å; K818-I822 VanDerWaalsContact O-CG1 3.24Å; K818-I822 WeakPolarHBondContact O-CG1 3.06Å; K818-I822 PolarHBondContact O-N 2.86Å
819	R	54.4	Low	54.2	Low	199 Å²	199	61.7 Å²	61.7	75%	0.751	30%	0.296	S	S	*	.	H	α-helix	trans	-64.6	-26.1	171	-77.9	174.8	174.8	-170.8	-0.6	112.9	L815 R816 I817 G823	L815-R819 WeakPolarHBondContact O-CB 3.3Å; L815-R819 VanDerWaalsContact O-CG 3.23Å; L815-R819 WeakPolarHBondContact O-CG 3.41Å; L815-R819 PolarHBondContact O-N 2.85Å; L815-R819 VanDerWaalsContact O-N 3.1Å; R816-R819 PolarHBondContact O-N 2.97Å; I817-R819 PolarHBondContact O-N 2.92Å; R819-G823 PolarHBondContact O-N 2.87Å
820	L	52.5	Low	54	Low	50 Å²	50	58.9 Å²	58.9	26%	0.262	28%	0.281	S	S	.	.	H	α-helix	trans	-79.1	-44.2	179.3	-136.3	157.5	0	0	0	111.3	N767 L771 R816 I817 K818 G823 W824	N767-L820 HydrophobicContact CB-CD1 4.42Å; L771-L820 HydrophobicContact CD1-CD2 4.05Å; R816-L820 WeakPolarHBondContact O-CB 3.28Å; R816-L820 PolarHBondContact O-N 2.9Å; R816-L820 VanDerWaalsContact O-N 3.11Å; I817-L820 CarbonylContact O-C 3.3Å; I817-L820 WeakPolarHBondContact O-CA 3.39Å; I817-L820 WeakPolarHBondContact O-CB 3.45Å; I817-L820 PolarHBondContact O-N 3.45Å; K818-L820 PolarHBondContact O-N 2.61Å; L820-G823 PolarHBondContact O-N 3.02Å; L820-W824 WeakPolarHBondContact O-CB 3.31Å; L820-W824 PolarHBondContact O-N 2.98Å
821	S	58.6	Low	53.5	Low	14 Å²	14	59.6 Å²	59.6	10%	0.098	29%	0.285	C	S	.	.	H	α-helix	trans	-65.5	-46.8	173.4	61.9	0	0	0	0	111.9	I817 K818 G823 W824 M825	I817-S821 PolarHBondContact O-N 2.94Å; K818-S821 PolarHBondContact O-OG 3.2Å; K818-S821 VanDerWaalsContact O-OG 3.11Å; S821-G823 VanDerWaalsContact C-N 3.26Å; S821-G823 PolarHBondContact O-N 3.09Å; S821-W824 WeakPolarHBondContact O-CB 3.39Å; S821-W824 PolarHBondContact O-N 2.96Å; S821-M825 WeakPolarHBondContact O-CG 3.43Å; S821-M825 PolarHBondContact O-N 3.47Å
822	I	57.7	Low	53	Low	87 Å²	87	57.8 Å²	57.8	45%	0.446	28%	0.278	S	S	.	.	H	α-helix	trans	-59.7	-38.7	173	-66.9	169.5	0	0	0	110.8	K818 W824 N826	K818-I822 HydrophobicContact CG-CD1 3.88Å; K818-I822 WeakPolarHBondContact O-CB 3.21Å; K818-I822 WeakPolarHBondContact O-CD1 2.99Å; K818-I822 VanDerWaalsContact O-CG1 3.24Å; K818-I822 WeakPolarHBondContact O-CG1 3.06Å; K818-I822 PolarHBondContact O-N 2.86Å; I822-W824 VanDerWaalsContact C-N 3.33Å; I822-W824 PolarHBondContact O-N 2.89Å; I822-N826 WeakPolarHBondContact CG2-ND2 3.36Å; I822-N826 VanDerWaalsContact O-CB 3.3Å; I822-N826 WeakPolarHBondContact O-CB 3.22Å; I822-N826 VanDerWaalsContact O-CG 3.28Å; I822-N826 PolarHBondContact O-N 2.98Å; I822-N826 PolarHBondContact O-ND2 2.92Å
823	G	47.2	Very low	52.6	Low	17 Å²	17	60.9 Å²	60.9	18%	0.175	29%	0.29	C	S	.	.	H	α-helix	trans	-63.9	-35.7	174.6	0	0	0	0	0	113.6	R819 L820 S821 C827	R819-G823 PolarHBondContact O-N 2.87Å; L820-G823 PolarHBondContact O-N 3.02Å; S821-G823 VanDerWaalsContact C-N 3.26Å; S821-G823 PolarHBondContact O-N 3.09Å; G823-C827 PolarHBondContact O-N 2.79Å; G823-C827 PolarHBondContact O-SG 2.85Å; G823-C827 VanDerWaalsContact O-SG 3.41Å
824	W	54.7	Low	52	Low	40 Å²	40	60.9 Å²	60.9	15%	0.152	29%	0.294	C	S	.	.	H	α-helix	trans	-72.6	-50.7	176.7	-171.8	-83.1	0	0	0	111.9	M572 I575 G576 L579 L820 S821 I822 N826 C827 L828	M572-W824 HydrophobicContact CB-CZ2 4.15Å; M572-W824 HydrophobicContact CE-CH2 4.16Å; M572-W824 HydrophobicContact CE-CZ2 3.85Å; M572-W824 HydrophobicContact CG-CZ2 4Å; M572-W824 PolarHBondContact O-NE1 2.79Å; I575-W824 HydrophobicContact CB-CZ2 4.08Å; I575-W824 HydrophobicContact CG2-CH2 4.16Å; I575-W824 HydrophobicContact CG2-CZ2 3.65Å; G576-W824 VanDerWaalsContact CA-CD1 3.49Å; L579-W824 HydrophobicContact CD1-CD2 4.42Å; L579-W824 HydrophobicContact CD1-CG 4.42Å; L820-W824 WeakPolarHBondContact O-CB 3.31Å; L820-W824 PolarHBondContact O-N 2.98Å; S821-W824 WeakPolarHBondContact O-CB 3.39Å; S821-W824 PolarHBondContact O-N 2.96Å; I822-W824 VanDerWaalsContact C-N 3.33Å; I822-W824 PolarHBondContact O-N 2.89Å; W824-N826 VanDerWaalsContact C-N 3.3Å; W824-N826 PolarHBondContact O-N 3.03Å; W824-C827 WeakPolarHBondContact O-CA 3.27Å; W824-C827 WeakPolarHBondContact O-CB 3.25Å; W824-C827 PolarHBondContact O-N 2.78Å; W824-L828 WeakPolarHBondContact O-CB 3.38Å; W824-L828 PolarHBondContact O-N 2.68Å
825	M	56	Low	51.3	Low	43 Å²	43	61.7 Å²	61.7	21%	0.212	30%	0.298	C	S	.	.	H	α-helix	trans	-63.8	-34.5	179.7	-64.8	-58.1	-80.2	0	0	112.1	S821 L828 N829	S821-M825 WeakPolarHBondContact O-CG 3.43Å; S821-M825 PolarHBondContact O-N 3.47Å; M825-L828 HydrophobicContact CE-CD2 4.17Å; M825-L828 WeakPolarHBondContact O-CB 3.43Å; M825-L828 PolarHBondContact O-N 2.84Å; M825-L828 HydrophobicContact SD-CD2 3.78Å; M825-N829 PolarHBondContact O-N 2.79Å
826	N	49.3	Very low	50.7	Low	82 Å²	82	62.7 Å²	62.7	44%	0.439	30%	0.302	S	S	.	.	H	α-helix	trans	-65.8	-42.6	170.5	-76.5	-42.4	0	0	0	112.5	I822 W824 L828 L830	I822-N826 WeakPolarHBondContact CG2-ND2 3.36Å; I822-N826 VanDerWaalsContact O-CB 3.3Å; I822-N826 WeakPolarHBondContact O-CB 3.22Å; I822-N826 VanDerWaalsContact O-CG 3.28Å; I822-N826 PolarHBondContact O-N 2.98Å; I822-N826 PolarHBondContact O-ND2 2.92Å; W824-N826 VanDerWaalsContact C-N 3.3Å; W824-N826 PolarHBondContact O-N 3.03Å; N826-L828 VanDerWaalsContact C-N 3.25Å; N826-L828 PolarHBondContact O-N 2.9Å; N826-L830 WeakPolarHBondContact O-CB 3.43Å; N826-L830 VanDerWaalsContact O-CD1 3.23Å; N826-L830 WeakPolarHBondContact O-CD1 3.32Å; N826-L830 WeakPolarHBondContact O-CG 3.43Å; N826-L830 PolarHBondContact O-N 2.99Å
827	C	44.3	Very low	50.2	Low	13 Å²	13	58.4 Å²	58.4	9%	0.088	29%	0.289	C	S	.	.	H	α-helix	trans	-57.6	-41.5	171.1	-76.2	0	0	0	0	111.8	L759 R764 G823 W824 L830 L831	L759-C827 HydrophobicContact CD1-CB 4.38Å; R764-C827 PolarHBondContact NH1-SG 3.15Å; G823-C827 PolarHBondContact O-N 2.79Å; G823-C827 PolarHBondContact O-SG 2.85Å; G823-C827 VanDerWaalsContact O-SG 3.41Å; W824-C827 WeakPolarHBondContact O-CA 3.27Å; W824-C827 WeakPolarHBondContact O-CB 3.25Å; W824-C827 PolarHBondContact O-N 2.78Å; C827-L830 PolarHBondContact O-N 3.36Å; C827-L831 WeakPolarHBondContact O-CG 3.38Å; C827-L831 PolarHBondContact O-N 3.03Å
828	L	50.7	Low	49.4	Very low	3 Å²	3	62.4 Å²	62.4	2%	0.016	31%	0.306	C	S	.	.	H	α-helix	trans	-66.5	-49.5	-176.1	-173.7	69.4	0	0	0	112.2	I569 M572 V573 W824 M825 N826 L830 L831 Q832	I569-L828 HydrophobicContact CG2-CD1 4.46Å; M572-L828 HydrophobicContact CB-CD1 3.88Å; V573-L828 HydrophobicContact CB-CD1 4.46Å; V573-L828 HydrophobicContact CB-CD2 4.23Å; V573-L828 HydrophobicContact CG2-CD1 3.77Å; V573-L828 HydrophobicContact CG2-CD2 3.97Å; V573-L828 HydrophobicContact CG2-CG 4.21Å; W824-L828 WeakPolarHBondContact O-CB 3.38Å; W824-L828 PolarHBondContact O-N 2.68Å; M825-L828 HydrophobicContact CE-CD2 4.17Å; M825-L828 WeakPolarHBondContact O-CB 3.43Å; M825-L828 PolarHBondContact O-N 2.84Å; M825-L828 HydrophobicContact SD-CD2 3.78Å; N826-L828 VanDerWaalsContact C-N 3.25Å; N826-L828 PolarHBondContact O-N 2.9Å; L828-L830 PolarHBondContact O-N 3.09Å; L828-L831 PolarHBondContact O-N 3.09Å; L828-Q832 WeakPolarHBondContact O-CG 3.46Å; L828-Q832 PolarHBondContact O-N 3.04Å
829	N	49.5	Very low	48.7	Very low	75 Å²	75	61.2 Å²	61.2	40%	0.401	30%	0.302	S	S	.	.	H	α-helix	trans	-58.6	-38	175.5	-73.4	-6.1	0	0	0	111.4	M825 Q832 Q833	M825-N829 PolarHBondContact O-N 2.79Å; N829-Q832 PolarHBondContact O-N 2.77Å; N829-Q833 WeakPolarHBondContact O-CB 3.35Å; N829-Q833 VanDerWaalsContact O-CG 3.32Å; N829-Q833 WeakPolarHBondContact O-CG 3.3Å; N829-Q833 PolarHBondContact O-N 2.81Å
830	L	45	Very low	48.1	Very low	49 Å²	49	53.8 Å²	53.8	26%	0.257	28%	0.283	S	S	.	.	H	α-helix	trans	-73.6	-32.2	178.9	-69.3	166.3	0	0	0	113.1	R755 N826 C827 L828 G834	R755-L830 VanDerWaalsContact CZ-CD1 3.45Å; N826-L830 WeakPolarHBondContact O-CB 3.43Å; N826-L830 VanDerWaalsContact O-CD1 3.23Å; N826-L830 WeakPolarHBondContact O-CD1 3.32Å; N826-L830 WeakPolarHBondContact O-CG 3.43Å; N826-L830 PolarHBondContact O-N 2.99Å; C827-L830 PolarHBondContact O-N 3.36Å; L828-L830 PolarHBondContact O-N 3.09Å; L830-G834 PolarHBondContact O-N 3.33Å
831	L	43.5	Very low	47.5	Very low	37 Å²	37	52.6 Å²	52.6	19%	0.194	28%	0.283	C	S	.	.	H	α-helix	trans	-68.3	-38.9	169.4	-73.5	168.7	0	0	0	111.5	I569 M572 I756 L759 C827 L828 Q835	I569-L831 HydrophobicContact CD1-CB 4.49Å; I569-L831 HydrophobicContact CG1-CB 4.36Å; M572-L831 HydrophobicContact CE-CD1 4.29Å; M572-L831 HydrophobicContact SD-CD1 4.15Å; I756-L831 HydrophobicContact CD1-CD2 4.33Å; I756-L831 HydrophobicContact CG1-CD2 3.99Å; L759-L831 HydrophobicContact CD1-CD1 3.99Å; C827-L831 WeakPolarHBondContact O-CG 3.38Å; C827-L831 PolarHBondContact O-N 3.03Å; L828-L831 PolarHBondContact O-N 3.09Å; L831-Q835 WeakPolarHBondContact O-CB 3.33Å; L831-Q835 PolarHBondContact O-N 3.24Å
832	Q	47.7	Very low	46.7	Very low	72 Å²	72	53.9 Å²	53.9	34%	0.336	29%	0.289	S	S	.	.	H	α-helix	trans	-67.3	-43.9	174.5	-71.5	179.4	-6.5	0	0	111.8	I569 L828 N829 Q835 I836	I569-Q832 HydrophobicContact CG2-CG 4.08Å; L828-Q832 WeakPolarHBondContact O-CG 3.46Å; L828-Q832 PolarHBondContact O-N 3.04Å; N829-Q832 PolarHBondContact O-N 2.77Å; Q832-Q835 PolarHBondContact O-N 2.86Å; Q832-I836 WeakPolarHBondContact O-CB 3.46Å; Q832-I836 WeakPolarHBondContact O-CD1 3.33Å; Q832-I836 WeakPolarHBondContact O-CG1 3.49Å; Q832-I836 PolarHBondContact O-N 2.9Å
833	Q	48	Very low	46	Very low	105 Å²	105	54.5 Å²	54.5	49%	0.491	29%	0.29	S	S	.	.	H	α-helix	trans	-62.2	-47.1	175.3	-77.6	173.9	-29	0	0	111.6	N829 Q835 I836 Q837	N829-Q833 WeakPolarHBondContact O-CB 3.35Å; N829-Q833 VanDerWaalsContact O-CG 3.32Å; N829-Q833 WeakPolarHBondContact O-CG 3.3Å; N829-Q833 PolarHBondContact O-N 2.81Å; Q833-Q835 VanDerWaalsContact C-N 3.33Å; Q833-Q835 PolarHBondContact O-N 2.92Å; Q833-I836 PolarHBondContact O-N 3.33Å; Q833-I836 VanDerWaalsContact O-N 3.15Å; Q833-Q837 WeakPolarHBondContact O-CB 3.23Å; Q833-Q837 WeakPolarHBondContact O-CG 3.32Å; Q833-Q837 PolarHBondContact O-N 3.34Å; Q833-Q837 PolarHBondContact O-OE1 2.9Å
834	G	42.1	Very low	45.9	Very low	24 Å²	24	58.6 Å²	58.6	25%	0.247	31%	0.307	C	S	.	.	H	α-helix	trans	-61.3	-38.8	175.3	0	0	0	0	0	113.1	L830 F838	L830-G834 PolarHBondContact O-N 3.33Å; G834-F838 VanDerWaalsContact O-CB 3.28Å; G834-F838 WeakPolarHBondContact O-CB 3.48Å; G834-F838 PolarHBondContact O-N 2.98Å
835	Q	45	Very low	45.2	Very low	32 Å²	32	60.2 Å²	60.2	15%	0.15	32%	0.318	C	S	.	.	H	α-helix	trans	-64	-45	172.6	-178.6	61.5	34.8	0	0	111.2	I569 L831 Q832 Q833 F838 E839	I569-Q835 HydrophobicContact CD1-CB 4.37Å; L831-Q835 WeakPolarHBondContact O-CB 3.33Å; L831-Q835 PolarHBondContact O-N 3.24Å; Q832-Q835 PolarHBondContact O-N 2.86Å; Q833-Q835 VanDerWaalsContact C-N 3.33Å; Q833-Q835 PolarHBondContact O-N 2.92Å; Q835-F838 PolarHBondContact O-N 3.41Å; Q835-E839 PolarHBondContact NE2-OE2 3.49Å; Q835-E839 WeakPolarHBondContact O-CB 3.36Å; Q835-E839 PolarHBondContact O-N 3.17Å
836	I	47	Very low	44.4	Very low	114 Å²	114	61.6 Å²	61.6	59%	0.585	32%	0.324	S	S	*	.	H	α-helix	trans	-65.2	-41.9	178.1	-69.4	162.4	0	0	0	111.5	Q832 Q833 E839 A840	Q832-I836 WeakPolarHBondContact O-CB 3.46Å; Q832-I836 WeakPolarHBondContact O-CD1 3.33Å; Q832-I836 WeakPolarHBondContact O-CG1 3.49Å; Q832-I836 PolarHBondContact O-N 2.9Å; Q833-I836 PolarHBondContact O-N 3.33Å; Q833-I836 VanDerWaalsContact O-N 3.15Å; I836-E839 PolarHBondContact O-N 3.05Å; I836-A840 VanDerWaalsContact O-CB 3.24Å; I836-A840 WeakPolarHBondContact O-CB 3.46Å; I836-A840 PolarHBondContact O-N 2.89Å
837	Q	41.3	Very low	44.2	Very low	82 Å²	82	63.9 Å²	63.9	38%	0.383	33%	0.33	S	S	.	.	H	α-helix	trans	-61.9	-42.2	174.4	-75.9	165.5	-42.8	0	0	111	D748 Q833 A840 G841	D748-Q837 PolarHBondContact OD2-NE2 3.11Å; Q833-Q837 WeakPolarHBondContact O-CB 3.23Å; Q833-Q837 WeakPolarHBondContact O-CG 3.32Å; Q833-Q837 PolarHBondContact O-N 3.34Å; Q833-Q837 PolarHBondContact O-OE1 2.9Å; Q837-A840 PolarHBondContact O-N 3.37Å; Q837-G841 PolarHBondContact O-N 2.83Å
838	F	43.4	Very low	43.9	Very low	98 Å²	98	67.8 Å²	67.8	43%	0.43	35%	0.349	S	S	.	.	H	α-helix	trans	-67.8	-41.8	174.9	178.6	-106.8	0	0	0	112.8	G834 Q835 A840 G841 N842	G834-F838 VanDerWaalsContact O-CB 3.28Å; G834-F838 WeakPolarHBondContact O-CB 3.48Å; G834-F838 PolarHBondContact O-N 2.98Å; Q835-F838 PolarHBondContact O-N 3.41Å; F838-A840 VanDerWaalsContact C-N 3.33Å; F838-G841 PolarHBondContact O-N 3.07Å; F838-N842 WeakPolarHBondContact CE1-ND2 3.45Å; F838-N842 WeakPolarHBondContact CZ-ND2 3.4Å; F838-N842 WeakPolarHBondContact O-CB 3.43Å; F838-N842 PolarHBondContact O-N 3.18Å; F838-N842 PolarHBondContact O-ND2 3.04Å
839	E	44	Very low	43.5	Very low	49 Å²	49	72.1 Å²	72.1	23%	0.229	37%	0.371	C	S	.	.	H	α-helix	trans	-64.5	-38.8	175.7	-140.5	99	-125.8	0	0	111.1	R562 Q835 I836 Q843	R562-E839 WeakPolarHBondContact CD-OE1 3.47Å; R562-E839 IonicContact CZ-OE1 3.75Å; R562-E839 IonicContact NE-OE1 2.74Å; R562-E839 IonicContact NH1-OE1 2.64Å; R562-E839 PolarHBondContact NH1-OE1 2.95Å; Q835-E839 PolarHBondContact NE2-OE2 3.49Å; Q835-E839 WeakPolarHBondContact O-CB 3.36Å; Q835-E839 PolarHBondContact O-N 3.17Å; I836-E839 PolarHBondContact O-N 3.05Å; E839-Q843 WeakPolarHBondContact O-CB 3.4Å; E839-Q843 VanDerWaalsContact O-CG 3.28Å; E839-Q843 WeakPolarHBondContact O-CG 3.29Å; E839-Q843 PolarHBondContact O-N 3.08Å
840	A	43.2	Very low	43.1	Very low	43 Å²	43	74 Å²	74	36%	0.355	38%	0.381	S	S	.	.	H	α-helix	trans	-69.7	-42.6	174.6	0	0	0	0	0	112.1	I836 Q837 F838 Q843 I844	I836-A840 VanDerWaalsContact O-CB 3.24Å; I836-A840 WeakPolarHBondContact O-CB 3.46Å; I836-A840 PolarHBondContact O-N 2.89Å; Q837-A840 PolarHBondContact O-N 3.37Å; F838-A840 VanDerWaalsContact C-N 3.33Å; A840-Q843 PolarHBondContact O-N 3.01Å; A840-I844 VanDerWaalsContact O-CG1 3.29Å; A840-I844 WeakPolarHBondContact O-CG1 3.3Å; A840-I844 PolarHBondContact O-N 3.02Å
841	G	39.6	Very low	43	Very low	26 Å²	26	76.2 Å²	76.2	27%	0.268	40%	0.397	S	S	.	.	H	α-helix	trans	-59.8	-45.9	174.1	0	0	0	0	0	112	Q837 F838 I844 I845	Q837-G841 PolarHBondContact O-N 2.83Å; F838-G841 PolarHBondContact O-N 3.07Å; G841-I844 PolarHBondContact O-N 3.48Å; G841-I845 WeakPolarHBondContact O-CG1 3.3Å; G841-I845 PolarHBondContact O-N 3.39Å
842	N	41.7	Very low	42.6	Very low	41 Å²	41	77 Å²	77	22%	0.219	40%	0.401	C	S	.	.	H	α-helix	trans	-64.6	-38.4	173.5	-72.1	-27	0	0	0	112.3	F838 I844 I845 E846	F838-N842 WeakPolarHBondContact CE1-ND2 3.45Å; F838-N842 WeakPolarHBondContact CZ-ND2 3.4Å; F838-N842 WeakPolarHBondContact O-CB 3.43Å; F838-N842 PolarHBondContact O-N 3.18Å; F838-N842 PolarHBondContact O-ND2 3.04Å; N842-I844 VanDerWaalsContact C-N 3.31Å; N842-I844 PolarHBondContact O-N 3.39Å; N842-I845 PolarHBondContact O-N 2.82Å; N842-E846 WeakPolarHBondContact O-CB 3.34Å; N842-E846 WeakPolarHBondContact O-CG 3.3Å; N842-E846 PolarHBondContact O-N 2.81Å
843	Q	43.5	Very low	42.3	Very low	99 Å²	99	80.8 Å²	80.8	46%	0.463	42%	0.424	S	S	.	.	H	α-helix	trans	-67	-29.5	173.4	-78.1	176.5	47.5	0	0	113.3	E839 A840 K847	E839-Q843 WeakPolarHBondContact O-CB 3.4Å; E839-Q843 VanDerWaalsContact O-CG 3.28Å; E839-Q843 WeakPolarHBondContact O-CG 3.29Å; E839-Q843 PolarHBondContact O-N 3.08Å; A840-Q843 PolarHBondContact O-N 3.01Å; Q843-K847 VanDerWaalsContact O-CB 3.28Å; Q843-K847 WeakPolarHBondContact O-CB 3.29Å; Q843-K847 WeakPolarHBondContact O-CD 3.09Å; Q843-K847 WeakPolarHBondContact O-CG 2.9Å; Q843-K847 PolarHBondContact O-N 2.85Å
844	I	44.2	Very low	42.1	Very low	104 Å²	104	83.3 Å²	83.3	53%	0.533	44%	0.441	S	S	.	.	H	α-helix	trans	-71.1	-44.7	172.6	-71.7	162.8	0	0	0	109.7	A840 G841 N842 K847 L848	A840-I844 VanDerWaalsContact O-CG1 3.29Å; A840-I844 WeakPolarHBondContact O-CG1 3.3Å; A840-I844 PolarHBondContact O-N 3.02Å; G841-I844 PolarHBondContact O-N 3.48Å; N842-I844 VanDerWaalsContact C-N 3.31Å; N842-I844 PolarHBondContact O-N 3.39Å; I844-K847 PolarHBondContact O-N 3.33Å; I844-L848 HydrophobicContact CG2-CD1 3.9Å; I844-L848 WeakPolarHBondContact O-CB 3.42Å; I844-L848 VanDerWaalsContact O-CG 3.26Å; I844-L848 WeakPolarHBondContact O-CG 3.34Å; I844-L848 PolarHBondContact O-N 2.88Å
845	I	39.9	Very low	42.1	Very low	73 Å²	73	87.4 Å²	87.4	37%	0.374	46%	0.457	S	S	.	.	H	α-helix	trans	-64.9	-46.3	176.4	-67.9	165.2	0	0	0	111.1	G841 N842 K847 L848 I849	G841-I845 WeakPolarHBondContact O-CG1 3.3Å; G841-I845 PolarHBondContact O-N 3.39Å; N842-I845 PolarHBondContact O-N 2.82Å; I845-K847 VanDerWaalsContact C-N 3.34Å; I845-K847 PolarHBondContact O-N 2.94Å; I845-L848 PolarHBondContact O-N 3.05Å; I845-I849 HydrophobicContact CG2-CD1 3.71Å; I845-I849 WeakPolarHBondContact O-CB 3.37Å; I845-I849 VanDerWaalsContact O-CG1 3.28Å; I845-I849 WeakPolarHBondContact O-CG1 3.28Å; I845-I849 PolarHBondContact O-N 3.02Å
846	E	39.4	Very low	42.4	Very low	73 Å²	73	90.5 Å²	90.5	34%	0.341	48%	0.482	S	S	.	.	H	α-helix	trans	-60.9	-40.7	174.1	-80.3	-165.8	135	0	0	111.5	Y557 N842 I849 L850	Y557-E846 VanDerWaalsContact CE1-OE1 3.3Å; Y557-E846 WeakPolarHBondContact CE1-OE1 3.44Å; Y557-E846 PolarHBondContact OH-OE1 3.32Å; N842-E846 WeakPolarHBondContact O-CB 3.34Å; N842-E846 WeakPolarHBondContact O-CG 3.3Å; N842-E846 PolarHBondContact O-N 2.81Å; E846-I849 PolarHBondContact O-N 3.01Å; E846-L850 HydrophobicContact CB-CD1 4.22Å; E846-L850 WeakPolarHBondContact O-CB 3.16Å; E846-L850 VanDerWaalsContact O-CG 3.24Å; E846-L850 WeakPolarHBondContact O-CG 3.38Å; E846-L850 PolarHBondContact O-N 3.21Å
847	K	45.4	Very low	42.6	Very low	129 Å²	129	90.8 Å²	90.8	56%	0.561	48%	0.484	S	S	*	.	H	α-helix	trans	-62.4	-49	173.3	-79.3	169.4	-178.3	171	0	111.5	Q843 I844 I845 I849 L850 T851	Q843-K847 VanDerWaalsContact O-CB 3.28Å; Q843-K847 WeakPolarHBondContact O-CB 3.29Å; Q843-K847 WeakPolarHBondContact O-CD 3.09Å; Q843-K847 WeakPolarHBondContact O-CG 2.9Å; Q843-K847 PolarHBondContact O-N 2.85Å; I844-K847 PolarHBondContact O-N 3.33Å; I845-K847 VanDerWaalsContact C-N 3.34Å; I845-K847 PolarHBondContact O-N 2.94Å; K847-I849 PolarHBondContact O-N 3.1Å; K847-L850 PolarHBondContact O-N 3.44Å; K847-T851 HydrophobicContact CB-CG2 4.4Å; K847-T851 WeakPolarHBondContact O-CG2 3.27Å; K847-T851 PolarHBondContact O-N 2.7Å; K847-T851 PolarHBondContact O-OG1 3.1Å
848	L	38.3	Very low	42.6	Very low	95 Å²	95	90.7 Å²	90.7	50%	0.497	49%	0.486	S	S	.	.	H	α-helix	trans	-59.3	-26.4	177.3	-72.6	166.1	0	0	0	113.4	I844 I845 L858	I844-L848 HydrophobicContact CG2-CD1 3.9Å; I844-L848 WeakPolarHBondContact O-CB 3.42Å; I844-L848 VanDerWaalsContact O-CG 3.26Å; I844-L848 WeakPolarHBondContact O-CG 3.34Å; I844-L848 PolarHBondContact O-N 2.88Å; I845-L848 PolarHBondContact O-N 3.05Å; L848-L858 HydrophobicContact CD2-CD2 3.87Å
849	I	41.7	Very low	42.4	Very low	94 Å²	94	92.2 Å²	92.2	48%	0.482	50%	0.495	S	S	.	.	H	α-helix	trans	-88.7	-34.4	176.4	-68.5	169.5	0	0	0	112.4	I845 E846 K847	I845-I849 HydrophobicContact CG2-CD1 3.71Å; I845-I849 WeakPolarHBondContact O-CB 3.37Å; I845-I849 VanDerWaalsContact O-CG1 3.28Å; I845-I849 WeakPolarHBondContact O-CG1 3.28Å; I845-I849 PolarHBondContact O-N 3.02Å; E846-I849 PolarHBondContact O-N 3.01Å; K847-I849 PolarHBondContact O-N 3.1Å
850	L	41.7	Very low	42.5	Very low	114 Å²	114	91.6 Å²	91.6	60%	0.597	50%	0.496	S	S	*	.	H	α-helix	trans	-102.6	-19	-169.3	-65.5	170.8	0	0	0	115.3	E846 K847	E846-L850 HydrophobicContact CB-CD1 4.22Å; E846-L850 WeakPolarHBondContact O-CB 3.16Å; E846-L850 VanDerWaalsContact O-CG 3.24Å; E846-L850 WeakPolarHBondContact O-CG 3.38Å; E846-L850 PolarHBondContact O-N 3.21Å; K847-L850 PolarHBondContact O-N 3.44Å
851	T	42.8	Very low	42.7	Very low	97 Å²	97	95.6 Å²	95.6	60%	0.595	51%	0.505	S	S	*	.	S	Bend	trans	-80.4	-21.7	179.5	58.5	0	0	0	0	113.5	K847	K847-T851 HydrophobicContact CB-CG2 4.4Å; K847-T851 WeakPolarHBondContact O-CG2 3.27Å; K847-T851 PolarHBondContact O-N 2.7Å; K847-T851 PolarHBondContact O-OG1 3.1Å
852	N	34.9	Very low	42.6	Very low	53 Å²	53	100.5 Å²	100.5	28%	0.283	52%	0.519	S	S	.	.			trans	-118.8	73.9	-166.8	-70.6	39.2	0	0	0	112.1	D854 D855	N852-D854 VanDerWaalsContact C-N 3.29Å; N852-D855 HydrophobicContact CB-CB 4.36Å
853	N	40.9	Very low	42.6	Very low	152 Å²	152	105.1 Å²	105.1	81%	0.813	54%	0.535	S	S	*	.	S	Bend	trans	-75.3	-19.8	163.2	-80.8	-43.7	0	0	0	112.6
854	D	44.6	Very low	42.6	Very low	158 Å²	158	105.9 Å²	105.9	85%	0.845	54%	0.536	S	S	*	.	S	Bend	trans	-103.9	-24.3	-171.5	-58.1	-51.7	0	0	0	114.1	N852	N852-D854 VanDerWaalsContact C-N 3.29Å
855	D	41.4	Very low	42.4	Very low	110 Å²	110	105.2 Å²	105.2	59%	0.588	53%	0.534	S	S	*	.			trans	-101.4	88.7	-177.5	-93.7	-26.5	0	0	0	112.3	N852 D857	N852-D855 HydrophobicContact CB-CB 4.36Å; D855-D857 PolarHBondContact O-N 2.94Å
856	S	51	Low	42.2	Very low	96 Å²	96	106.4 Å²	106.4	67%	0.671	54%	0.541	S	S	*	.	H	α-helix	trans	-62.1	-25.6	-178.2	61	0	0	0	0	114.5	L858 S860	S856-L858 PolarHBondContact O-N 3.32Å; S856-S860 PolarHBondContact O-N 2.74Å
857	D	52.2	Low	42.1	Very low	120 Å²	120	106.4 Å²	106.4	64%	0.642	54%	0.543	S	S	*	.	H	α-helix	trans	-67.1	-35.9	-172.5	-111.4	-15.7	0	0	0	112.9	D855 S860 K861	D855-D857 PolarHBondContact O-N 2.94Å; D857-S860 WeakPolarHBondContact O-CB 3.26Å; D857-S860 PolarHBondContact O-N 3.22Å; D857-S860 PolarHBondContact O-OG 3Å; D857-K861 WeakPolarHBondContact O-CB 3.36Å; D857-K861 PolarHBondContact O-N 3.37Å
858	L	40.1	Very low	41.8	Very low	80 Å²	80	101.8 Å²	101.8	42%	0.419	53%	0.527	S	S	.	.	H	α-helix	trans	-74.2	-39.6	-176.9	-144.5	81.1	0	0	0	112.3	L848 S856 S860 K861 F862	L848-L858 HydrophobicContact CD2-CD2 3.87Å; S856-L858 PolarHBondContact O-N 3.32Å; L858-S860 VanDerWaalsContact C-N 3.3Å; L858-K861 WeakPolarHBondContact O-CA 3.35Å; L858-K861 VanDerWaalsContact O-CB 3.32Å; L858-K861 WeakPolarHBondContact O-CB 3.33Å; L858-K861 PolarHBondContact O-N 2.97Å; L858-F862 PolarHBondContact O-N 2.94Å
859	Q	39.2	Very low	42.2	Very low	131 Å²	131	105.9 Å²	105.9	61%	0.612	54%	0.537	S	S	*	.	H	α-helix	trans	-65.9	-36.9	172.4	-165.2	179.8	61.4	0	0	110.7	K861 Y863	Q859-K861 PolarHBondContact O-N 3.3Å; Q859-Y863 PolarHBondContact O-N 3.05Å; Q859-Y863 VanDerWaalsContact O-N 3.09Å
860	S	47.5	Very low	42.7	Very low	36 Å²	36	104.1 Å²	104.1	25%	0.252	53%	0.528	S	S	.	.	H	α-helix	trans	-60.4	-33.3	169.3	96.4	0	0	0	0	112.1	S856 D857 L858 K864	S856-S860 PolarHBondContact O-N 2.74Å; D857-S860 WeakPolarHBondContact O-CB 3.26Å; D857-S860 PolarHBondContact O-N 3.22Å; D857-S860 PolarHBondContact O-OG 3Å; L858-S860 VanDerWaalsContact C-N 3.3Å; S860-K864 WeakPolarHBondContact O-CB 3.35Å; S860-K864 VanDerWaalsContact O-CD 3.26Å; S860-K864 WeakPolarHBondContact O-CD 3.48Å; S860-K864 WeakPolarHBondContact O-CG 3.44Å; S860-K864 PolarHBondContact O-N 2.9Å; S860-K864 PolarHBondContact OG-NZ 2.97Å
861	K	45.6	Very low	43.8	Very low	126 Å²	126	98.7 Å²	98.7	55%	0.548	50%	0.5	S	S	.	.	H	α-helix	trans	-74.3	-45.9	-177.8	-145.6	167.9	-172.2	173.6	0	111.7	D857 L858 Q859 Y863 K864 D865	D857-K861 WeakPolarHBondContact O-CB 3.36Å; D857-K861 PolarHBondContact O-N 3.37Å; L858-K861 WeakPolarHBondContact O-CA 3.35Å; L858-K861 VanDerWaalsContact O-CB 3.32Å; L858-K861 WeakPolarHBondContact O-CB 3.33Å; L858-K861 PolarHBondContact O-N 2.97Å; Q859-K861 PolarHBondContact O-N 3.3Å; K861-Y863 VanDerWaalsContact C-N 3.32Å; K861-Y863 PolarHBondContact O-N 3.2Å; K861-K864 CarbonylContact O-C 3.59Å; K861-K864 WeakPolarHBondContact O-CA 3.32Å; K861-K864 WeakPolarHBondContact O-CB 3.29Å; K861-K864 PolarHBondContact O-N 3.4Å; K861-K864 VanDerWaalsContact O-N 3.08Å; K861-D865 VanDerWaalsContact O-CG 3.24Å; K861-D865 PolarHBondContact O-N 3.36Å
862	F	39.6	Very low	45.4	Very low	130 Å²	130	96.2 Å²	96.2	57%	0.57	48%	0.482	S	S	*	.	H	α-helix	trans	-62.3	-39.3	173.4	-167.7	-101.6	0	0	0	112.1	L858 D865 L866	L858-F862 PolarHBondContact O-N 2.94Å; F862-D865 PolarHBondContact O-N 2.85Å; F862-L866 HydrophobicContact CE1-CD1 4.21Å; F862-L866 WeakPolarHBondContact O-CB 3.46Å; F862-L866 PolarHBondContact O-N 2.86Å
863	Y	41.6	Very low	47.7	Very low	138 Å²	138	95.4 Å²	95.4	54%	0.541	48%	0.476	S	S	.	.	H	α-helix	trans	-66.5	-36.2	171	-100.9	-77.7	0	0	0	113.2	Q859 K861 N867	Q859-Y863 PolarHBondContact O-N 3.05Å; Q859-Y863 VanDerWaalsContact O-N 3.09Å; K861-Y863 VanDerWaalsContact C-N 3.32Å; K861-Y863 PolarHBondContact O-N 3.2Å; Y863-N867 WeakPolarHBondContact O-CB 3.28Å; Y863-N867 PolarHBondContact O-N 2.65Å; Y863-N867 PolarHBondContact O-ND2 2.93Å
864	K	42.5	Very low	49.8	Very low	115 Å²	115	92.5 Å²	92.5	50%	0.5	46%	0.458	S	S	.	.	H	α-helix	trans	-64.4	-41.7	172.6	-77.3	157.4	-173.1	158.7	0	111.4	S860 K861 N867 S868	S860-K864 WeakPolarHBondContact O-CB 3.35Å; S860-K864 VanDerWaalsContact O-CD 3.26Å; S860-K864 WeakPolarHBondContact O-CD 3.48Å; S860-K864 WeakPolarHBondContact O-CG 3.44Å; S860-K864 PolarHBondContact O-N 2.9Å; S860-K864 PolarHBondContact OG-NZ 2.97Å; K861-K864 CarbonylContact O-C 3.59Å; K861-K864 WeakPolarHBondContact O-CA 3.32Å; K861-K864 WeakPolarHBondContact O-CB 3.29Å; K861-K864 PolarHBondContact O-N 3.4Å; K861-K864 VanDerWaalsContact O-N 3.08Å; K864-N867 CarbonylContact O-C 3.57Å; K864-N867 PolarHBondContact O-N 3.04Å; K864-S868 WeakPolarHBondContact O-CB 3.45Å; K864-S868 PolarHBondContact O-N 3.06Å; K864-S868 PolarHBondContact O-OG 2.88Å
865	D	39.2	Very low	51.9	Low	89 Å²	89	85.2 Å²	85.2	48%	0.476	42%	0.418	S	S	.	.	H	α-helix	trans	-68.8	-40.1	-180	-65.5	-26.9	0	0	0	110.9	K861 F862 S868 Y869	K861-D865 VanDerWaalsContact O-CG 3.24Å; K861-D865 PolarHBondContact O-N 3.36Å; F862-D865 PolarHBondContact O-N 2.85Å; D865-S868 WeakPolarHBondContact O-CA 3.25Å; D865-S868 VanDerWaalsContact O-CB 3.3Å; D865-S868 WeakPolarHBondContact O-CB 3.4Å; D865-S868 PolarHBondContact O-N 3.35Å; D865-Y869 WeakPolarHBondContact O-CD2 3.47Å
866	L	37.4	Very low	54.1	Low	99 Å²	99	84.4 Å²	84.4	52%	0.518	42%	0.421	S	S	.	.	H	α-helix	trans	-67.2	-39.5	172.9	-134.4	165.8	0	0	0	111.5	F862 S868 Y869	F862-L866 HydrophobicContact CE1-CD1 4.21Å; F862-L866 WeakPolarHBondContact O-CB 3.46Å; F862-L866 PolarHBondContact O-N 2.86Å; L866-S868 PolarHBondContact O-N 2.81Å; L866-Y869 PolarHBondContact O-N 2.83Å
867	N	36.6	Very low	55.8	Low	73 Å²	73	80.3 Å²	80.3	39%	0.39	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	10.6	168.5	-63.9	-18.1	0	0	0	113.8	Y863 K864 I872	Y863-N867 WeakPolarHBondContact O-CB 3.28Å; Y863-N867 PolarHBondContact O-N 2.65Å; Y863-N867 PolarHBondContact O-ND2 2.93Å; K864-N867 CarbonylContact O-C 3.57Å; K864-N867 PolarHBondContact O-N 3.04Å; N867-I872 WeakPolarHBondContact OD1-CD1 3.36Å
868	S	39.8	Very low	57.5	Low	31 Å²	31	78.9 Å²	78.9	22%	0.217	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-0	169	-59	0	0	0	0	112.5	K864 D865 L866 I1006	K864-S868 WeakPolarHBondContact O-CB 3.45Å; K864-S868 PolarHBondContact O-N 3.06Å; K864-S868 PolarHBondContact O-OG 2.88Å; D865-S868 WeakPolarHBondContact O-CA 3.25Å; D865-S868 VanDerWaalsContact O-CB 3.3Å; D865-S868 WeakPolarHBondContact O-CB 3.4Å; D865-S868 PolarHBondContact O-N 3.35Å; L866-S868 PolarHBondContact O-N 2.81Å; S868-I1006 CarbonylContact O-C 3.52Å; S868-I1006 VanDerWaalsContact O-C 3.25Å; S868-I1006 VanDerWaalsContact O-CA 3.25Å; S868-I1006 WeakPolarHBondContact O-CA 3.33Å
869	Y	46.5	Very low	59.5	Low	182 Å²	182	75.6 Å²	75.6	71%	0.714	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-12.3	168.1	-72.3	-82	0	0	0	113.2	D865 L866 G1005	D865-Y869 WeakPolarHBondContact O-CD2 3.47Å; L866-Y869 PolarHBondContact O-N 2.83Å; Y869-G1005 CarbonylContact C-O 3.47Å
870	L	52	Low	61.1	Low	57 Å²	57	73.4 Å²	73.4	30%	0.298	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	120.5	174.7	-145.8	71.3	0	0	0	107.8	I872 W969 L1002 G1003	L870-I872 HydrophobicContact CB-CG1 4.46Å; L870-I872 PolarHBondContact O-N 2.92Å; L870-W969 HydrophobicContact CD1-CH2 4.2Å; L870-W969 HydrophobicContact CD2-CH2 4.49Å; L870-L1002 HydrophobicContact CD2-CB 4.31Å; L870-L1002 HydrophobicContact CD2-CD2 4.25Å; L870-G1003 CarbonylContact C-O 3.53Å; L870-G1003 WeakPolarHBondContact CA-O 3.32Å; L870-G1003 WeakPolarHBondContact CD1-O 3.5Å; L870-G1003 WeakPolarHBondContact CG-O 3.46Å
871	S	65.3	Low	61.9	Low	0 Å²	0	76 Å²	76	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	126.2	169.9	47.5	0	0	0	0	108.4	G1003 P1004 G1008 L1012	S871-G1003 PolarHBondContact N-O 2.99Å; S871-G1003 PolarHBondContact O-N 3.36Å; S871-G1003 VanDerWaalsContact O-N 3.08Å; S871-G1003 PolarHBondContact OG-O 2.92Å; S871-P1004 PolarHBondContact OG-O 3.29Å; S871-G1008 WeakPolarHBondContact CA-O 3.31Å; S871-G1008 WeakPolarHBondContact CB-O 3.47Å; S871-L1012 WeakPolarHBondContact OG-CD2 3.42Å
872	I	75.1	Confident	62.6	Low	45 Å²	45	73.6 Å²	73.6	23%	0.231	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	131.9	-179.4	-54.1	-172.6	0	0	0	109.1	N867 L870 Q1000 L1001 L1002	N867-I872 WeakPolarHBondContact OD1-CD1 3.36Å; L870-I872 HydrophobicContact CB-CG1 4.46Å; L870-I872 PolarHBondContact O-N 2.92Å; I872-Q1000 HydrophobicContact CG2-CG 4.34Å; I872-L1001 WeakPolarHBondContact CA-O 3.38Å; I872-L1002 HydrophobicContact CB-CD2 4.36Å; I872-L1002 HydrophobicContact CD1-CD2 3.89Å; I872-L1002 HydrophobicContact CG1-CD2 3.74Å; I872-L1002 HydrophobicContact CG2-CD2 4.02Å
873	K	83.1	Confident	63.1	Low	35 Å²	35	72.4 Å²	72.4	15%	0.152	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	119.8	168.9	172.4	57.2	178.8	155.1	0	109.1	Y875 L1001 N1009 L1012 L1020 N1021	K873-Y875 HydrophobicContact CD-CE1 4.28Å; K873-Y875 HydrophobicContact CG-CD2 4.26Å; K873-Y875 HydrophobicContact CG-CE1 4.02Å; K873-Y875 HydrophobicContact CG-CE2 3.65Å; K873-L1001 PolarHBondContact N-O 2.85Å; K873-L1001 PolarHBondContact O-N 3.1Å; K873-N1009 HydrophobicContact CB-CB 4.01Å; K873-L1012 HydrophobicContact CB-CD1 3.52Å; K873-L1020 VanDerWaalsContact CE-O 3.25Å; K873-L1020 WeakPolarHBondContact CE-O 3.37Å; K873-L1020 PolarHBondContact NZ-O 3.48Å; K873-N1021 PolarHBondContact NZ-OD1 2.91Å; K873-N1021 VanDerWaalsContact NZ-OD1 3.11Å
874	E	85.3	Confident	63.3	Low	91 Å²	91	68.8 Å²	68.8	43%	0.425	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	143.3	169.5	-55.1	-154.2	170.4	0	0	111.2	N998 Q1000	E874-N998 PolarHBondContact OE2-ND2 3.26Å; E874-Q1000 HydrophobicContact CG-CG 3.78Å; E874-Q1000 WeakPolarHBondContact OE1-CG 3.47Å; E874-Q1000 PolarHBondContact OE1-NE2 3.21Å
875	Y	88.6	Confident	63.5	Low	5 Å²	5	65.2 Å²	65.2	2%	0.02	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	132.2	168.5	-58.9	-77.5	0	0	0	107.7	K873 W997 N998 L999 L1001 P1015 L1022	K873-Y875 HydrophobicContact CD-CE1 4.28Å; K873-Y875 HydrophobicContact CG-CD2 4.26Å; K873-Y875 HydrophobicContact CG-CE1 4.02Å; K873-Y875 HydrophobicContact CG-CE2 3.65Å; Y875-W997 VanDerWaalsContact O-CZ3 3.25Å; Y875-W997 WeakPolarHBondContact O-CZ3 3.44Å; Y875-N998 CarbonylContact O-C 3.59Å; Y875-N998 VanDerWaalsContact O-CA 3.31Å; Y875-N998 WeakPolarHBondContact O-CA 3.46Å; Y875-N998 PolarHBondContact O-OD1 3.5Å; Y875-L999 HydrophobicContact CD2-CD2 4.41Å; Y875-L999 PolarHBondContact N-O 2.73Å; Y875-L999 PolarHBondContact O-N 3.07Å; Y875-L1001 HydrophobicContact CE2-CB 4.45Å; Y875-L1001 HydrophobicContact CE2-CD2 4.38Å; Y875-P1015 WeakPolarHBondContact OH-CD 3.47Å; Y875-L1022 HydrophobicContact CD1-CB 4.45Å; Y875-L1022 HydrophobicContact CD1-CD1 4.28Å; Y875-L1022 HydrophobicContact CD1-CG 3.76Å; Y875-L1022 HydrophobicContact CD2-CD1 3.78Å; Y875-L1022 HydrophobicContact CD2-CG 4.07Å; Y875-L1022 HydrophobicContact CE1-CD2 4.49Å; Y875-L1022 HydrophobicContact CE1-CG 4.02Å; Y875-L1022 HydrophobicContact CE2-CD1 4.32Å; Y875-L1022 HydrophobicContact CE2-CG 4.33Å; Y875-L1022 HydrophobicContact CG-CD1 3.74Å; Y875-L1022 HydrophobicContact CG-CG 3.76Å
876	S	88.5	Confident	64.1	Low	93 Å²	93	70.1 Å²	70.1	65%	0.65	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.2	140	-178.3	64.3	0	0	0	0	111.7	W997	S876-W997 WeakPolarHBondContact CA-O 3.09Å
877	G	87.2	Confident	65	Low	11 Å²	11	72.2 Å²	72.2	11%	0.113	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	172.4	177.5	0	0	0	0	0	113.1	W997	G877-W997 VanDerWaalsContact CA-CE2 3.46Å; G877-W997 PolarHBondContact N-O 2.89Å; G877-W997 PolarHBondContact O-N 3.46Å
878	N	86.5	Confident	66.4	Low	89 Å²	89	70.2 Å²	70.2	48%	0.476	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	134.5	172.4	-54.4	-49.5	0	0	0	108.2	G995 K996	N878-G995 CarbonylContact C-O 3.58Å; N878-G995 WeakPolarHBondContact CA-O 3.38Å; N878-K996 WeakPolarHBondContact OD1-CD 3.45Å; N878-K996 WeakPolarHBondContact OD1-CE 3.44Å; N878-K996 WeakPolarHBondContact OD1-CG 3.23Å
879	Y	83.6	Confident	67.5	Low	11 Å²	11	73 Å²	73	4%	0.043	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	109.9	163.4	172.5	-101.9	0	0	0	108	H909 L910 L911 V943 I992 S994 G995	Y879-H909 HydrophobicContact CE2-CB 4.4Å; Y879-H909 AromaticContact CZ-ND1 3.88Å; Y879-H909 PolarHBondContact OH-ND1 2.78Å; Y879-L910 WeakPolarHBondContact CD2-O 3.13Å; Y879-L911 HydrophobicContact CD2-CD2 4.2Å; Y879-L911 HydrophobicContact CG-CD2 4.04Å; Y879-V943 HydrophobicContact CD1-CG2 4.25Å; Y879-I992 HydrophobicContact CE1-CB 4.31Å; Y879-I992 HydrophobicContact CE1-CG2 3.98Å; Y879-S994 CarbonylContact O-C 3.57Å; Y879-S994 WeakPolarHBondContact O-CA 3.42Å; Y879-G995 PolarHBondContact N-O 3.03Å; Y879-G995 PolarHBondContact O-N 3.16Å
880	S	72.3	Confident	68.7	Low	85 Å²	85	68.5 Å²	68.5	59%	0.594	37%	0.365	S	S	*	.			trans	-76.4	137.9	171.3	-66.6	0	0	0	0	109.8	I882	S880-I882 PolarHBondContact O-N 3.01Å
881	E	63.1	Low	69.8	Low	91 Å²	91	67.2 Å²	67.2	43%	0.425	36%	0.36	S	S	.	.			trans	-66.8	103.2	174.7	-174.9	164.7	167.6	0	0	109.6	P883 S994	E881-P883 WeakPolarHBondContact O-CD 3.27Å; E881-S994 PolarHBondContact OE2-N 3.43Å
882	I	61.3	Low	69.7	Low	75 Å²	75	68.3 Å²	68.3	39%	0.385	37%	0.371	S	S	.	.			trans	-71.5	114.8	167.1	-56.6	174.5	0	0	0	105.5	S880 S884	S880-I882 PolarHBondContact O-N 3.01Å; I882-S884 PolarHBondContact O-N 3.39Å; I882-S884 VanDerWaalsContact O-N 3.16Å
883	P	49.2	Very low	68.8	Low	106 Å²	106	72.9 Å²	72.9	69%	0.688	39%	0.391	S	S	*	.			trans	-58.9	124.6	177.8	25.3	-33.4	0	0	0	107.9	E881 P885	E881-P883 WeakPolarHBondContact O-CD 3.27Å; P883-P885 VanDerWaalsContact O-CD 3.22Å; P883-P885 WeakPolarHBondContact O-CD 3.33Å
884	S	46.4	Very low	67.1	Low	62 Å²	62	75.7 Å²	75.7	43%	0.434	42%	0.415	S	S	.	.			trans	-58.5	112.9	-173.7	52.4	0	0	0	0	109.2	I882 Y886	I882-S884 PolarHBondContact O-N 3.39Å; I882-S884 VanDerWaalsContact O-N 3.16Å; S884-Y886 PolarHBondContact O-N 3Å
885	P	47.2	Very low	65.1	Low	40 Å²	40	79.1 Å²	79.1	26%	0.26	43%	0.432	S	S	.	.			trans	-63.3	136.8	175.6	25.5	-29	0	0	0	107.6	P883 L887 R1317	P883-P885 VanDerWaalsContact O-CD 3.22Å; P883-P885 WeakPolarHBondContact O-CD 3.33Å; P885-L887 PolarHBondContact O-N 3.15Å; P885-R1317 VanDerWaalsContact CG-NH2 3.3Å
886	Y	52.3	Low	63	Low	192 Å²	192	84.7 Å²	84.7	75%	0.753	46%	0.456	S	S	*	.			trans	-25.7	125.6	-171	-62.8	-89.1	0	0	0	114	S884 M888	S884-Y886 PolarHBondContact O-N 3Å; Y886-M888 PolarHBondContact O-N 3.41Å
887	L	54.3	Low	60.7	Low	143 Å²	143	85.4 Å²	85.4	75%	0.749	46%	0.457	S	S	*	.			trans	-45.9	118.2	178.8	-160.9	86.4	0	0	0	108.7	P885 H889	P885-L887 PolarHBondContact O-N 3.15Å; L887-H889 PolarHBondContact O-CD2 3.05Å; L887-H889 PolarHBondContact O-N 3.39Å
888	M	66	Low	58.5	Low	31 Å²	31	92.4 Å²	92.4	15%	0.153	49%	0.492	C	S	.	.			trans	-61.4	114.9	-168.1	-174.4	176.7	61.2	0	0	109.4	Y886 H890 R1061 L1062	Y886-M888 PolarHBondContact O-N 3.41Å; M888-H890 PolarHBondContact O-N 3.42Å; M888-R1061 HydrophobicContact CE-CB 3.91Å; M888-R1061 HydrophobicContact CE-CG 3.59Å; M888-R1061 HydrophobicContact SD-CB 3.75Å; M888-R1061 HydrophobicContact SD-CG 4.07Å; M888-L1062 WeakPolarHBondContact CE-O 3.08Å
889	H	64.5	Low	56.2	Low	90 Å²	90	93.4 Å²	93.4	42%	0.417	50%	0.495	S	S	.	.			trans	-63.2	130.7	-170.2	-81.4	-112.3	0	0	0	110.7	L887 T891 S1063 Y1309	L887-H889 PolarHBondContact O-CD2 3.05Å; L887-H889 PolarHBondContact O-N 3.39Å; H889-T891 PolarHBondContact O-N 3.46Å; H889-S1063 WeakPolarHBondContact O-CB 3.06Å; H889-Y1309 VanDerWaalsContact CB-O 3.26Å; H889-Y1309 WeakPolarHBondContact CB-O 3.24Å
890	H	71.5	Confident	54	Low	86 Å²	86	98.4 Å²	98.4	40%	0.398	52%	0.522	S	S	.	.			trans	-79.1	113.3	180	-174.5	-75.2	0	0	0	110.2	M888 G892 S1063 P1065	M888-H890 PolarHBondContact O-N 3.42Å; H890-G892 PolarHBondContact CE1-O 2.94Å; H890-G892 VanDerWaalsContact CE1-O 3.24Å; H890-G892 PolarHBondContact ND1-N 2.89Å; H890-G892 PolarHBondContact ND1-O 2.92Å; H890-G892 VanDerWaalsContact ND1-O 3.13Å; H890-S1063 CarbonylContact C-O 3.54Å; H890-S1063 WeakPolarHBondContact CA-O 3.28Å; H890-P1065 WeakPolarHBondContact CD2-CD 3.42Å; H890-P1065 WeakPolarHBondContact NE2-CD 3.41Å
891	T	74.3	Confident	52.5	Low	31 Å²	31	103.2 Å²	103.2	19%	0.19	54%	0.535	C	S	.	.			trans	-104.3	10.5	-178.8	69.9	0	0	0	0	113.3	H889 S1063 Y1309 N1310	H889-T891 PolarHBondContact O-N 3.46Å; T891-S1063 PolarHBondContact N-O 3.41Å; T891-S1063 PolarHBondContact OG1-O 3.32Å; T891-S1063 PolarHBondContact OG1-OG 3.39Å; T891-Y1309 WeakPolarHBondContact CG2-O 3.32Å; T891-N1310 WeakPolarHBondContact CG2-O 3.29Å
892	G	63.4	Low	51.4	Low	23 Å²	23	102.9 Å²	102.9	24%	0.237	54%	0.543	C	S	.	.	S	Bend	trans	-88.7	160.2	174.5	0	0	0	0	0	111.8	H890	H890-G892 PolarHBondContact CE1-O 2.94Å; H890-G892 VanDerWaalsContact CE1-O 3.24Å; H890-G892 PolarHBondContact ND1-N 2.89Å; H890-G892 PolarHBondContact ND1-O 2.92Å; H890-G892 VanDerWaalsContact ND1-O 3.13Å
893	E	57.1	Low	50.4	Low	140 Å²	140	104.2 Å²	104.2	65%	0.654	55%	0.546	S	S	*	.			trans	-61.7	139.9	-177.8	-61.7	-171.3	153.9	0	0	112.7	Q895	E893-Q895 PolarHBondContact O-N 3.27Å
894	S	46.5	Very low	50.4	Low	94 Å²	94	103.7 Å²	103.7	66%	0.657	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-72.6	8.2	-171.3	59.9	0	0	0	0	115.2	F896 T897	S894-F896 VanDerWaalsContact C-N 3.3Å; S894-T897 WeakPolarHBondContact O-CG2 3.42Å; S894-T897 PolarHBondContact O-OG1 3.26Å
895	Q	44	Very low	50.8	Low	164 Å²	164	108.8 Å²	108.8	77%	0.766	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-78.5	-14.3	178.9	-59.3	-170.1	18.1	0	0	112.8	E893	E893-Q895 PolarHBondContact O-N 3.27Å
896	F	43.1	Very low	51.8	Low	121 Å²	121	108.2 Å²	108.2	53%	0.531	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-93.7	6.7	-179.9	-70.7	-76.3	0	0	0	115	S894 N898 M899 N1066	S894-F896 VanDerWaalsContact C-N 3.3Å; F896-N898 PolarHBondContact O-N 3.22Å; F896-M899 HydrophobicContact CD1-CG 4.29Å; F896-M899 PolarHBondContact O-N 2.9Å; F896-N1066 WeakPolarHBondContact CG-ND2 3.38Å
897	T	41.8	Very low	53.1	Low	109 Å²	109	99.8 Å²	99.8	67%	0.669	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-1.6	-175.4	57.9	0	0	0	0	115.3	S894	S894-T897 WeakPolarHBondContact O-CG2 3.42Å; S894-T897 PolarHBondContact O-OG1 3.26Å
898	N	39.2	Very low	54.5	Low	158 Å²	158	94.3 Å²	94.3	85%	0.845	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	3.3	174	-70.7	-1.9	0	0	0	113.4	F896	F896-N898 PolarHBondContact O-N 3.22Å
899	M	38.5	Very low	55.4	Low	109 Å²	109	93.5 Å²	93.5	54%	0.537	48%	0.477	S	S	.	.	S	Bend	trans	-80.3	137.1	167.9	-62.8	-65.2	-73.5	0	0	109.2	F896	F896-M899 HydrophobicContact CD1-CG 4.29Å; F896-M899 PolarHBondContact O-N 2.9Å
900	D	38.2	Very low	56.5	Low	116 Å²	116	89.7 Å²	89.7	62%	0.62	46%	0.46	S	S	*	.			trans	-43.5	138	-169	-73.3	-53.9	0	0	0	115.1	S902 F903	D900-S902 WeakPolarHBondContact CB-OG 3.28Å; D900-S902 PolarHBondContact O-N 2.99Å; D900-F903 HydrophobicContact CB-CD2 4.37Å; D900-F903 WeakPolarHBondContact O-CD2 3.28Å; D900-F903 PolarHBondContact O-N 3.34Å; D900-F903 VanDerWaalsContact O-N 3.14Å
901	E	40.7	Very low	57.3	Low	186 Å²	186	85.7 Å²	85.7	87%	0.869	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-54	-17.4	170.7	-62.3	-174.3	133.7	0	0	113	F903 H904	E901-F903 PolarHBondContact O-N 3.33Å; E901-H904 PolarHBondContact O-N 3.07Å
902	S	40.8	Very low	58	Low	84 Å²	84	84.2 Å²	84.2	59%	0.587	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-57.4	-22.8	175.2	77.2	0	0	0	0	115.3	D900	D900-S902 WeakPolarHBondContact CB-OG 3.28Å; D900-S902 PolarHBondContact O-N 2.99Å
903	F	38.5	Very low	59.3	Low	103 Å²	103	83.1 Å²	83.1	45%	0.452	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-75.7	-21.3	-179.1	-76	-78.8	0	0	0	113.8	D900 E901 K905	D900-F903 HydrophobicContact CB-CD2 4.37Å; D900-F903 WeakPolarHBondContact O-CD2 3.28Å; D900-F903 PolarHBondContact O-N 3.34Å; D900-F903 VanDerWaalsContact O-N 3.14Å; E901-F903 PolarHBondContact O-N 3.33Å; F903-K905 PolarHBondContact O-N 3.08Å
904	H	49.3	Very low	60.8	Low	96 Å²	96	77.2 Å²	77.2	44%	0.444	39%	0.394	S	S	.	.			trans	-79.9	62.4	178.1	-84.4	-71.9	0	0	0	112.9	E901 D906	E901-H904 PolarHBondContact O-N 3.07Å; H904-D906 PolarHBondContact O-N 3.29Å
905	K	55.1	Low	62.8	Low	169 Å²	169	73.2 Å²	73.2	74%	0.735	37%	0.366	S	S	*	.			trans	-55.9	124	167.1	-73	-179.3	179.3	173.7	0	110	F903 R1061	F903-K905 PolarHBondContact O-N 3.08Å; K905-R1061 VanDerWaalsContact O-CZ 3.26Å; K905-R1061 PolarHBondContact O-NE 3.22Å; K905-R1061 PolarHBondContact O-NH2 3.41Å
906	D	68.7	Low	64.8	Low	28 Å²	28	65.5 Å²	65.5	15%	0.15	33%	0.33	C	S	.	.			trans	-79.9	-179.7	178	-149.6	-0.8	0	0	0	112.6	H904 A990 R1061	H904-D906 PolarHBondContact O-N 3.29Å; D906-A990 WeakPolarHBondContact OD2-CB 3.49Å; D906-R1061 IonicContact OD1-CZ 3.23Å; D906-R1061 IonicContact OD1-NH1 3.89Å; D906-R1061 PolarHBondContact OD1-NH1 2.69Å; D906-R1061 IonicContact OD1-NH2 3Å; D906-R1061 PolarHBondContact OD1-NH2 2.65Å
907	W	79.5	Confident	66.6	Low	14 Å²	14	61.7 Å²	61.7	5%	0.053	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-54.5	139.7	174.2	-71.1	99.3	0	0	0	111.6	H909 H1059 R1061 K1315 R1317	W907-H909 PolarHBondContact O-CD2 3.05Å; W907-H909 PolarHBondContact O-N 2.94Å; W907-H1059 HydrophobicContact CE3-CB 4.24Å; W907-H1059 AromaticContact CE3-ND1 3.19Å; W907-H1059 HydrophobicContact CZ3-CB 4.05Å; W907-H1059 AromaticContact CZ3-ND1 3.53Å; W907-R1061 VanDerWaalsContact CD1-NH1 3.34Å; W907-R1061 HydrophobicContact CH2-CB 4.05Å; W907-R1061 HydrophobicContact CZ2-CB 4.29Å; W907-K1315 HydrophobicContact CH2-CB 4.3Å; W907-K1315 HydrophobicContact CH2-CG 3.96Å; W907-K1315 HydrophobicContact CZ2-CB 4.33Å; W907-K1315 HydrophobicContact CZ2-CD 4.24Å; W907-K1315 HydrophobicContact CZ2-CG 3.95Å; W907-R1317 HydrophobicContact CE3-CB 3.86Å; W907-R1317 HydrophobicContact CH2-CB 4.09Å; W907-R1317 HydrophobicContact CZ3-CB 3.36Å
908	I	82.9	Confident	67.9	Low	28 Å²	28	56.9 Å²	56.9	14%	0.144	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-67.9	124.5	174	-54.4	-156.2	0	0	0	109.7	L910 I984 C1090 Y1092	I908-L910 HydrophobicContact CG2-CD2 4.15Å; I908-I984 HydrophobicContact CG2-CG2 3.77Å; I908-C1090 HydrophobicContact CD1-CB 3.92Å; I908-C1090 WeakPolarHBondContact CD1-SG 3.3Å; I908-Y1092 HydrophobicContact CD1-CD1 4.2Å; I908-Y1092 HydrophobicContact CD1-CE1 3.59Å
909	H	84.8	Confident	68.8	Low	14 Å²	14	50 Å²	50	7%	0.065	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	129.1	176.1	-69.6	-90.9	0	0	0	110.2	Y879 W907 V985 I992	Y879-H909 HydrophobicContact CE2-CB 4.4Å; Y879-H909 AromaticContact CZ-ND1 3.88Å; Y879-H909 PolarHBondContact OH-ND1 2.78Å; W907-H909 PolarHBondContact O-CD2 3.05Å; W907-H909 PolarHBondContact O-N 2.94Å; H909-V985 HydrophobicContact CB-CB 4.21Å; H909-V985 PolarHBondContact O-N 2.92Å; H909-I992 HydrophobicContact CB-CD1 3.98Å; H909-I992 VanDerWaalsContact CD2-CD1 3.43Å; H909-I992 WeakPolarHBondContact CD2-CD1 3.46Å
910	L	88.2	Confident	69.4	Low	10 Å²	10	48.4 Å²	48.4	5%	0.052	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	138.7	-177	-61.5	178.2	0	0	0	111.3	Y879 I908 R913 L982 G983 I984 F1026 I1319	Y879-L910 WeakPolarHBondContact CD2-O 3.13Å; I908-L910 HydrophobicContact CG2-CD2 4.15Å; L910-R913 HydrophobicContact CD1-CB 4.4Å; L910-L982 HydrophobicContact CD2-CD2 4.17Å; L910-G983 CarbonylContact C-O 3.56Å; L910-G983 WeakPolarHBondContact CA-O 3.14Å; L910-I984 HydrophobicContact CD2-CG1 3.92Å; L910-F1026 HydrophobicContact CB-CD2 4.43Å; L910-F1026 HydrophobicContact CB-CE2 3.69Å; L910-F1026 HydrophobicContact CB-CZ 3.98Å; L910-I1319 HydrophobicContact CD1-CD1 4.07Å; L910-I1319 HydrophobicContact CD1-CG2 4.37Å
911	L	88.2	Confident	69.7	Low	2 Å²	2	46.5 Å²	46.5	1%	0.01	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-45.7	173	-60.5	179.1	0	0	0	111.3	Y879 L939 T941 V943 G983 V985 W997	Y879-L911 HydrophobicContact CD2-CD2 4.2Å; Y879-L911 HydrophobicContact CG-CD2 4.04Å; L911-L939 HydrophobicContact CD1-CD2 4.32Å; L911-T941 HydrophobicContact CD1-CG2 4.48Å; L911-V943 HydrophobicContact CD2-CB 4.49Å; L911-V943 HydrophobicContact CD2-CG2 4.23Å; L911-G983 PolarHBondContact N-O 2.88Å; L911-V985 HydrophobicContact CD1-CG2 4.29Å; L911-V985 HydrophobicContact CD2-CG2 3.75Å; L911-V985 HydrophobicContact CG-CG2 3.84Å; L911-W997 HydrophobicContact CB-CG 4.19Å; L911-W997 HydrophobicContact CD1-CB 4.42Å; L911-W997 PolarHBondContact O-NE1 2.95Å
912	F	90.3	Very high	70	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	155.5	175.8	50.4	-93.8	0	0	0	109.4	L939 I948 L981 L982 G983 W997 L999 L1022 C1023	F912-L939 HydrophobicContact CE1-CD1 3.86Å; F912-L939 HydrophobicContact CZ-CD1 4.42Å; F912-I948 HydrophobicContact CZ-CG1 4.35Å; F912-L981 HydrophobicContact CD2-CG 4.23Å; F912-L981 HydrophobicContact CE2-CD1 3.85Å; F912-L981 HydrophobicContact CE2-CD2 4.38Å; F912-L981 HydrophobicContact CE2-CG 3.86Å; F912-L982 VanDerWaalsContact CE2-C 3.48Å; F912-G983 PolarHBondContact O-N 3.36Å; F912-W997 HydrophobicContact CB-CH2 3.77Å; F912-W997 HydrophobicContact CB-CZ2 3.62Å; F912-W997 HydrophobicContact CB-CZ3 4.46Å; F912-W997 AromaticContact CD1-CD2 3.76Å; F912-W997 HydrophobicContact CD1-CD2 3.76Å; F912-W997 AromaticContact CD1-CE2 3.85Å; F912-W997 AromaticContact CD1-CE3 3.65Å; F912-W997 HydrophobicContact CD1-CE3 3.65Å; F912-W997 HydrophobicContact CD1-CG 4.48Å; F912-W997 AromaticContact CD1-CH2 3.84Å; F912-W997 HydrophobicContact CD1-CH2 3.84Å; F912-W997 AromaticContact CD1-CZ2 3.9Å; F912-W997 HydrophobicContact CD1-CZ2 3.9Å; F912-W997 AromaticContact CD1-CZ3 3.7Å; F912-W997 HydrophobicContact CD1-CZ3 3.7Å; F912-W997 HydrophobicContact CE1-CD2 4.35Å; F912-W997 HydrophobicContact CE1-CE3 4.04Å; F912-W997 HydrophobicContact CE1-CZ3 4.3Å; F912-W997 HydrophobicContact CG-CH2 4.09Å; F912-W997 HydrophobicContact CG-CZ2 4.21Å; F912-W997 HydrophobicContact CG-CZ3 4.3Å; F912-L999 HydrophobicContact CE1-CB 4.4Å; F912-L999 HydrophobicContact CE2-CD2 4.01Å; F912-L999 HydrophobicContact CZ-CB 4.49Å; F912-L999 HydrophobicContact CZ-CD1 4.38Å; F912-L999 HydrophobicContact CZ-CD2 3.9Å; F912-L999 HydrophobicContact CZ-CG 4.49Å; F912-L1022 HydrophobicContact CB-CB 4.28Å; F912-L1022 HydrophobicContact CD2-CD1 3.99Å; F912-L1022 HydrophobicContact CE2-CD1 4.48Å; F912-L1022 HydrophobicContact CG-CD1 4.25Å; F912-C1023 VanDerWaalsContact CA-O 3.26Å; F912-C1023 WeakPolarHBondContact CA-O 3.24Å
913	R	89.4	Confident	70	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	123.9	172.3	-171.8	-161.8	68.6	172.9	4.6	110.9	L910 L981 L982 C1023 F1026 L1055 I1056 T1057 I1319 N1321	L910-R913 HydrophobicContact CD1-CB 4.4Å; R913-L981 WeakPolarHBondContact CA-O 3.4Å; R913-L982 HydrophobicContact CG-CD2 3.81Å; R913-L982 HydrophobicContact CG-CG 3.96Å; R913-C1023 PolarHBondContact N-O 2.94Å; R913-C1023 WeakPolarHBondContact O-CB 3.46Å; R913-F1026 HydrophobicContact CB-CE1 3.77Å; R913-F1026 HydrophobicContact CB-CZ 4.3Å; R913-L1055 HydrophobicContact CG-CD2 3.87Å; R913-L1055 PolarHBondContact NH1-O 3.23Å; R913-L1055 PolarHBondContact NH2-O 3.42Å; R913-I1056 VanDerWaalsContact NH1-CA 3.31Å; R913-T1057 VanDerWaalsContact CD-OG1 3.28Å; R913-T1057 WeakPolarHBondContact CD-OG1 3.21Å; R913-T1057 VanDerWaalsContact NH1-N 3.15Å; R913-T1057 PolarHBondContact NH1-OG1 2.96Å; R913-I1319 PolarHBondContact NH1-O 3.4Å; R913-N1321 PolarHBondContact NH2-OD1 2.87Å
914	D	89.2	Confident	69.8	Low	16 Å²	16	47 Å²	47	9%	0.086	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	167.6	177.9	-131.6	-50.4	0	0	0	112.9	L981 P1015 L1022 C1023	D914-L981 PolarHBondContact N-O 2.87Å; D914-L981 PolarHBondContact O-N 3.17Å; D914-P1015 HydrophobicContact CB-CB 4.19Å; D914-L1022 HydrophobicContact CB-CB 4.43Å; D914-L1022 HydrophobicContact CB-CD2 3.52Å; D914-L1022 WeakPolarHBondContact OD2-CA 3.37Å; D914-C1023 PolarHBondContact OD2-N 3.43Å
915	C	87.6	Confident	68.8	Low	11 Å²	11	48.8 Å²	48.8	7%	0.074	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	112.7	173.4	-171.3	0	0	0	0	110.8	Y917 N953 P1015 I1016 I1095	C915-Y917 HydrophobicContact CB-CE2 4.15Å; C915-Y917 WeakPolarHBondContact SG-CE2 3.45Å; C915-N953 PolarHBondContact SG-ND2 2.91Å; C915-P1015 VanDerWaalsContact O-CA 3.31Å; C915-P1015 WeakPolarHBondContact O-CA 3.5Å; C915-I1016 PolarHBondContact O-N 2.98Å; C915-I1095 HydrophobicContact CB-CD1 4.47Å
916	I	87	Confident	67.7	Low	2 Å²	2	46.5 Å²	46.5	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	138.5	-176.6	59.5	162.8	0	0	0	112.4	F937 Y979 L981 P1013 K1014 P1015 L1022	I916-F937 HydrophobicContact CD1-CE1 4.22Å; I916-F937 HydrophobicContact CD1-CZ 4.26Å; I916-Y979 VanDerWaalsContact CG1-O 3.26Å; I916-Y979 WeakPolarHBondContact CG1-O 3.33Å; I916-Y979 PolarHBondContact N-O 3.29Å; I916-Y979 PolarHBondContact O-N 3.49Å; I916-L981 HydrophobicContact CD1-CB 4.11Å; I916-L981 HydrophobicContact CD1-CD2 4.08Å; I916-L981 HydrophobicContact CG1-CB 4.03Å; I916-L981 HydrophobicContact CG2-CB 4.39Å; I916-L981 HydrophobicContact CG2-CD2 4.09Å; I916-P1013 HydrophobicContact CB-CB 4.28Å; I916-P1013 HydrophobicContact CD1-CB 3.94Å; I916-K1014 WeakPolarHBondContact CA-O 3.43Å; I916-P1015 HydrophobicContact CG2-CB 4.41Å; I916-L1022 HydrophobicContact CG2-CD2 4.12Å
917	Y	81	Confident	65.8	Low	41 Å²	41	54.3 Å²	54.3	16%	0.161	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	140.9	-177.5	-67.3	-104	0	0	0	110.8	C915 H977 P1013 K1014 I1016	C915-Y917 HydrophobicContact CB-CE2 4.15Å; C915-Y917 WeakPolarHBondContact SG-CE2 3.45Å; Y917-H977 PolarHBondContact OH-O 2.84Å; Y917-H977 VanDerWaalsContact OH-O 3.08Å; Y917-P1013 VanDerWaalsContact O-CA 3.24Å; Y917-P1013 WeakPolarHBondContact O-CA 3.3Å; Y917-K1014 PolarHBondContact N-O 2.97Å; Y917-K1014 PolarHBondContact O-N 3.19Å; Y917-I1016 HydrophobicContact CD1-CD1 4.31Å; Y917-I1016 HydrophobicContact CD2-CB 4.4Å; Y917-I1016 HydrophobicContact CD2-CD1 3.55Å; Y917-I1016 HydrophobicContact CD2-CG1 3.54Å; Y917-I1016 HydrophobicContact CE1-CD1 4.09Å; Y917-I1016 HydrophobicContact CE2-CB 4.14Å; Y917-I1016 HydrophobicContact CE2-CD1 3.31Å; Y917-I1016 HydrophobicContact CE2-CG1 3.59Å; Y917-I1016 HydrophobicContact CG-CD1 4.06Å; Y917-I1016 HydrophobicContact CG-CG1 4.33Å
918	S	68.7	Low	63.6	Low	7 Å²	7	60.5 Å²	60.5	5%	0.049	31%	0.311	C	S	.	.			trans	-63.7	139.6	174.1	-173.5	0	0	0	0	110.2	T920 M921	S918-T920 PolarHBondContact O-N 2.88Å; S918-M921 PolarHBondContact O-N 3.14Å
919	S	58	Low	61.4	Low	14 Å²	14	65.5 Å²	65.5	10%	0.098	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-8.9	-168.5	-171.2	0	0	0	0	114.4	N1011	S919-N1011 VanDerWaalsContact CB-C 3.44Å; S919-N1011 VanDerWaalsContact CB-CA 3.5Å; S919-N1011 WeakPolarHBondContact CB-O 2.98Å; S919-N1011 WeakPolarHBondContact OG-CA 3.13Å
920	T	52.1	Low	59.6	Low	76 Å²	76	74.2 Å²	74.2	47%	0.466	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-40.4	173	49.5	0	0	0	0	112	S918 L922 K923	S918-T920 PolarHBondContact O-N 2.88Å; T920-L922 PolarHBondContact O-N 3.15Å; T920-K923 PolarHBondContact O-N 2.79Å
921	M	44.7	Very low	57.7	Low	76 Å²	76	81.1 Å²	81.1	37%	0.374	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-21.7	179	-86.1	-73.6	177.1	0	0	113.9	S918 K923 V974	S918-M921 PolarHBondContact O-N 3.14Å; M921-K923 VanDerWaalsContact C-N 3.33Å; M921-K923 PolarHBondContact O-N 2.87Å; M921-V974 HydrophobicContact CE-CG1 3.67Å; M921-V974 HydrophobicContact CG-CG1 4.02Å
922	L	46.7	Very low	56.3	Low	105 Å²	105	86.7 Å²	86.7	55%	0.55	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-3.5	-178.1	-83	165.1	0	0	0	114.4	T920 K1014	T920-L922 PolarHBondContact O-N 3.15Å; L922-K1014 HydrophobicContact CD1-CD 4.44Å
923	K	41	Very low	55	Low	135 Å²	135	88.6 Å²	88.6	59%	0.587	45%	0.448	S	S	*	.			trans	-118.2	89.2	176.3	-75	-177.6	177.4	174.2	0	110.6	T920 M921 E925	T920-K923 PolarHBondContact O-N 2.79Å; M921-K923 VanDerWaalsContact C-N 3.33Å; M921-K923 PolarHBondContact O-N 2.87Å; K923-E925 PolarHBondContact O-N 3.41Å
924	N	33	Very low	54.4	Low	144 Å²	144	94 Å²	94	77%	0.77	47%	0.472	S	S	*	.			trans	-69	64.8	167.3	-87	-24.6	0	0	0	112
925	E	29.4	Very low	54.1	Low	133 Å²	133	93.4 Å²	93.4	62%	0.621	47%	0.468	S	S	*	.	S	Bend	trans	-176.2	147.2	148.2	-105.3	158.2	-175.6	0	0	111.7	K923 K1125	K923-E925 PolarHBondContact O-N 3.41Å; E925-K1125 IonicContact OE1-NZ 3.38Å; E925-K1125 PolarHBondContact OE1-NZ 3.27Å
926	V	31.8	Very low	53.9	Low	120 Å²	120	92.9 Å²	92.9	73%	0.727	47%	0.465	S	S	*	.			trans	72.9	110	-176.8	-163.2	0	0	0	0	115.8	I928	V926-I928 HydrophobicContact CG1-CD1 4.26Å; V926-I928 HydrophobicContact CG1-CG1 3.79Å; V926-I928 PolarHBondContact O-N 2.96Å
927	M	28.1	Very low	54	Low	192 Å²	192	92.8 Å²	92.8	95%	0.946	47%	0.465	S	S	*	.			trans	-64.5	113.3	161.1	-71.6	-80.8	-73.1	0	0	109.4
928	I	33.5	Very low	54.2	Low	144 Å²	144	93.1 Å²	93.1	74%	0.738	47%	0.466	S	S	*	.			trans	-120.5	142.1	164	-55.2	-175.9	0	0	0	106.8	V926	V926-I928 HydrophobicContact CG1-CD1 4.26Å; V926-I928 HydrophobicContact CG1-CG1 3.79Å; V926-I928 PolarHBondContact O-N 2.96Å
929	N	36.2	Very low	55.1	Low	133 Å²	133	93.5 Å²	93.5	71%	0.711	47%	0.467	S	S	*	.			trans	-45.9	155.7	-164.5	-55.9	-21.3	0	0	0	115.8	E931	N929-E931 PolarHBondContact O-N 2.91Å
930	E	46.7	Very low	56.5	Low	197 Å²	197	98.6 Å²	98.6	92%	0.921	49%	0.487	S	S	*	.			trans	-69.6	50.1	178.4	-56.7	-177	127.1	0	0	113.9	E932	E930-E932 PolarHBondContact O-N 3.35Å
931	E	48.8	Very low	58.2	Low	155 Å²	155	96.9 Å²	96.9	72%	0.724	48%	0.477	S	S	*	.			trans	-66.9	117.5	174.3	-66	-170.7	170.8	0	0	109.9	N929 V933	N929-E931 PolarHBondContact O-N 2.91Å; E931-V933 WeakPolarHBondContact O-CG2 3.04Å; E931-V933 PolarHBondContact O-N 3.28Å
932	E	58.7	Low	60.1	Low	120 Å²	120	97.9 Å²	97.9	56%	0.561	49%	0.487	S	S	*	.			trans	-65	91.5	-178.2	-67.9	-168.9	104.5	0	0	111.8	E930 K934 N971	E930-E932 PolarHBondContact O-N 3.35Å; E932-K934 PolarHBondContact O-N 2.76Å; E932-N971 HydrophobicContact CB-CB 4.28Å; E932-N971 PolarHBondContact OE1-ND2 2.77Å; E932-N971 PolarHBondContact OE2-ND2 3.42Å
933	V	64.2	Low	61.7	Low	40 Å²	40	93.2 Å²	93.2	24%	0.242	46%	0.463	C	S	.	.			trans	-65.7	119.2	-179.8	-167.5	0	0	0	0	110.1	E931 Y935 P1004	E931-V933 WeakPolarHBondContact O-CG2 3.04Å; E931-V933 PolarHBondContact O-N 3.28Å; V933-Y935 HydrophobicContact CB-CE1 4.41Å; V933-Y935 HydrophobicContact CB-CE2 3.86Å; V933-Y935 HydrophobicContact CG1-CD1 4.37Å; V933-Y935 HydrophobicContact CG1-CE1 3.57Å; V933-Y935 HydrophobicContact CG1-CE2 3.92Å; V933-Y935 WeakPolarHBondContact CG1-OH 3.35Å; V933-Y935 WeakPolarHBondContact O-CD2 3.05Å; V933-Y935 WeakPolarHBondContact O-CE2 3.28Å; V933-P1004 HydrophobicContact CG1-CG 3.62Å
934	K	75.4	Confident	63.6	Low	113 Å²	113	89.2 Å²	89.2	49%	0.491	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	125.6	179.6	-80.8	169.3	-177.6	166.9	0	111.4	E932 W969 L970 N971 P1004	E932-K934 PolarHBondContact O-N 2.76Å; K934-W969 HydrophobicContact CB-CE3 4.09Å; K934-L970 WeakPolarHBondContact CA-O 3.47Å; K934-N971 WeakPolarHBondContact CE-OD1 3.32Å; K934-N971 WeakPolarHBondContact CG-OD1 3.3Å; K934-P1004 VanDerWaalsContact O-CD 3.29Å; K934-P1004 WeakPolarHBondContact O-CD 3.23Å
935	Y	83.6	Confident	65.9	Low	3 Å²	3	87.1 Å²	87.1	1%	0.012	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	153.5	177.1	-55.3	-72	0	0	0	111	V933 W969 L970 L972 L1002 N1011 L1012 P1013	V933-Y935 HydrophobicContact CB-CE1 4.41Å; V933-Y935 HydrophobicContact CB-CE2 3.86Å; V933-Y935 HydrophobicContact CG1-CD1 4.37Å; V933-Y935 HydrophobicContact CG1-CE1 3.57Å; V933-Y935 HydrophobicContact CG1-CE2 3.92Å; V933-Y935 WeakPolarHBondContact CG1-OH 3.35Å; V933-Y935 WeakPolarHBondContact O-CD2 3.05Å; V933-Y935 WeakPolarHBondContact O-CE2 3.28Å; Y935-W969 CarbonylContact O-C 3.58Å; Y935-W969 WeakPolarHBondContact O-CA 3.43Å; Y935-L970 PolarHBondContact N-O 2.83Å; Y935-L970 PolarHBondContact O-N 2.79Å; Y935-L972 HydrophobicContact CD2-CB 3.83Å; Y935-L972 HydrophobicContact CD2-CD1 3.75Å; Y935-L972 HydrophobicContact CD2-CG 3.81Å; Y935-L972 HydrophobicContact CE2-CB 3.99Å; Y935-L972 HydrophobicContact CE2-CD1 4.37Å; Y935-L972 HydrophobicContact CE2-CG 4.45Å; Y935-L972 HydrophobicContact CG-CD1 4.41Å; Y935-L1002 CarbonylContact C-O 3.5Å; Y935-L1002 VanDerWaalsContact CA-O 3.3Å; Y935-L1002 WeakPolarHBondContact CA-O 3.34Å; Y935-N1011 PolarHBondContact OH-O 2.96Å; Y935-L1012 HydrophobicContact CD1-CD2 4.34Å; Y935-P1013 HydrophobicContact CD1-CG 4.11Å; Y935-P1013 HydrophobicContact CD2-CG 4.3Å; Y935-P1013 HydrophobicContact CE1-CG 4Å; Y935-P1013 HydrophobicContact CE2-CG 4.16Å; Y935-P1013 HydrophobicContact CG-CG 4.23Å
936	S	83.6	Confident	68.7	Low	1 Å²	1	81.6 Å²	81.6	1%	0.007	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	146.1	172.1	-165.1	0	0	0	0	111.3	S968 L1002	S936-S968 WeakPolarHBondContact CB-O 3.33Å; S936-S968 PolarHBondContact OG-O 2.93Å; S936-L1002 PolarHBondContact N-O 2.81Å; S936-L1002 PolarHBondContact O-N 3.37Å
937	F	88.4	Confident	71.5	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	123	-173.8	-63.4	-105.4	0	0	0	108.9	I916 I948 L950 P961 L970 L972 L981 L999 L1001	I916-F937 HydrophobicContact CD1-CE1 4.22Å; I916-F937 HydrophobicContact CD1-CZ 4.26Å; F937-I948 HydrophobicContact CB-CD1 3.65Å; F937-I948 HydrophobicContact CD1-CD1 4.48Å; F937-I948 HydrophobicContact CG-CD1 4.43Å; F937-L950 HydrophobicContact CD1-CD1 4.48Å; F937-L950 HydrophobicContact CE1-CD1 3.78Å; F937-L950 HydrophobicContact CE2-CD1 4.3Å; F937-L950 HydrophobicContact CE2-CD2 4.4Å; F937-L950 HydrophobicContact CZ-CD1 3.69Å; F937-L950 HydrophobicContact CZ-CD2 4.02Å; F937-P961 HydrophobicContact CB-CB 4.26Å; F937-P961 HydrophobicContact CD2-CB 4.35Å; F937-P961 HydrophobicContact CD2-CG 4.23Å; F937-P961 HydrophobicContact CG-CG 4.45Å; F937-L970 HydrophobicContact CD2-CD1 4.32Å; F937-L970 HydrophobicContact CE2-CD1 4.31Å; F937-L972 HydrophobicContact CE2-CD1 4.37Å; F937-L972 HydrophobicContact CZ-CD1 4.22Å; F937-L981 HydrophobicContact CD1-CD1 4.39Å; F937-L981 HydrophobicContact CE1-CD1 4.13Å; F937-L981 HydrophobicContact CE1-CD2 4.47Å; F937-L999 HydrophobicContact CB-CD1 4.43Å; F937-L1001 HydrophobicContact CD1-CD1 3.67Å; F937-L1001 HydrophobicContact CD2-CD1 4.35Å; F937-L1001 HydrophobicContact CE1-CD1 3.48Å; F937-L1001 VanDerWaalsContact CE1-CD1 3.48Å; F937-L1001 HydrophobicContact CE2-CD1 4.19Å; F937-L1001 HydrophobicContact CG-CD1 4.11Å; F937-L1001 HydrophobicContact CZ-CD1 3.76Å
938	R	85.5	Confident	74.5	Confident	48 Å²	48	68.3 Å²	68.3	18%	0.181	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	110.8	176	-64.9	-172.7	169.6	-145.1	-4.1	109.8	D547 Y967 L999 Q1000 L1002	D547-R938 IonicContact OD1-NH1 2.89Å; D547-R938 IonicContact OD1-NH2 2.78Å; D547-R938 IonicContact OD2-NH1 3.27Å; D547-R938 PolarHBondContact OD2-NH1 2.98Å; R938-Y967 HydrophobicContact CB-CD1 4.41Å; R938-Y967 HydrophobicContact CB-CE1 4.09Å; R938-Y967 HydrophobicContact CG-CD1 3.76Å; R938-Y967 HydrophobicContact CG-CD2 4.09Å; R938-Y967 HydrophobicContact CG-CE1 3.7Å; R938-Y967 HydrophobicContact CG-CE2 4.04Å; R938-Y967 HydrophobicContact CG-CG 3.95Å; R938-Y967 VanDerWaalsContact NE-CE2 3.31Å; R938-L999 WeakPolarHBondContact O-CA 3.25Å; R938-Q1000 HydrophobicContact CB-CB 3.94Å; R938-Q1000 PolarHBondContact N-O 2.88Å; R938-Q1000 PolarHBondContact O-N 2.71Å; R938-L1002 HydrophobicContact CG-CD1 3.97Å
939	L	88.6	Confident	77.2	Confident	15 Å²	15	61.9 Å²	61.9	8%	0.079	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	127.1	172.6	-175.1	60.4	0	0	0	110.4	L911 F912 T941 I948 I963 W997 L999	L911-L939 HydrophobicContact CD1-CD2 4.32Å; F912-L939 HydrophobicContact CE1-CD1 3.86Å; F912-L939 HydrophobicContact CZ-CD1 4.42Å; L939-T941 HydrophobicContact CD2-CG2 4.04Å; L939-T941 HydrophobicContact CG-CG2 3.95Å; L939-I948 HydrophobicContact CB-CD1 4.15Å; L939-I948 HydrophobicContact CB-CG1 4.32Å; L939-I948 HydrophobicContact CD2-CG1 4.28Å; L939-I963 HydrophobicContact CB-CB 4.29Å; L939-I963 HydrophobicContact CB-CG2 3.67Å; L939-W997 HydrophobicContact CD1-CB 4.35Å; L939-L999 HydrophobicContact CB-CD1 4.44Å; L939-L999 HydrophobicContact CD1-CB 4.47Å
940	K	86.5	Confident	79.8	Confident	120 Å²	120	55.5 Å²	55.5	52%	0.522	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	121.2	166.2	-66.8	-175.4	178.1	-176.7	0	108	W997 N998	K940-W997 CarbonylContact O-C 3.59Å; K940-W997 WeakPolarHBondContact O-CA 3.37Å; K940-N998 PolarHBondContact N-O 2.77Å; K940-N998 PolarHBondContact O-N 3.29Å
941	T	87.9	Confident	81.9	Confident	40 Å²	40	46.9 Å²	46.9	25%	0.245	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	152.6	-175.8	173.5	0	0	0	0	111.7	L911 L939 V943 S946 K996	L911-T941 HydrophobicContact CD1-CG2 4.48Å; L939-T941 HydrophobicContact CD2-CG2 4.04Å; L939-T941 HydrophobicContact CG-CG2 3.95Å; T941-V943 VanDerWaalsContact C-N 3.33Å; T941-V943 PolarHBondContact OG1-N 3.31Å; T941-S946 WeakPolarHBondContact CG2-OG 3.27Å; T941-K996 CarbonylContact C-O 3.56Å; T941-K996 VanDerWaalsContact CA-O 3.24Å; T941-K996 WeakPolarHBondContact CA-O 3.27Å; T941-K996 PolarHBondContact OG1-O 3.36Å
942	T	83.7	Confident	83.8	Confident	98 Å²	98	40.2 Å²	40.2	60%	0.601	21%	0.206	S	C	*	.	S	Bend	trans	-87.2	-3.7	175.5	67.3	0	0	0	0	113.1	G995 K996	T942-G995 WeakPolarHBondContact OG1-CA 3.37Å; T942-K996 PolarHBondContact N-O 2.83Å; T942-K996 PolarHBondContact OG1-N 3.14Å
943	V	81.8	Confident	85.2	Confident	7 Å²	7	36.5 Å²	36.5	4%	0.042	19%	0.19	C	C	.	.	S	Bend	trans	-96.6	120.8	-179.3	-171.3	0	0	0	0	109.2	Y879 L911 T941 S946 V985 I992	Y879-V943 HydrophobicContact CD1-CG2 4.25Å; L911-V943 HydrophobicContact CD2-CB 4.49Å; L911-V943 HydrophobicContact CD2-CG2 4.23Å; T941-V943 VanDerWaalsContact C-N 3.33Å; T941-V943 PolarHBondContact OG1-N 3.31Å; V943-S946 PolarHBondContact O-OG 3.45Å; V943-V985 HydrophobicContact CG1-CB 4.47Å; V943-V985 HydrophobicContact CG1-CG1 3.66Å; V943-V985 HydrophobicContact CG1-CG2 3.93Å; V943-I992 HydrophobicContact CG1-CG2 3.55Å
944	S	80	Confident	86.1	Confident	51 Å²	51	37.5 Å²	37.5	36%	0.357	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	155.7	-179.5	44.2	0	0	0	0	113.1	S946 V985	S944-S946 PolarHBondContact O-N 2.81Å; S944-V985 WeakPolarHBondContact O-CG1 3.45Å
945	N	82.4	Confident	86.4	Confident	100 Å²	100	36.6 Å²	36.6	54%	0.535	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	24.2	-178.9	-56.2	5.5	0	0	0	114.8	N986	N945-N986 HydrophobicContact CB-CB 4.41Å; N945-N986 WeakPolarHBondContact CB-O 3.14Å; N945-N986 PolarHBondContact ND2-O 2.94Å; N945-N986 PolarHBondContact O-N 2.88Å
946	S	87	Confident	86.2	Confident	17 Å²	17	38.7 Å²	38.7	12%	0.119	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	144.8	172.2	60.8	0	0	0	0	112.3	T941 V943 S944 I963 I984	T941-S946 WeakPolarHBondContact CG2-OG 3.27Å; V943-S946 PolarHBondContact O-OG 3.45Å; S944-S946 PolarHBondContact O-N 2.81Å; S946-I963 WeakPolarHBondContact O-CD1 3.49Å; S946-I984 CarbonylContact C-O 3.58Å; S946-I984 WeakPolarHBondContact CA-O 3.39Å
947	Y	90.1	Very high	86.2	Confident	32 Å²	32	43.6 Å²	43.6	13%	0.125	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	163.7	173.1	62.2	-81.3	0	0	0	111.9	L949 Q960 I984 N986	Y947-L949 HydrophobicContact CE2-CD1 4.24Å; Y947-Q960 HydrophobicContact CD2-CG 4.31Å; Y947-Q960 VanDerWaalsContact CD2-NE2 3.26Å; Y947-I984 HydrophobicContact CD1-CB 4.36Å; Y947-I984 HydrophobicContact CD2-CB 4.46Å; Y947-I984 HydrophobicContact CE1-CB 3.84Å; Y947-I984 HydrophobicContact CE1-CG2 3.77Å; Y947-I984 HydrophobicContact CE2-CB 3.99Å; Y947-I984 HydrophobicContact CE2-CD1 4.05Å; Y947-I984 HydrophobicContact CE2-CG1 4.43Å; Y947-I984 HydrophobicContact CE2-CG2 4.43Å; Y947-I984 PolarHBondContact N-O 3Å; Y947-I984 PolarHBondContact O-N 2.85Å; Y947-I984 WeakPolarHBondContact OH-CG2 3.22Å; Y947-N986 HydrophobicContact CD1-CB 4.2Å; Y947-N986 HydrophobicContact CE1-CB 3.73Å
948	I	91.8	Very high	86.2	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	140.7	171.2	-61.6	172	0	0	0	109	F912 F937 L939 L950 Q960 P961 I963 L981 L982 L999	F912-I948 HydrophobicContact CZ-CG1 4.35Å; F937-I948 HydrophobicContact CB-CD1 3.65Å; F937-I948 HydrophobicContact CD1-CD1 4.48Å; F937-I948 HydrophobicContact CG-CD1 4.43Å; L939-I948 HydrophobicContact CB-CD1 4.15Å; L939-I948 HydrophobicContact CB-CG1 4.32Å; L939-I948 HydrophobicContact CD2-CG1 4.28Å; I948-L950 HydrophobicContact CG2-CD1 4.19Å; I948-Q960 WeakPolarHBondContact O-CG 3.26Å; I948-P961 HydrophobicContact CB-CG 4.23Å; I948-P961 HydrophobicContact CG2-CG 3.84Å; I948-I963 HydrophobicContact CB-CG2 4.23Å; I948-I963 HydrophobicContact CD1-CG2 3.5Å; I948-I963 VanDerWaalsContact CD1-CG2 3.5Å; I948-I963 HydrophobicContact CG1-CG2 3.6Å; I948-L981 HydrophobicContact CG2-CD1 3.65Å; I948-L982 WeakPolarHBondContact CA-O 3.48Å; I948-L999 HydrophobicContact CD1-CD1 3.46Å; I948-L999 VanDerWaalsContact CD1-CD1 3.46Å; I948-L999 HydrophobicContact CG1-CD1 4.39Å
949	L	91.5	Very high	86.3	Confident	9 Å²	9	47.5 Å²	47.5	5%	0.047	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	129.2	164.3	-153.4	69.1	0	0	0	109.1	Y947 I951 I958 L982 I984 Y1092	Y947-L949 HydrophobicContact CE2-CD1 4.24Å; L949-I951 HydrophobicContact CD2-CD1 3.99Å; L949-I951 HydrophobicContact CD2-CG1 4.13Å; L949-I951 HydrophobicContact CG-CG1 4.32Å; L949-I958 HydrophobicContact CD1-CG2 3.4Å; L949-I958 VanDerWaalsContact CD1-CG2 3.4Å; L949-I958 HydrophobicContact CD2-CG2 4.02Å; L949-I958 HydrophobicContact CG-CG2 3.74Å; L949-L982 HydrophobicContact CB-CB 4.31Å; L949-L982 HydrophobicContact CB-CD1 4.32Å; L949-L982 PolarHBondContact N-O 3.38Å; L949-L982 PolarHBondContact O-N 2.92Å; L949-I984 HydrophobicContact CB-CD1 3.89Å; L949-I984 HydrophobicContact CD2-CD1 3.8Å; L949-I984 HydrophobicContact CG-CD1 4.44Å; L949-Y1092 HydrophobicContact CD2-CD1 4.15Å; L949-Y1092 HydrophobicContact CD2-CD2 4.34Å; L949-Y1092 HydrophobicContact CD2-CE1 4.48Å; L949-Y1092 HydrophobicContact CD2-CG 4.08Å
950	L	90.9	Very high	86.3	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	137	160.5	-110.7	75.4	0	0	0	108	F937 I948 I959 P961 L972 Y979 S980 L981	F937-L950 HydrophobicContact CD1-CD1 4.48Å; F937-L950 HydrophobicContact CE1-CD1 3.78Å; F937-L950 HydrophobicContact CE2-CD1 4.3Å; F937-L950 HydrophobicContact CE2-CD2 4.4Å; F937-L950 HydrophobicContact CZ-CD1 3.69Å; F937-L950 HydrophobicContact CZ-CD2 4.02Å; I948-L950 HydrophobicContact CG2-CD1 4.19Å; L950-I959 HydrophobicContact CB-CB 4Å; L950-I959 PolarHBondContact N-O 2.91Å; L950-I959 PolarHBondContact O-N 3.47Å; L950-P961 HydrophobicContact CD1-CG 4.35Å; L950-L972 HydrophobicContact CD2-CD1 4.01Å; L950-L972 HydrophobicContact CD2-CD2 3.62Å; L950-L972 HydrophobicContact CD2-CG 4.5Å; L950-Y979 HydrophobicContact CD2-CD1 4.04Å; L950-Y979 HydrophobicContact CD2-CG 4.22Å; L950-S980 CarbonylContact C-O 3.57Å; L950-S980 WeakPolarHBondContact CA-O 3.39Å; L950-L981 HydrophobicContact CD1-CB 4.44Å; L950-L981 HydrophobicContact CD1-CD1 3.6Å
951	I	90.5	Very high	86.2	Confident	16 Å²	16	47.4 Å²	47.4	8%	0.082	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	127.4	169.1	-56.6	175.4	0	0	0	107.4	L949 N953 E957 I958 Y979 S980 L982 Y1092 A1093	L949-I951 HydrophobicContact CD2-CD1 3.99Å; L949-I951 HydrophobicContact CD2-CG1 4.13Å; L949-I951 HydrophobicContact CG-CG1 4.32Å; I951-N953 PolarHBondContact O-N 3.46Å; I951-N953 PolarHBondContact O-OD1 2.84Å; I951-E957 WeakPolarHBondContact CA-O 3.17Å; I951-I958 HydrophobicContact CG1-CG1 4.29Å; I951-I958 HydrophobicContact CG1-CG2 4.49Å; I951-Y979 CarbonylContact O-C 3.59Å; I951-Y979 VanDerWaalsContact O-CA 3.25Å; I951-Y979 WeakPolarHBondContact O-CA 3.32Å; I951-S980 PolarHBondContact N-O 2.84Å; I951-S980 PolarHBondContact O-N 2.59Å; I951-L982 HydrophobicContact CD1-CD1 4Å; I951-L982 HydrophobicContact CG1-CD1 4.3Å; I951-Y1092 HydrophobicContact CD1-CG 4.41Å; I951-A1093 HydrophobicContact CD1-CB 4Å
952	N	88.7	Confident	85.6	Confident	14 Å²	14	47.8 Å²	47.8	8%	0.075	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	114.7	174.3	-179.4	-8.3	0	0	0	109.4	D954 N955 G956 E957 N975 Y979	N952-D954 VanDerWaalsContact C-N 3.28Å; N952-D954 PolarHBondContact O-N 3.27Å; N952-D954 PolarHBondContact OD1-N 3.42Å; N952-D954 VanDerWaalsContact OD1-N 3.07Å; N952-N955 WeakPolarHBondContact CB-OD1 3.5Å; N952-N955 PolarHBondContact ND2-OD1 3.16Å; N952-N955 PolarHBondContact O-N 3.08Å; N952-G956 VanDerWaalsContact O-CA 3.3Å; N952-G956 WeakPolarHBondContact O-CA 3.45Å; N952-G956 PolarHBondContact O-N 2.87Å; N952-E957 HydrophobicContact CB-CB 4.11Å; N952-E957 PolarHBondContact N-O 3.37Å; N952-N975 PolarHBondContact OD1-ND2 3.2Å; N952-Y979 HydrophobicContact CB-CD1 3.86Å; N952-Y979 HydrophobicContact CB-CE1 3.6Å
953	N	86.9	Confident	85.1	Confident	42 Å²	42	44.9 Å²	44.9	23%	0.225	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-17.7	-175.7	-57.5	-19.5	0	0	0	113.1	C915 I951 H977 G978 S980	C915-N953 PolarHBondContact SG-ND2 2.91Å; I951-N953 PolarHBondContact O-N 3.46Å; I951-N953 PolarHBondContact O-OD1 2.84Å; N953-H977 HydrophobicContact CB-CB 3.65Å; N953-H977 PolarHBondContact ND2-O 3.09Å; N953-G978 WeakPolarHBondContact CB-O 3.14Å; N953-G978 PolarHBondContact N-O 3.31Å; N953-G978 PolarHBondContact ND2-O 2.88Å; N953-S980 PolarHBondContact ND2-OG 3.27Å; N953-S980 WeakPolarHBondContact OD1-CB 3.41Å; N953-S980 PolarHBondContact OD1-N 2.69Å; N953-S980 PolarHBondContact OD1-OG 2.74Å
954	D	83.7	Confident	84.2	Confident	62 Å²	62	51.9 Å²	51.9	33%	0.332	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-29.1	177.4	-82.2	1.3	0	0	0	112.9	N952 N975 H976 H977	N952-D954 VanDerWaalsContact C-N 3.28Å; N952-D954 PolarHBondContact O-N 3.27Å; N952-D954 PolarHBondContact OD1-N 3.42Å; N952-D954 VanDerWaalsContact OD1-N 3.07Å; D954-N975 PolarHBondContact OD1-OD1 2.81Å; D954-N975 WeakPolarHBondContact OD2-CA 3.06Å; D954-N975 PolarHBondContact OD2-OD1 3.44Å; D954-H976 PolarHBondContact OD1-N 2.88Å; D954-H976 IonicContact OD2-CG 3.89Å; D954-H976 PolarHBondContact OD2-N 3.44Å; D954-H976 IonicContact OD2-ND1 2.81Å; D954-H976 PolarHBondContact OD2-ND1 3.38Å; D954-H977 IonicContact OD1-CE1 2.79Å; D954-H977 IonicContact OD1-CG 2.85Å; D954-H977 PolarHBondContact OD1-N 3.43Å; D954-H977 IonicContact OD1-ND1 3.27Å; D954-H977 PolarHBondContact OD1-ND1 2.88Å
955	N	81.6	Confident	82.7	Confident	94 Å²	94	53.2 Å²	53.2	50%	0.503	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.7	-0.6	-174	74.3	-8.9	0	0	0	115.7	N952 E957	N952-N955 WeakPolarHBondContact CB-OD1 3.5Å; N952-N955 PolarHBondContact ND2-OD1 3.16Å; N952-N955 PolarHBondContact O-N 3.08Å; N955-E957 VanDerWaalsContact C-N 3.26Å; N955-E957 PolarHBondContact ND2-OE2 3.41Å; N955-E957 PolarHBondContact O-N 3.35Å; N955-E957 WeakPolarHBondContact OD1-CB 3.31Å; N955-E957 PolarHBondContact OD1-N 2.99Å
956	G	79	Confident	80.7	Confident	46 Å²	46	51.1 Å²	51.1	47%	0.474	27%	0.271	S	S	.	.			trans	74.6	5.3	-177.7	0	0	0	0	0	115.5	N952 I958	N952-G956 VanDerWaalsContact O-CA 3.3Å; N952-G956 WeakPolarHBondContact O-CA 3.45Å; N952-G956 PolarHBondContact O-N 2.87Å; G956-I958 PolarHBondContact O-N 3.02Å
957	E	83.9	Confident	79.8	Confident	105 Å²	105	52.2 Å²	52.2	49%	0.491	27%	0.273	S	S	.	.			trans	-67.5	126.6	-175.3	-175.6	178.4	-176.1	0	0	111.9	I951 N952 N955	I951-E957 WeakPolarHBondContact CA-O 3.17Å; N952-E957 HydrophobicContact CB-CB 4.11Å; N952-E957 PolarHBondContact N-O 3.37Å; N955-E957 VanDerWaalsContact C-N 3.26Å; N955-E957 PolarHBondContact ND2-OE2 3.41Å; N955-E957 PolarHBondContact O-N 3.35Å; N955-E957 WeakPolarHBondContact OD1-CB 3.31Å; N955-E957 PolarHBondContact OD1-N 2.99Å
958	I	87.6	Confident	78.8	Confident	96 Å²	96	52.1 Å²	52.1	49%	0.492	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	120.2	-177	-52.8	-174	0	0	0	109.6	L949 I951 G956	L949-I958 HydrophobicContact CD1-CG2 3.4Å; L949-I958 VanDerWaalsContact CD1-CG2 3.4Å; L949-I958 HydrophobicContact CD2-CG2 4.02Å; L949-I958 HydrophobicContact CG-CG2 3.74Å; I951-I958 HydrophobicContact CG1-CG1 4.29Å; I951-I958 HydrophobicContact CG1-CG2 4.49Å; G956-I958 PolarHBondContact O-N 3.02Å
959	I	88.6	Confident	78.2	Confident	34 Å²	34	58.5 Å²	58.5	17%	0.174	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	130.8	179.4	-58.1	170.1	0	0	0	108.1	L950 P961 L970 Y979	L950-I959 HydrophobicContact CB-CB 4Å; L950-I959 PolarHBondContact N-O 2.91Å; L950-I959 PolarHBondContact O-N 3.47Å; I959-P961 WeakPolarHBondContact O-CD 3.43Å; I959-L970 HydrophobicContact CG2-CD1 3.9Å; I959-L970 HydrophobicContact CG2-CD2 4.01Å; I959-Y979 HydrophobicContact CD1-CE1 4.38Å
960	Q	87.6	Confident	77.7	Confident	127 Å²	127	59.7 Å²	59.7	59%	0.593	31%	0.307	S	S	*	.			trans	-114.2	97.4	177.9	-162.8	176.2	11.2	0	0	109.8	Y947 I948	Y947-Q960 HydrophobicContact CD2-CG 4.31Å; Y947-Q960 VanDerWaalsContact CD2-NE2 3.26Å; I948-Q960 WeakPolarHBondContact O-CG 3.26Å
961	P	84	Confident	77.3	Confident	5 Å²	5	62.5 Å²	62.5	3%	0.032	32%	0.322	C	S	.	.			trans	-63.9	140.4	-179.7	-20.3	32	0	0	0	112.2	F937 I948 L950 I959 I963 S968 L970	F937-P961 HydrophobicContact CB-CB 4.26Å; F937-P961 HydrophobicContact CD2-CB 4.35Å; F937-P961 HydrophobicContact CD2-CG 4.23Å; F937-P961 HydrophobicContact CG-CG 4.45Å; I948-P961 HydrophobicContact CB-CG 4.23Å; I948-P961 HydrophobicContact CG2-CG 3.84Å; L950-P961 HydrophobicContact CD1-CG 4.35Å; I959-P961 WeakPolarHBondContact O-CD 3.43Å; P961-I963 PolarHBondContact O-N 3.3Å; P961-S968 WeakPolarHBondContact CA-OG 3.44Å; P961-L970 HydrophobicContact CB-CD1 3.91Å; P961-L970 HydrophobicContact CG-CD1 3.77Å
962	S	76.7	Confident	76.6	Confident	49 Å²	49	62.2 Å²	62.2	34%	0.343	32%	0.32	S	S	.	.			trans	-70.7	105	172.4	-170.7	0	0	0	0	109.9	E964 P966 Y967 S968	S962-E964 PolarHBondContact OG-O 2.77Å; S962-P966 PolarHBondContact OG-O 2.95Å; S962-Y967 WeakPolarHBondContact O-CA 3.34Å; S962-S968 PolarHBondContact N-OG 3.33Å
963	I	72.8	Confident	76	Confident	37 Å²	37	68.6 Å²	68.6	19%	0.19	35%	0.348	C	S	.	.			trans	-79.5	-17.6	172.2	48.1	153.1	0	0	0	113.4	L939 S946 I948 P961 Y967	L939-I963 HydrophobicContact CB-CB 4.29Å; L939-I963 HydrophobicContact CB-CG2 3.67Å; S946-I963 WeakPolarHBondContact O-CD1 3.49Å; I948-I963 HydrophobicContact CB-CG2 4.23Å; I948-I963 HydrophobicContact CD1-CG2 3.5Å; I948-I963 VanDerWaalsContact CD1-CG2 3.5Å; I948-I963 HydrophobicContact CG1-CG2 3.6Å; P961-I963 PolarHBondContact O-N 3.3Å; I963-Y967 WeakPolarHBondContact O-CE1 3.4Å
964	E	63.6	Low	75.3	Confident	153 Å²	153	70.5 Å²	70.5	72%	0.715	36%	0.361	S	S	*	.	S	Bend	trans	-92.6	153.4	170.3	-64.1	-163.5	164	0	0	110.4	S962 P966	S962-E964 PolarHBondContact OG-O 2.77Å; E964-P966 CarbonylContact O-C 3.57Å; E964-P966 VanDerWaalsContact O-C 3.23Å
965	Y	47.5	Very low	74.7	Confident	80 Å²	80	67.7 Å²	67.7	31%	0.314	35%	0.345	S	S	.	.	S	Bend	trans	-75	131.8	-179.2	-174.5	-82.4	0	0	0	111.1	Y546 Y967	Y546-Y965 HydrophobicContact CD1-CD1 4.06Å; Y546-Y965 HydrophobicContact CD1-CD2 4.03Å; Y546-Y965 HydrophobicContact CD1-CE1 4.34Å; Y546-Y965 HydrophobicContact CD1-CE2 4.31Å; Y546-Y965 AromaticContact CD1-CG 3.92Å; Y546-Y965 HydrophobicContact CD1-CG 3.92Å; Y546-Y965 AromaticContact CE1-CD1 3.55Å; Y546-Y965 HydrophobicContact CE1-CD1 3.55Å; Y546-Y965 AromaticContact CE1-CD2 3.68Å; Y546-Y965 HydrophobicContact CE1-CD2 3.68Å; Y546-Y965 AromaticContact CE1-CE1 3.39Å; Y546-Y965 HydrophobicContact CE1-CE1 3.39Å; Y546-Y965 AromaticContact CE1-CE2 3.51Å; Y546-Y965 HydrophobicContact CE1-CE2 3.51Å; Y546-Y965 AromaticContact CE1-CG 3.71Å; Y546-Y965 HydrophobicContact CE1-CG 3.71Å; Y546-Y965 AromaticContact CE1-CZ 3.36Å; Y546-Y965 HydrophobicContact CE2-CD1 4.2Å; Y546-Y965 HydrophobicContact CE2-CE1 4.1Å; Y546-Y965 AromaticContact CZ-CD1 3.64Å; Y546-Y965 AromaticContact CZ-CE1 3.24Å; Y546-Y965 AromaticContact CZ-CZ 3.56Å; Y546-Y965 WeakPolarHBondContact OH-CE1 3.28Å; Y546-Y965 VanDerWaalsContact OH-CZ 3.23Å; Y546-Y965 PolarHBondContact OH-OH 2.94Å; Y965-Y967 AromaticContact CD2-CD2 3.7Å; Y965-Y967 HydrophobicContact CD2-CD2 3.7Å; Y965-Y967 AromaticContact CD2-CE2 3.72Å; Y965-Y967 HydrophobicContact CD2-CE2 3.72Å; Y965-Y967 HydrophobicContact CE2-CD2 4.37Å
966	P	41.3	Very low	74.3	Confident	55 Å²	55	69.3 Å²	69.3	36%	0.357	35%	0.35	S	S	.	.	S	Bend	cis	-79.3	128.1	7.6	30.9	-35	0	0	0	113.2	S962 E964 S968	S962-P966 PolarHBondContact OG-O 2.95Å; E964-P966 CarbonylContact O-C 3.57Å; E964-P966 VanDerWaalsContact O-C 3.23Å; P966-S968 PolarHBondContact O-N 3.24Å
967	Y	66.9	Low	74.3	Confident	41 Å²	41	72.7 Å²	72.7	16%	0.161	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-60.8	133.9	175.3	-54.8	-74.3	0	0	0	110.7	R938 S962 I963 Y965	R938-Y967 HydrophobicContact CB-CD1 4.41Å; R938-Y967 HydrophobicContact CB-CE1 4.09Å; R938-Y967 HydrophobicContact CG-CD1 3.76Å; R938-Y967 HydrophobicContact CG-CD2 4.09Å; R938-Y967 HydrophobicContact CG-CE1 3.7Å; R938-Y967 HydrophobicContact CG-CE2 4.04Å; R938-Y967 HydrophobicContact CG-CG 3.95Å; R938-Y967 VanDerWaalsContact NE-CE2 3.31Å; S962-Y967 WeakPolarHBondContact O-CA 3.34Å; I963-Y967 WeakPolarHBondContact O-CE1 3.4Å; Y965-Y967 AromaticContact CD2-CD2 3.7Å; Y965-Y967 HydrophobicContact CD2-CD2 3.7Å; Y965-Y967 AromaticContact CD2-CE2 3.72Å; Y965-Y967 HydrophobicContact CD2-CE2 3.72Å; Y965-Y967 HydrophobicContact CE2-CD2 4.37Å
968	S	69.8	Low	74.4	Confident	30 Å²	30	67.7 Å²	67.7	21%	0.21	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-69.6	132.7	176.1	55.3	0	0	0	0	110.5	S936 P961 S962 P966	S936-S968 WeakPolarHBondContact CB-O 3.33Å; S936-S968 PolarHBondContact OG-O 2.93Å; P961-S968 WeakPolarHBondContact CA-OG 3.44Å; S962-S968 PolarHBondContact N-OG 3.33Å; P966-S968 PolarHBondContact O-N 3.24Å
969	W	80	Confident	74.5	Confident	133 Å²	133	63.5 Å²	63.5	50%	0.504	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	125.9	161.1	-70.4	86	0	0	0	108.2	L870 K934 Y935 L1002	L870-W969 HydrophobicContact CD1-CH2 4.2Å; L870-W969 HydrophobicContact CD2-CH2 4.49Å; K934-W969 HydrophobicContact CB-CE3 4.09Å; Y935-W969 CarbonylContact O-C 3.58Å; Y935-W969 WeakPolarHBondContact O-CA 3.43Å; W969-L1002 HydrophobicContact CH2-CB 4.39Å
970	L	80.4	Confident	74.6	Confident	34 Å²	34	61.9 Å²	61.9	18%	0.178	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	129.7	-173.3	-67.2	168	0	0	0	109.8	K934 Y935 F937 I959 P961 L972	K934-L970 WeakPolarHBondContact CA-O 3.47Å; Y935-L970 PolarHBondContact N-O 2.83Å; Y935-L970 PolarHBondContact O-N 2.79Å; F937-L970 HydrophobicContact CD2-CD1 4.32Å; F937-L970 HydrophobicContact CE2-CD1 4.31Å; I959-L970 HydrophobicContact CG2-CD1 3.9Å; I959-L970 HydrophobicContact CG2-CD2 4.01Å; P961-L970 HydrophobicContact CB-CD1 3.91Å; P961-L970 HydrophobicContact CG-CD1 3.77Å; L970-L972 HydrophobicContact CB-CD2 4.5Å; L970-L972 PolarHBondContact O-N 2.89Å
971	N	81.3	Confident	74.8	Confident	59 Å²	59	55.9 Å²	55.9	32%	0.316	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	110	164.7	-61.5	1.8	0	0	0	107.1	E932 K934	E932-N971 HydrophobicContact CB-CB 4.28Å; E932-N971 PolarHBondContact OE1-ND2 2.77Å; E932-N971 PolarHBondContact OE2-ND2 3.42Å; K934-N971 WeakPolarHBondContact CE-OD1 3.32Å; K934-N971 WeakPolarHBondContact CG-OD1 3.3Å
972	L	77.1	Confident	75.2	Confident	10 Å²	10	55.6 Å²	55.6	5%	0.052	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-94.9	117.2	169.8	-61.8	-179.3	0	0	0	108.3	Y935 F937 L950 L970 Y979 P1013	Y935-L972 HydrophobicContact CD2-CB 3.83Å; Y935-L972 HydrophobicContact CD2-CD1 3.75Å; Y935-L972 HydrophobicContact CD2-CG 3.81Å; Y935-L972 HydrophobicContact CE2-CB 3.99Å; Y935-L972 HydrophobicContact CE2-CD1 4.37Å; Y935-L972 HydrophobicContact CE2-CG 4.45Å; Y935-L972 HydrophobicContact CG-CD1 4.41Å; F937-L972 HydrophobicContact CE2-CD1 4.37Å; F937-L972 HydrophobicContact CZ-CD1 4.22Å; L950-L972 HydrophobicContact CD2-CD1 4.01Å; L950-L972 HydrophobicContact CD2-CD2 3.62Å; L950-L972 HydrophobicContact CD2-CG 4.5Å; L970-L972 HydrophobicContact CB-CD2 4.5Å; L970-L972 PolarHBondContact O-N 2.89Å; L972-Y979 HydrophobicContact CB-CE2 4.06Å; L972-Y979 HydrophobicContact CD2-CE1 4.15Å; L972-Y979 HydrophobicContact CD2-CE2 4.39Å; L972-P1013 HydrophobicContact CD1-CG 4.39Å
973	K	75.4	Confident	75.9	Confident	148 Å²	148	53.3 Å²	53.3	64%	0.643	25%	0.253	S	S	*	.	P	Polyproline II helix	trans	-68.7	162	178.3	-66.5	-175.7	177.5	-179.7	0	110.3	N975 Y979	K973-N975 PolarHBondContact O-N 2.87Å; K973-Y979 PolarHBondContact N-OH 3.47Å; K973-Y979 PolarHBondContact O-OH 3.33Å
974	V	71.9	Confident	76.7	Confident	82 Å²	82	51.6 Å²	51.6	50%	0.497	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-64.2	134	166.7	-170.4	0	0	0	0	108	M921	M921-V974 HydrophobicContact CE-CG1 3.67Å; M921-V974 HydrophobicContact CG-CG1 4.02Å
975	N	72.1	Confident	77.7	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.016	21%	0.213	C	C	.	.			trans	-147.5	129.2	-165.6	168.6	-9.1	0	0	0	107	N952 D954 K973 H977 G978 Y979	N952-N975 PolarHBondContact OD1-ND2 3.2Å; D954-N975 PolarHBondContact OD1-OD1 2.81Å; D954-N975 WeakPolarHBondContact OD2-CA 3.06Å; D954-N975 PolarHBondContact OD2-OD1 3.44Å; K973-N975 PolarHBondContact O-N 2.87Å; N975-H977 PolarHBondContact OD1-N 2.8Å; N975-G978 PolarHBondContact ND2-O 2.74Å; N975-G978 PolarHBondContact OD1-N 2.96Å; N975-G978 PolarHBondContact OD1-O 3.08Å; N975-Y979 HydrophobicContact CB-CD2 4.21Å; N975-Y979 HydrophobicContact CB-CE2 3.66Å; N975-Y979 WeakPolarHBondContact ND2-CD2 3.39Å; N975-Y979 WeakPolarHBondContact ND2-CE2 3.36Å
976	H	73.8	Confident	78.9	Confident	128 Å²	128	45.7 Å²	45.7	59%	0.593	22%	0.224	S	C	*	.	S	Bend	trans	-83.6	-42.8	-167.9	-55.7	79.4	0	0	0	111.6	D954	D954-H976 PolarHBondContact OD1-N 2.88Å; D954-H976 IonicContact OD2-CG 3.89Å; D954-H976 PolarHBondContact OD2-N 3.44Å; D954-H976 IonicContact OD2-ND1 2.81Å; D954-H976 PolarHBondContact OD2-ND1 3.38Å
977	H	79.1	Confident	80	Confident	117 Å²	117	44.7 Å²	44.7	54%	0.542	22%	0.216	S	C	.	.	S	Bend	trans	-90.7	0.1	178.4	-57.2	88.9	0	0	0	113.2	Y917 N953 D954 N975	Y917-H977 PolarHBondContact OH-O 2.84Å; Y917-H977 VanDerWaalsContact OH-O 3.08Å; N953-H977 HydrophobicContact CB-CB 3.65Å; N953-H977 PolarHBondContact ND2-O 3.09Å; D954-H977 IonicContact OD1-CE1 2.79Å; D954-H977 IonicContact OD1-CG 2.85Å; D954-H977 PolarHBondContact OD1-N 3.43Å; D954-H977 IonicContact OD1-ND1 3.27Å; D954-H977 PolarHBondContact OD1-ND1 2.88Å; N975-H977 PolarHBondContact OD1-N 2.8Å
978	G	84.9	Confident	79.5	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.236	C	C	.	.			trans	81.1	179	175.9	0	0	0	0	0	114.2	N953 N975	N953-G978 WeakPolarHBondContact CB-O 3.14Å; N953-G978 PolarHBondContact N-O 3.31Å; N953-G978 PolarHBondContact ND2-O 2.88Å; N975-G978 PolarHBondContact ND2-O 2.74Å; N975-G978 PolarHBondContact OD1-N 2.96Å; N975-G978 PolarHBondContact OD1-O 3.08Å
979	Y	89.5	Confident	78.6	Confident	8 Å²	8	52.1 Å²	52.1	3%	0.031	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	121.5	176.2	-69.6	-90.6	0	0	0	109.8	I916 L950 I951 N952 I959 L972 K973 N975 L981	I916-Y979 VanDerWaalsContact CG1-O 3.26Å; I916-Y979 WeakPolarHBondContact CG1-O 3.33Å; I916-Y979 PolarHBondContact N-O 3.29Å; I916-Y979 PolarHBondContact O-N 3.49Å; L950-Y979 HydrophobicContact CD2-CD1 4.04Å; L950-Y979 HydrophobicContact CD2-CG 4.22Å; I951-Y979 CarbonylContact O-C 3.59Å; I951-Y979 VanDerWaalsContact O-CA 3.25Å; I951-Y979 WeakPolarHBondContact O-CA 3.32Å; N952-Y979 HydrophobicContact CB-CD1 3.86Å; N952-Y979 HydrophobicContact CB-CE1 3.6Å; I959-Y979 HydrophobicContact CD1-CE1 4.38Å; L972-Y979 HydrophobicContact CB-CE2 4.06Å; L972-Y979 HydrophobicContact CD2-CE1 4.15Å; L972-Y979 HydrophobicContact CD2-CE2 4.39Å; K973-Y979 PolarHBondContact N-OH 3.47Å; K973-Y979 PolarHBondContact O-OH 3.33Å; N975-Y979 HydrophobicContact CB-CD2 4.21Å; N975-Y979 HydrophobicContact CB-CE2 3.66Å; N975-Y979 WeakPolarHBondContact ND2-CD2 3.39Å; N975-Y979 WeakPolarHBondContact ND2-CE2 3.36Å; Y979-L981 PolarHBondContact O-N 3.22Å
980	S	90.6	Very high	77.6	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	116.5	169.4	-62.7	0	0	0	0	109.7	L950 I951 N953	L950-S980 CarbonylContact C-O 3.57Å; L950-S980 WeakPolarHBondContact CA-O 3.39Å; I951-S980 PolarHBondContact N-O 2.84Å; I951-S980 PolarHBondContact O-N 2.59Å; N953-S980 PolarHBondContact ND2-OG 3.27Å; N953-S980 WeakPolarHBondContact OD1-CB 3.41Å; N953-S980 PolarHBondContact OD1-N 2.69Å; N953-S980 PolarHBondContact OD1-OG 2.74Å
981	L	92.5	Very high	76.6	Confident	1 Å²	1	50 Å²	50	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	119.4	-180	166.1	64.6	0	0	0	109.5	F912 R913 D914 I916 F937 I948 L950 Y979 L999 L1022	F912-L981 HydrophobicContact CD2-CG 4.23Å; F912-L981 HydrophobicContact CE2-CD1 3.85Å; F912-L981 HydrophobicContact CE2-CD2 4.38Å; F912-L981 HydrophobicContact CE2-CG 3.86Å; R913-L981 WeakPolarHBondContact CA-O 3.4Å; D914-L981 PolarHBondContact N-O 2.87Å; D914-L981 PolarHBondContact O-N 3.17Å; I916-L981 HydrophobicContact CD1-CB 4.11Å; I916-L981 HydrophobicContact CD1-CD2 4.08Å; I916-L981 HydrophobicContact CG1-CB 4.03Å; I916-L981 HydrophobicContact CG2-CB 4.39Å; I916-L981 HydrophobicContact CG2-CD2 4.09Å; F937-L981 HydrophobicContact CD1-CD1 4.39Å; F937-L981 HydrophobicContact CE1-CD1 4.13Å; F937-L981 HydrophobicContact CE1-CD2 4.47Å; I948-L981 HydrophobicContact CG2-CD1 3.65Å; L950-L981 HydrophobicContact CD1-CB 4.44Å; L950-L981 HydrophobicContact CD1-CD1 3.6Å; Y979-L981 PolarHBondContact O-N 3.22Å; L981-L999 HydrophobicContact CD2-CD2 3.91Å; L981-L1022 HydrophobicContact CD2-CD1 3.83Å; L981-L1022 HydrophobicContact CD2-CD2 3.96Å
982	L	91.9	Very high	75.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	141.6	178.1	-53.1	100.1	0	0	0	111.3	L910 F912 R913 I948 L949 I951 I984 Y1092 A1093	L910-L982 HydrophobicContact CD2-CD2 4.17Å; F912-L982 VanDerWaalsContact CE2-C 3.48Å; R913-L982 HydrophobicContact CG-CD2 3.81Å; R913-L982 HydrophobicContact CG-CG 3.96Å; I948-L982 WeakPolarHBondContact CA-O 3.48Å; L949-L982 HydrophobicContact CB-CB 4.31Å; L949-L982 HydrophobicContact CB-CD1 4.32Å; L949-L982 PolarHBondContact N-O 3.38Å; L949-L982 PolarHBondContact O-N 2.92Å; I951-L982 HydrophobicContact CD1-CD1 4Å; I951-L982 HydrophobicContact CG1-CD1 4.3Å; L982-I984 HydrophobicContact CB-CD1 4.19Å; L982-I984 HydrophobicContact CB-CG1 3.91Å; L982-Y1092 WeakPolarHBondContact CD2-O 3.43Å; L982-A1093 HydrophobicContact CD1-CB 4.42Å
983	G	91.5	Very high	75.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	115	161.7	0	0	0	0	0	108.6	L910 L911 F912	L910-G983 CarbonylContact C-O 3.56Å; L910-G983 WeakPolarHBondContact CA-O 3.14Å; L911-G983 PolarHBondContact N-O 2.88Å; F912-G983 PolarHBondContact O-N 3.36Å
984	I	89	Confident	75.9	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	147.4	-172	-53.1	-179.6	0	0	0	109.6	I908 L910 S946 Y947 L949 L982 Y1092	I908-I984 HydrophobicContact CG2-CG2 3.77Å; L910-I984 HydrophobicContact CD2-CG1 3.92Å; S946-I984 CarbonylContact C-O 3.58Å; S946-I984 WeakPolarHBondContact CA-O 3.39Å; Y947-I984 HydrophobicContact CD1-CB 4.36Å; Y947-I984 HydrophobicContact CD2-CB 4.46Å; Y947-I984 HydrophobicContact CE1-CB 3.84Å; Y947-I984 HydrophobicContact CE1-CG2 3.77Å; Y947-I984 HydrophobicContact CE2-CB 3.99Å; Y947-I984 HydrophobicContact CE2-CD1 4.05Å; Y947-I984 HydrophobicContact CE2-CG1 4.43Å; Y947-I984 HydrophobicContact CE2-CG2 4.43Å; Y947-I984 PolarHBondContact N-O 3Å; Y947-I984 PolarHBondContact O-N 2.85Å; Y947-I984 WeakPolarHBondContact OH-CG2 3.22Å; L949-I984 HydrophobicContact CB-CD1 3.89Å; L949-I984 HydrophobicContact CD2-CD1 3.8Å; L949-I984 HydrophobicContact CG-CD1 4.44Å; L982-I984 HydrophobicContact CB-CD1 4.19Å; L982-I984 HydrophobicContact CB-CG1 3.91Å; I984-Y1092 HydrophobicContact CD1-CD1 3.76Å; I984-Y1092 HydrophobicContact CD1-CE1 3.86Å
985	V	86.3	Confident	76.5	Confident	7 Å²	7	43.7 Å²	43.7	4%	0.042	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	121.6	175.4	-171.5	0	0	0	0	111	H909 L911 V943 S944 N987 I992	H909-V985 HydrophobicContact CB-CB 4.21Å; H909-V985 PolarHBondContact O-N 2.92Å; L911-V985 HydrophobicContact CD1-CG2 4.29Å; L911-V985 HydrophobicContact CD2-CG2 3.75Å; L911-V985 HydrophobicContact CG-CG2 3.84Å; V943-V985 HydrophobicContact CG1-CB 4.47Å; V943-V985 HydrophobicContact CG1-CG1 3.66Å; V943-V985 HydrophobicContact CG1-CG2 3.93Å; S944-V985 WeakPolarHBondContact O-CG1 3.45Å; V985-N987 HydrophobicContact CG1-CB 4.32Å; V985-I992 HydrophobicContact CB-CD1 4.34Å; V985-I992 HydrophobicContact CG1-CD1 3.89Å; V985-I992 HydrophobicContact CG1-CG2 4.39Å
986	N	72.6	Confident	77.3	Confident	103 Å²	103	50.1 Å²	50.1	55%	0.551	28%	0.28	S	S	*	.			trans	-101.3	66.9	-179.9	-126.3	28.5	0	0	0	111.5	N945 Y947	N945-N986 HydrophobicContact CB-CB 4.41Å; N945-N986 WeakPolarHBondContact CB-O 3.14Å; N945-N986 PolarHBondContact ND2-O 2.94Å; N945-N986 PolarHBondContact O-N 2.88Å; Y947-N986 HydrophobicContact CD1-CB 4.2Å; Y947-N986 HydrophobicContact CE1-CB 3.73Å
987	N	64	Low	78.1	Confident	34 Å²	34	44.4 Å²	44.4	18%	0.182	25%	0.253	C	S	.	.			trans	-108.2	112.9	176.3	-169.1	10	0	0	0	110.8	V985 L989 I992	V985-N987 HydrophobicContact CG1-CB 4.32Å; N987-L989 PolarHBondContact ND2-O 3.26Å; N987-L989 PolarHBondContact O-N 3.09Å; N987-L989 PolarHBondContact OD1-N 2.8Å; N987-L989 VanDerWaalsContact OD1-N 3.1Å; N987-L989 PolarHBondContact OD1-O 3.32Å; N987-I992 HydrophobicContact CB-CD1 3.84Å; N987-I992 HydrophobicContact CB-CG1 4.06Å
988	P	55.3	Low	78.7	Confident	92 Å²	92	41 Å²	41	60%	0.597	24%	0.238	S	C	*	.	S	Bend	trans	-73.5	-11.6	174.1	31.2	-35.2	0	0	0	113
989	L	52.1	Low	79	Confident	134 Å²	134	41 Å²	41	70%	0.702	24%	0.239	S	C	*	.	S	Bend	trans	-110.2	96.6	-177.2	-68.8	165.1	0	0	0	110.7	N987	N987-L989 PolarHBondContact ND2-O 3.26Å; N987-L989 PolarHBondContact O-N 3.09Å; N987-L989 PolarHBondContact OD1-N 2.8Å; N987-L989 VanDerWaalsContact OD1-N 3.1Å; N987-L989 PolarHBondContact OD1-O 3.32Å
990	A	58.5	Low	78.9	Confident	44 Å²	44	42.5 Å²	42.5	36%	0.364	25%	0.246	S	C	.	.	S	Bend	trans	-81.6	156.8	173	0	0	0	0	0	112.2	D906	D906-A990 WeakPolarHBondContact OD2-CB 3.49Å
991	P	59.1	Low	78.7	Confident	78 Å²	78	42.6 Å²	42.6	51%	0.506	25%	0.246	S	C	.	.	P	Polyproline II helix	cis	-79	148.5	-1	32.7	-35.4	0	0	0	113.3
992	I	67.9	Low	78.2	Confident	6 Å²	6	43 Å²	43	3%	0.031	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-85.5	117.2	174.8	-53.7	-175.9	0	0	0	108.7	Y879 H909 V943 V985 N987	Y879-I992 HydrophobicContact CE1-CB 4.31Å; Y879-I992 HydrophobicContact CE1-CG2 3.98Å; H909-I992 HydrophobicContact CB-CD1 3.98Å; H909-I992 VanDerWaalsContact CD2-CD1 3.43Å; H909-I992 WeakPolarHBondContact CD2-CD1 3.46Å; V943-I992 HydrophobicContact CG1-CG2 3.55Å; V985-I992 HydrophobicContact CB-CD1 4.34Å; V985-I992 HydrophobicContact CG1-CD1 3.89Å; V985-I992 HydrophobicContact CG1-CG2 4.39Å; N987-I992 HydrophobicContact CB-CD1 3.84Å; N987-I992 HydrophobicContact CB-CG1 4.06Å
993	P	71.1	Confident	77.5	Confident	76 Å²	76	43 Å²	43	49%	0.494	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-64.6	147.3	-175.4	26.8	-35.3	0	0	0	112.1
994	S	80.5	Confident	76	Confident	77 Å²	77	46 Å²	46	54%	0.538	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-54.1	143.2	171.9	59.1	0	0	0	0	112.3	Y879 E881	Y879-S994 CarbonylContact O-C 3.57Å; Y879-S994 WeakPolarHBondContact O-CA 3.42Å; E881-S994 PolarHBondContact OE2-N 3.43Å
995	G	83.5	Confident	74.5	Confident	9 Å²	9	46.5 Å²	46.5	9%	0.093	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	179.6	-168.7	0	0	0	0	0	114.7	N878 Y879 T942	N878-G995 CarbonylContact C-O 3.58Å; N878-G995 WeakPolarHBondContact CA-O 3.38Å; Y879-G995 PolarHBondContact N-O 3.03Å; Y879-G995 PolarHBondContact O-N 3.16Å; T942-G995 WeakPolarHBondContact OG1-CA 3.37Å
996	K	89.3	Confident	72.6	Confident	137 Å²	137	51.9 Å²	51.9	60%	0.596	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	145.8	178.1	-59.2	-162.9	174.8	-174.7	0	110.9	N878 T941 T942	N878-K996 WeakPolarHBondContact OD1-CD 3.45Å; N878-K996 WeakPolarHBondContact OD1-CE 3.44Å; N878-K996 WeakPolarHBondContact OD1-CG 3.23Å; T941-K996 CarbonylContact C-O 3.56Å; T941-K996 VanDerWaalsContact CA-O 3.24Å; T941-K996 WeakPolarHBondContact CA-O 3.27Å; T941-K996 PolarHBondContact OG1-O 3.36Å; T942-K996 PolarHBondContact N-O 2.83Å; T942-K996 PolarHBondContact OG1-N 3.14Å
997	W	91.5	Very high	71.4	Confident	9 Å²	9	52.8 Å²	52.8	3%	0.034	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	148.6	176.6	62.2	-100	0	0	0	111.4	Y875 S876 G877 L911 F912 L939 K940 L999 L1022	Y875-W997 VanDerWaalsContact O-CZ3 3.25Å; Y875-W997 WeakPolarHBondContact O-CZ3 3.44Å; S876-W997 WeakPolarHBondContact CA-O 3.09Å; G877-W997 VanDerWaalsContact CA-CE2 3.46Å; G877-W997 PolarHBondContact N-O 2.89Å; G877-W997 PolarHBondContact O-N 3.46Å; L911-W997 HydrophobicContact CB-CG 4.19Å; L911-W997 HydrophobicContact CD1-CB 4.42Å; L911-W997 PolarHBondContact O-NE1 2.95Å; F912-W997 HydrophobicContact CB-CH2 3.77Å; F912-W997 HydrophobicContact CB-CZ2 3.62Å; F912-W997 HydrophobicContact CB-CZ3 4.46Å; F912-W997 AromaticContact CD1-CD2 3.76Å; F912-W997 HydrophobicContact CD1-CD2 3.76Å; F912-W997 AromaticContact CD1-CE2 3.85Å; F912-W997 AromaticContact CD1-CE3 3.65Å; F912-W997 HydrophobicContact CD1-CE3 3.65Å; F912-W997 HydrophobicContact CD1-CG 4.48Å; F912-W997 AromaticContact CD1-CH2 3.84Å; F912-W997 HydrophobicContact CD1-CH2 3.84Å; F912-W997 AromaticContact CD1-CZ2 3.9Å; F912-W997 HydrophobicContact CD1-CZ2 3.9Å; F912-W997 AromaticContact CD1-CZ3 3.7Å; F912-W997 HydrophobicContact CD1-CZ3 3.7Å; F912-W997 HydrophobicContact CE1-CD2 4.35Å; F912-W997 HydrophobicContact CE1-CE3 4.04Å; F912-W997 HydrophobicContact CE1-CZ3 4.3Å; F912-W997 HydrophobicContact CG-CH2 4.09Å; F912-W997 HydrophobicContact CG-CZ2 4.21Å; F912-W997 HydrophobicContact CG-CZ3 4.3Å; L939-W997 HydrophobicContact CD1-CB 4.35Å; K940-W997 CarbonylContact O-C 3.59Å; K940-W997 WeakPolarHBondContact O-CA 3.37Å; W997-L999 HydrophobicContact CE3-CB 4.41Å; W997-L999 HydrophobicContact CZ3-CB 4.25Å; W997-L1022 HydrophobicContact CH2-CB 4.49Å
998	N	91.1	Very high	70.9	Confident	44 Å²	44	53 Å²	53	24%	0.235	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	124.4	167.8	-177	-16.1	0	0	0	107.9	E874 Y875 K940	E874-N998 PolarHBondContact OE2-ND2 3.26Å; Y875-N998 CarbonylContact O-C 3.59Å; Y875-N998 VanDerWaalsContact O-CA 3.31Å; Y875-N998 WeakPolarHBondContact O-CA 3.46Å; Y875-N998 PolarHBondContact O-OD1 3.5Å; K940-N998 PolarHBondContact N-O 2.77Å; K940-N998 PolarHBondContact O-N 3.29Å
999	L	90.8	Very high	71.2	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	113.5	171.6	179.3	71.2	0	0	0	109	Y875 F912 F937 R938 L939 I948 L981 W997 L1022	Y875-L999 HydrophobicContact CD2-CD2 4.41Å; Y875-L999 PolarHBondContact N-O 2.73Å; Y875-L999 PolarHBondContact O-N 3.07Å; F912-L999 HydrophobicContact CE1-CB 4.4Å; F912-L999 HydrophobicContact CE2-CD2 4.01Å; F912-L999 HydrophobicContact CZ-CB 4.49Å; F912-L999 HydrophobicContact CZ-CD1 4.38Å; F912-L999 HydrophobicContact CZ-CD2 3.9Å; F912-L999 HydrophobicContact CZ-CG 4.49Å; F937-L999 HydrophobicContact CB-CD1 4.43Å; R938-L999 WeakPolarHBondContact O-CA 3.25Å; L939-L999 HydrophobicContact CB-CD1 4.44Å; L939-L999 HydrophobicContact CD1-CB 4.47Å; I948-L999 HydrophobicContact CD1-CD1 3.46Å; I948-L999 VanDerWaalsContact CD1-CD1 3.46Å; I948-L999 HydrophobicContact CG1-CD1 4.39Å; L981-L999 HydrophobicContact CD2-CD2 3.91Å; W997-L999 HydrophobicContact CE3-CB 4.41Å; W997-L999 HydrophobicContact CZ3-CB 4.25Å; L999-L1022 HydrophobicContact CD2-CD1 3.75Å
1000	Q	87.5	Confident	71.4	Confident	39 Å²	39	50.7 Å²	50.7	18%	0.182	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	123.9	165.9	-99	177.8	-1.8	0	0	109.3	I872 E874 R938	I872-Q1000 HydrophobicContact CG2-CG 4.34Å; E874-Q1000 HydrophobicContact CG-CG 3.78Å; E874-Q1000 WeakPolarHBondContact OE1-CG 3.47Å; E874-Q1000 PolarHBondContact OE1-NE2 3.21Å; R938-Q1000 HydrophobicContact CB-CB 3.94Å; R938-Q1000 PolarHBondContact N-O 2.88Å; R938-Q1000 PolarHBondContact O-N 2.71Å
1001	L	86.6	Confident	71.6	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	128.7	168.9	-174.5	62.7	0	0	0	109.2	I872 K873 Y875 F937 L1012 P1013	I872-L1001 WeakPolarHBondContact CA-O 3.38Å; K873-L1001 PolarHBondContact N-O 2.85Å; K873-L1001 PolarHBondContact O-N 3.1Å; Y875-L1001 HydrophobicContact CE2-CB 4.45Å; Y875-L1001 HydrophobicContact CE2-CD2 4.38Å; F937-L1001 HydrophobicContact CD1-CD1 3.67Å; F937-L1001 HydrophobicContact CD2-CD1 4.35Å; F937-L1001 HydrophobicContact CE1-CD1 3.48Å; F937-L1001 VanDerWaalsContact CE1-CD1 3.48Å; F937-L1001 HydrophobicContact CE2-CD1 4.19Å; F937-L1001 HydrophobicContact CG-CD1 4.11Å; F937-L1001 HydrophobicContact CZ-CD1 3.76Å; L1001-L1012 HydrophobicContact CD2-CB 4.42Å; L1001-L1012 HydrophobicContact CG-CD2 4.39Å; L1001-P1013 HydrophobicContact CD2-CB 4.15Å; L1001-P1013 HydrophobicContact CD2-CG 4.37Å; L1001-P1013 WeakPolarHBondContact CD2-O 3.46Å
1002	L	82.4	Confident	72.4	Confident	11 Å²	11	48.5 Å²	48.5	6%	0.058	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	142.4	-172.9	-53.2	174.7	0	0	0	110.6	L870 I872 Y935 S936 R938 W969	L870-L1002 HydrophobicContact CD2-CB 4.31Å; L870-L1002 HydrophobicContact CD2-CD2 4.25Å; I872-L1002 HydrophobicContact CB-CD2 4.36Å; I872-L1002 HydrophobicContact CD1-CD2 3.89Å; I872-L1002 HydrophobicContact CG1-CD2 3.74Å; I872-L1002 HydrophobicContact CG2-CD2 4.02Å; Y935-L1002 CarbonylContact C-O 3.5Å; Y935-L1002 VanDerWaalsContact CA-O 3.3Å; Y935-L1002 WeakPolarHBondContact CA-O 3.34Å; S936-L1002 PolarHBondContact N-O 2.81Å; S936-L1002 PolarHBondContact O-N 3.37Å; R938-L1002 HydrophobicContact CG-CD1 3.97Å; W969-L1002 HydrophobicContact CH2-CB 4.39Å
1003	G	76.1	Confident	72.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.2	177.8	175.2	0	0	0	0	0	112.8	L870 S871	L870-G1003 CarbonylContact C-O 3.53Å; L870-G1003 WeakPolarHBondContact CA-O 3.32Å; L870-G1003 WeakPolarHBondContact CD1-O 3.5Å; L870-G1003 WeakPolarHBondContact CG-O 3.46Å; S871-G1003 PolarHBondContact N-O 2.99Å; S871-G1003 PolarHBondContact O-N 3.36Å; S871-G1003 VanDerWaalsContact O-N 3.08Å; S871-G1003 PolarHBondContact OG-O 2.92Å
1004	P	61.6	Low	73.3	Confident	63 Å²	63	46.6 Å²	46.6	41%	0.409	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	127.5	175.6	30.1	-33.8	0	0	0	111.2	S871 V933 K934	S871-P1004 PolarHBondContact OG-O 3.29Å; V933-P1004 HydrophobicContact CG1-CG 3.62Å; K934-P1004 VanDerWaalsContact O-CD 3.29Å; K934-P1004 WeakPolarHBondContact O-CD 3.23Å
1005	G	55.9	Low	73.1	Confident	10 Å²	10	43.5 Å²	43.5	10%	0.103	23%	0.234	C	C	.	.			trans	-177	150.2	177.1	0	0	0	0	0	112.8	Y869	Y869-G1005 CarbonylContact C-O 3.47Å
1006	I	48.4	Very low	72.4	Confident	120 Å²	120	48.4 Å²	48.4	62%	0.615	26%	0.257	S	S	*	.	S	Bend	trans	-92.9	-20.1	-165.5	-57	174	0	0	0	112.7	W741 S868	W741-I1006 HydrophobicContact CZ2-CD1 4.12Å; S868-I1006 CarbonylContact O-C 3.52Å; S868-I1006 VanDerWaalsContact O-C 3.25Å; S868-I1006 VanDerWaalsContact O-CA 3.25Å; S868-I1006 WeakPolarHBondContact O-CA 3.33Å
1007	I	45.6	Very low	71	Confident	122 Å²	122	44.3 Å²	44.3	63%	0.626	25%	0.253	S	S	*	.	S	Bend	trans	-162.1	139.1	169.7	-98.3	133.3	0	0	0	109.1
1008	G	54.1	Low	68.8	Low	40 Å²	40	51.1 Å²	51.1	41%	0.412	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	-147.8	168.2	0	0	0	0	0	115	S871	S871-G1008 WeakPolarHBondContact CA-O 3.31Å; S871-G1008 WeakPolarHBondContact CB-O 3.47Å
1009	N	61.5	Low	67	Low	54 Å²	54	53.5 Å²	53.5	29%	0.289	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	27.4	-178.2	67.2	-34.1	0	0	0	113	K873 L1012 K1014	K873-N1009 HydrophobicContact CB-CB 4.01Å; N1009-L1012 HydrophobicContact CB-CD1 4.17Å; N1009-K1014 WeakPolarHBondContact O-CE 3.48Å; N1009-K1014 PolarHBondContact O-NZ 3.45Å
1010	E	56.4	Low	65.9	Low	122 Å²	122	58.7 Å²	58.7	57%	0.57	34%	0.34	S	S	*	.	S	Bend	trans	-70.7	152.8	163.8	-59.8	-159.9	179.3	0	0	110.1	L1012	E1010-L1012 PolarHBondContact O-N 2.93Å
1011	N	63.3	Low	65.5	Low	76 Å²	76	61.2 Å²	61.2	41%	0.406	35%	0.354	S	S	.	.	S	Bend	trans	63.9	-12.5	-173	-55.2	-11.1	0	0	0	117.3	S919 Y935	S919-N1011 VanDerWaalsContact CB-C 3.44Å; S919-N1011 VanDerWaalsContact CB-CA 3.5Å; S919-N1011 WeakPolarHBondContact CB-O 2.98Å; S919-N1011 WeakPolarHBondContact OG-CA 3.13Å; Y935-N1011 PolarHBondContact OH-O 2.96Å
1012	L	75.5	Confident	65.3	Low	1 Å²	1	61.7 Å²	61.7	1%	0.005	36%	0.357	C	S	.	.	S	Bend	trans	-75.7	146.2	174	-69.1	-176.6	0	0	0	113.5	S871 K873 Y935 L1001 N1009 E1010	S871-L1012 WeakPolarHBondContact OG-CD2 3.42Å; K873-L1012 HydrophobicContact CB-CD1 3.52Å; Y935-L1012 HydrophobicContact CD1-CD2 4.34Å; L1001-L1012 HydrophobicContact CD2-CB 4.42Å; L1001-L1012 HydrophobicContact CG-CD2 4.39Å; N1009-L1012 HydrophobicContact CB-CD1 4.17Å; E1010-L1012 PolarHBondContact O-N 2.93Å
1013	P	78.7	Confident	65.3	Low	2 Å²	2	62.4 Å²	62.4	1%	0.013	36%	0.363	C	S	.	.			trans	-57.3	137.6	168.8	-25.3	32.5	0	0	0	112.9	I916 Y917 Y935 L972 L1001	I916-P1013 HydrophobicContact CB-CB 4.28Å; I916-P1013 HydrophobicContact CD1-CB 3.94Å; Y917-P1013 VanDerWaalsContact O-CA 3.24Å; Y917-P1013 WeakPolarHBondContact O-CA 3.3Å; Y935-P1013 HydrophobicContact CD1-CG 4.11Å; Y935-P1013 HydrophobicContact CD2-CG 4.3Å; Y935-P1013 HydrophobicContact CE1-CG 4Å; Y935-P1013 HydrophobicContact CE2-CG 4.16Å; Y935-P1013 HydrophobicContact CG-CG 4.23Å; L972-P1013 HydrophobicContact CD1-CG 4.39Å; L1001-P1013 HydrophobicContact CD2-CB 4.15Å; L1001-P1013 HydrophobicContact CD2-CG 4.37Å; L1001-P1013 WeakPolarHBondContact CD2-O 3.46Å
1014	K	78.6	Confident	65.6	Low	40 Å²	40	64 Å²	64	17%	0.174	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	142.8	-174.1	-74	158.6	-172	167.1	0	111.1	I916 Y917 L922 N1009	I916-K1014 WeakPolarHBondContact CA-O 3.43Å; Y917-K1014 PolarHBondContact N-O 2.97Å; Y917-K1014 PolarHBondContact O-N 3.19Å; L922-K1014 HydrophobicContact CD1-CD 4.44Å; N1009-K1014 WeakPolarHBondContact O-CE 3.48Å; N1009-K1014 PolarHBondContact O-NZ 3.45Å
1015	P	77.8	Confident	66.6	Low	11 Å²	11	66.9 Å²	66.9	7%	0.071	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	146.2	169	29.7	-34.2	0	0	0	110.7	Y875 D914 C915 I916 L1022	Y875-P1015 WeakPolarHBondContact OH-CD 3.47Å; D914-P1015 HydrophobicContact CB-CB 4.19Å; C915-P1015 VanDerWaalsContact O-CA 3.31Å; C915-P1015 WeakPolarHBondContact O-CA 3.5Å; I916-P1015 HydrophobicContact CG2-CB 4.41Å; P1015-L1022 HydrophobicContact CB-CD2 4.31Å; P1015-L1022 HydrophobicContact CG-CD2 4.25Å
1016	I	67	Low	68	Low	112 Å²	112	68.7 Å²	68.7	57%	0.574	39%	0.391	S	S	*	.	S	Bend	trans	-79.7	119.8	169.3	-78.8	-177.3	0	0	0	109.3	C915 Y917	C915-I1016 PolarHBondContact O-N 2.98Å; Y917-I1016 HydrophobicContact CD1-CD1 4.31Å; Y917-I1016 HydrophobicContact CD2-CB 4.4Å; Y917-I1016 HydrophobicContact CD2-CD1 3.55Å; Y917-I1016 HydrophobicContact CD2-CG1 3.54Å; Y917-I1016 HydrophobicContact CE1-CD1 4.09Å; Y917-I1016 HydrophobicContact CE2-CB 4.14Å; Y917-I1016 HydrophobicContact CE2-CD1 3.31Å; Y917-I1016 HydrophobicContact CE2-CG1 3.59Å; Y917-I1016 HydrophobicContact CG-CD1 4.06Å; Y917-I1016 HydrophobicContact CG-CG1 4.33Å
1017	G	61.4	Low	69.7	Low	51 Å²	51	68 Å²	68	53%	0.526	38%	0.381	S	S	.	.	S	Bend	trans	163.2	169.4	176.2	0	0	0	0	0	113.1	T1019	G1017-T1019 PolarHBondContact O-N 2.91Å
1018	T	44.7	Very low	71.7	Confident	152 Å²	152	64.7 Å²	64.7	93%	0.933	37%	0.367	S	S	*	.	S	Bend	trans	-74	-16.2	175.4	51.6	0	0	0	0	113
1019	T	53.5	Low	73.3	Confident	95 Å²	95	64.3 Å²	64.3	58%	0.583	36%	0.355	S	S	*	.	S	Bend	trans	-101	113.8	174.6	48.2	0	0	0	0	110.9	G1017 N1021	G1017-T1019 PolarHBondContact O-N 2.91Å; T1019-N1021 PolarHBondContact O-N 3.39Å
1020	L	66.9	Low	74.6	Confident	110 Å²	110	65.1 Å²	65.1	58%	0.576	36%	0.357	S	S	*	.	S	Bend	trans	-72.9	33.3	177.6	-72.7	162.8	0	0	0	114.1	K873	K873-L1020 VanDerWaalsContact CE-O 3.25Å; K873-L1020 WeakPolarHBondContact CE-O 3.37Å; K873-L1020 PolarHBondContact NZ-O 3.48Å
1021	N	78.5	Confident	76.2	Confident	91 Å²	91	61 Å²	61	49%	0.487	34%	0.339	S	S	.	.	S	Bend	trans	-138.7	144.2	-178.7	-76.2	-13.3	0	0	0	109.8	K873 T1019	K873-N1021 PolarHBondContact NZ-OD1 2.91Å; K873-N1021 VanDerWaalsContact NZ-OD1 3.11Å; T1019-N1021 PolarHBondContact O-N 3.39Å
1022	L	83.7	Confident	77.5	Confident	12 Å²	12	60.3 Å²	60.3	6%	0.063	33%	0.333	C	S	.	.			trans	-64.4	141.7	176.3	-58.3	171.5	0	0	0	111.9	Y875 F912 D914 I916 L981 W997 L999 P1015 S1024	Y875-L1022 HydrophobicContact CD1-CB 4.45Å; Y875-L1022 HydrophobicContact CD1-CD1 4.28Å; Y875-L1022 HydrophobicContact CD1-CG 3.76Å; Y875-L1022 HydrophobicContact CD2-CD1 3.78Å; Y875-L1022 HydrophobicContact CD2-CG 4.07Å; Y875-L1022 HydrophobicContact CE1-CD2 4.49Å; Y875-L1022 HydrophobicContact CE1-CG 4.02Å; Y875-L1022 HydrophobicContact CE2-CD1 4.32Å; Y875-L1022 HydrophobicContact CE2-CG 4.33Å; Y875-L1022 HydrophobicContact CG-CD1 3.74Å; Y875-L1022 HydrophobicContact CG-CG 3.76Å; F912-L1022 HydrophobicContact CB-CB 4.28Å; F912-L1022 HydrophobicContact CD2-CD1 3.99Å; F912-L1022 HydrophobicContact CE2-CD1 4.48Å; F912-L1022 HydrophobicContact CG-CD1 4.25Å; D914-L1022 HydrophobicContact CB-CB 4.43Å; D914-L1022 HydrophobicContact CB-CD2 3.52Å; D914-L1022 WeakPolarHBondContact OD2-CA 3.37Å; I916-L1022 HydrophobicContact CG2-CD2 4.12Å; L981-L1022 HydrophobicContact CD2-CD1 3.83Å; L981-L1022 HydrophobicContact CD2-CD2 3.96Å; W997-L1022 HydrophobicContact CH2-CB 4.49Å; L999-L1022 HydrophobicContact CD2-CD1 3.75Å; P1015-L1022 HydrophobicContact CB-CD2 4.31Å; P1015-L1022 HydrophobicContact CG-CD2 4.25Å; L1022-S1024 PolarHBondContact O-N 3.24Å
1023	C	82.5	Confident	78.1	Confident	27 Å²	27	61.8 Å²	61.8	18%	0.182	34%	0.341	C	S	.	.			trans	-64.5	125.8	173.6	-172.7	0	0	0	0	112	F912 R913 D914 F1026	F912-C1023 VanDerWaalsContact CA-O 3.26Å; F912-C1023 WeakPolarHBondContact CA-O 3.24Å; R913-C1023 PolarHBondContact N-O 2.94Å; R913-C1023 WeakPolarHBondContact O-CB 3.46Å; D914-C1023 PolarHBondContact OD2-N 3.43Å; C1023-F1026 WeakPolarHBondContact O-CE1 3.31Å
1024	S	82.9	Confident	78.5	Confident	34 Å²	34	62.7 Å²	62.7	24%	0.238	34%	0.344	C	S	.	.			trans	-117.3	-15.3	176.6	75.6	0	0	0	0	114.2	L1022	L1022-S1024 PolarHBondContact O-N 3.24Å
1025	N	81.6	Confident	78.8	Confident	122 Å²	122	61.3 Å²	61.3	65%	0.652	34%	0.338	S	S	*	.			trans	-115.1	100.9	-174.4	-69.3	1.6	0	0	0	107.4
1026	F	84.8	Confident	79	Confident	48 Å²	48	63.8 Å²	63.8	21%	0.211	35%	0.348	C	S	.	.			trans	-97.6	149.1	-175	-36.9	-72.2	0	0	0	111.6	L910 R913 C1023 I1319	L910-F1026 HydrophobicContact CB-CD2 4.43Å; L910-F1026 HydrophobicContact CB-CE2 3.69Å; L910-F1026 HydrophobicContact CB-CZ 3.98Å; R913-F1026 HydrophobicContact CB-CE1 3.77Å; R913-F1026 HydrophobicContact CB-CZ 4.3Å; C1023-F1026 WeakPolarHBondContact O-CE1 3.31Å; F1026-I1319 HydrophobicContact CB-CG2 3.37Å; F1026-I1319 HydrophobicContact CD1-CG2 4.38Å; F1026-I1319 HydrophobicContact CD2-CG2 4.36Å; F1026-I1319 HydrophobicContact CG-CG2 3.79Å
1027	Y	84.8	Confident	79.2	Confident	107 Å²	107	60.1 Å²	60.1	42%	0.42	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	140.9	162	-171.5	-108.3	0	0	0	110.1	I1029 I1319 C1320 S1323	Y1027-I1029 HydrophobicContact CD1-CG1 3.9Å; Y1027-I1029 HydrophobicContact CE1-CD1 4.36Å; Y1027-I1029 HydrophobicContact CE1-CG1 3.56Å; Y1027-I1319 WeakPolarHBondContact O-CA 3.45Å; Y1027-C1320 PolarHBondContact N-O 3.3Å; Y1027-C1320 PolarHBondContact O-N 2.91Å; Y1027-S1323 VanDerWaalsContact CD1-CA 3.43Å
1028	T	86.6	Confident	79.9	Confident	52 Å²	52	61 Å²	61	32%	0.319	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	114.8	-174.6	-61.5	0	0	0	0	109	E1030 R1317	T1028-E1030 HydrophobicContact CG2-CG 4.13Å; T1028-R1317 VanDerWaalsContact CG2-CD 3.49Å; T1028-R1317 HydrophobicContact CG2-CG 3.42Å; T1028-R1317 VanDerWaalsContact CG2-CG 3.42Å
1029	I	89.3	Confident	81.2	Confident	31 Å²	31	62.7 Å²	62.7	16%	0.159	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	122.1	169.3	-57.5	166.8	0	0	0	107	Y1027 L1031 R1317 I1318 I1326 I1328	Y1027-I1029 HydrophobicContact CD1-CG1 3.9Å; Y1027-I1029 HydrophobicContact CE1-CD1 4.36Å; Y1027-I1029 HydrophobicContact CE1-CG1 3.56Å; I1029-L1031 HydrophobicContact CG2-CG 4.36Å; I1029-R1317 CarbonylContact O-C 3.58Å; I1029-R1317 WeakPolarHBondContact O-CA 3.48Å; I1029-I1318 HydrophobicContact CB-CB 4.38Å; I1029-I1318 PolarHBondContact N-O 3.4Å; I1029-I1318 PolarHBondContact O-N 2.89Å; I1029-I1326 HydrophobicContact CD1-CB 4.48Å; I1029-I1326 HydrophobicContact CD1-CG2 4.49Å; I1029-I1328 HydrophobicContact CD1-CD1 4.22Å; I1029-I1328 HydrophobicContact CG2-CD1 3.99Å
1030	E	88.9	Confident	82.4	Confident	71 Å²	71	66.5 Å²	66.5	33%	0.332	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	137.6	167.4	-59.9	-156.7	146.2	0	0	109.8	T1028 K1315 R1317	T1028-E1030 HydrophobicContact CG2-CG 4.13Å; E1030-K1315 VanDerWaalsContact CD-CE 3.49Å; E1030-K1315 WeakPolarHBondContact OE2-CE 3.4Å; E1030-K1315 IonicContact OE2-NZ 2.69Å; E1030-K1315 PolarHBondContact OE2-NZ 2.8Å; E1030-R1317 HydrophobicContact CG-CG 4.34Å; E1030-R1317 IonicContact OE1-CZ 2.87Å; E1030-R1317 IonicContact OE1-NE 2.68Å; E1030-R1317 PolarHBondContact OE1-NE 3Å; E1030-R1317 IonicContact OE1-NH2 3.18Å; E1030-R1317 PolarHBondContact OE1-NH2 2.88Å
1031	L	89.4	Confident	83.2	Confident	37 Å²	37	64.6 Å²	64.6	19%	0.194	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	136.5	172.8	-71	171.7	0	0	0	107.9	I1029 W1314 K1315 M1316 I1328	I1029-L1031 HydrophobicContact CG2-CG 4.36Å; L1031-W1314 HydrophobicContact CB-CZ3 4.4Å; L1031-K1315 CarbonylContact O-C 3.58Å; L1031-K1315 WeakPolarHBondContact O-CA 3.35Å; L1031-M1316 HydrophobicContact CD1-CE 3.89Å; L1031-M1316 PolarHBondContact N-O 2.9Å; L1031-M1316 PolarHBondContact O-N 3.5Å; L1031-I1328 HydrophobicContact CD1-CB 4.42Å; L1031-I1328 HydrophobicContact CD1-CD1 3.76Å; L1031-I1328 HydrophobicContact CD1-CG2 3.96Å
1032	E	90.4	Very high	83.6	Confident	60 Å²	60	62.1 Å²	62.1	28%	0.28	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	142.2	180	57	-174.2	-144.6	0	0	108.9	I1307 W1314 K1315	E1032-I1307 HydrophobicContact CB-CD1 3.73Å; E1032-I1307 HydrophobicContact CG-CD1 3.69Å; E1032-W1314 WeakPolarHBondContact CA-O 3.06Å; E1032-K1315 HydrophobicContact CB-CB 4.39Å; E1032-K1315 HydrophobicContact CB-CD 4.25Å; E1032-K1315 HydrophobicContact CB-CG 4.17Å; E1032-K1315 WeakPolarHBondContact OE2-CD 3.4Å; E1032-K1315 VanDerWaalsContact OE2-CE 3.29Å; E1032-K1315 WeakPolarHBondContact OE2-CE 3.31Å; E1032-K1315 IonicContact OE2-NZ 3.66Å; E1032-K1315 PolarHBondContact OE2-NZ 2.76Å
1033	D	87.6	Confident	83.8	Confident	32 Å²	32	62.2 Å²	62.2	17%	0.171	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	167.8	-176.8	-131.4	-38.7	0	0	0	108.9	R1046 H1313 W1314	D1033-R1046 IonicContact OD2-CZ 3.62Å; D1033-R1046 IonicContact OD2-NH1 2.71Å; D1033-R1046 IonicContact OD2-NH2 3.73Å; D1033-R1046 PolarHBondContact OD2-NH2 3.21Å; D1033-H1313 WeakPolarHBondContact O-CA 3.29Å; D1033-W1314 HydrophobicContact CB-CD2 4.29Å; D1033-W1314 VanDerWaalsContact CB-CE2 3.4Å; D1033-W1314 HydrophobicContact CB-CH2 3.92Å; D1033-W1314 HydrophobicContact CB-CZ2 3.21Å; D1033-W1314 PolarHBondContact N-O 3.31Å; D1033-W1314 PolarHBondContact O-N 3.28Å
1034	Y	87.3	Confident	84.1	Confident	21 Å²	21	61.3 Å²	61.3	8%	0.082	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	158.5	177	-62.3	-72.6	0	0	0	112.1	E1036 F1245 I1307 D1308 Q1311 H1313 W1314	Y1034-E1036 PolarHBondContact O-N 2.92Å; Y1034-F1245 AromaticContact CD1-CE1 3.85Å; Y1034-F1245 HydrophobicContact CD1-CE1 3.85Å; Y1034-F1245 HydrophobicContact CD2-CE1 4.17Å; Y1034-F1245 AromaticContact CE1-CE1 3.55Å; Y1034-F1245 HydrophobicContact CE1-CE1 3.55Å; Y1034-F1245 AromaticContact CE1-CZ 3.94Å; Y1034-F1245 HydrophobicContact CE1-CZ 3.94Å; Y1034-F1245 AromaticContact CE2-CE1 3.89Å; Y1034-F1245 HydrophobicContact CE2-CE1 3.89Å; Y1034-F1245 AromaticContact CE2-CZ 3.92Å; Y1034-F1245 HydrophobicContact CE2-CZ 3.92Å; Y1034-F1245 HydrophobicContact CG-CE1 4.15Å; Y1034-F1245 AromaticContact CZ-CE1 3.56Å; Y1034-F1245 AromaticContact CZ-CZ 3.53Å; Y1034-I1307 HydrophobicContact CD1-CG2 4.46Å; Y1034-I1307 HydrophobicContact CE1-CB 4.42Å; Y1034-I1307 HydrophobicContact CE1-CG1 4.37Å; Y1034-I1307 HydrophobicContact CE1-CG2 3.78Å; Y1034-I1307 HydrophobicContact CE2-CG1 4.35Å; Y1034-I1307 WeakPolarHBondContact OH-CA 3.44Å; Y1034-D1308 PolarHBondContact OH-N 3.45Å; Y1034-D1308 VanDerWaalsContact OH-N 3.13Å; Y1034-Q1311 HydrophobicContact CD1-CB 3.99Å; Y1034-Q1311 HydrophobicContact CE1-CB 3.77Å; Y1034-Q1311 HydrophobicContact CE1-CG 4.36Å; Y1034-H1313 HydrophobicContact CD1-CB 4.46Å; Y1034-W1314 PolarHBondContact O-NE1 3.33Å; Y1034-W1314 VanDerWaalsContact O-NE1 3.14Å
1035	Y	85.8	Confident	84.4	Confident	11 Å²	11	62.6 Å²	62.6	4%	0.043	31%	0.306	C	S	.	.			trans	-78.3	106.1	169.9	173.1	-139.1	0	0	0	110.3	P1037 L1043 G1233 W1236 L1238 L1246 A1312	Y1035-P1037 HydrophobicContact CE1-CG 3.99Å; Y1035-P1037 HydrophobicContact CE2-CB 4.47Å; Y1035-P1037 HydrophobicContact CE2-CG 4.41Å; Y1035-P1037 WeakPolarHBondContact O-CD 3.44Å; Y1035-L1043 HydrophobicContact CD2-CD1 3.55Å; Y1035-L1043 HydrophobicContact CE2-CD1 4.22Å; Y1035-L1043 HydrophobicContact CG-CD1 4.39Å; Y1035-G1233 WeakPolarHBondContact OH-CA 3.11Å; Y1035-W1236 HydrophobicContact CD1-CB 4.48Å; Y1035-W1236 AromaticContact CD1-CD2 3.38Å; Y1035-W1236 HydrophobicContact CD1-CD2 3.38Å; Y1035-W1236 AromaticContact CD1-CE2 3.79Å; Y1035-W1236 AromaticContact CD1-CE3 3.46Å; Y1035-W1236 HydrophobicContact CD1-CE3 3.46Å; Y1035-W1236 VanDerWaalsContact CD1-CE3 3.46Å; Y1035-W1236 AromaticContact CD1-CG 3.8Å; Y1035-W1236 HydrophobicContact CD1-CG 3.8Å; Y1035-W1236 HydrophobicContact CD1-CH2 4.44Å; Y1035-W1236 HydrophobicContact CD1-CZ2 4.32Å; Y1035-W1236 HydrophobicContact CD1-CZ3 4.02Å; Y1035-W1236 AromaticContact CD2-CE3 3.82Å; Y1035-W1236 HydrophobicContact CD2-CE3 3.82Å; Y1035-W1236 AromaticContact CD2-CZ3 3.88Å; Y1035-W1236 HydrophobicContact CD2-CZ3 3.88Å; Y1035-W1236 HydrophobicContact CE1-CB 3.87Å; Y1035-W1236 AromaticContact CE1-CD2 3.66Å; Y1035-W1236 HydrophobicContact CE1-CD2 3.66Å; Y1035-W1236 AromaticContact CE1-CE3 3.71Å; Y1035-W1236 HydrophobicContact CE1-CE3 3.71Å; Y1035-W1236 AromaticContact CE1-CG 3.69Å; Y1035-W1236 HydrophobicContact CE1-CG 3.69Å; Y1035-W1236 WeakPolarHBondContact CE1-O 3.39Å; Y1035-W1236 HydrophobicContact CE2-CE3 4.04Å; Y1035-W1236 HydrophobicContact CE2-CZ3 4.47Å; Y1035-W1236 AromaticContact CG-CD2 3.91Å; Y1035-W1236 HydrophobicContact CG-CD2 3.91Å; Y1035-W1236 AromaticContact CG-CE3 3.53Å; Y1035-W1236 HydrophobicContact CG-CE3 3.53Å; Y1035-W1236 HydrophobicContact CG-CH2 4.05Å; Y1035-W1236 HydrophobicContact CG-CZ2 4.31Å; Y1035-W1236 AromaticContact CG-CZ3 3.63Å; Y1035-W1236 HydrophobicContact CG-CZ3 3.63Å; Y1035-W1236 AromaticContact CZ-CE3 3.99Å; Y1035-L1238 HydrophobicContact CD1-CD2 3.87Å; Y1035-L1238 HydrophobicContact CD1-CG 4.2Å; Y1035-L1238 HydrophobicContact CE1-CD2 4.45Å; Y1035-L1238 HydrophobicContact CE1-CG 4.31Å; Y1035-L1246 VanDerWaalsContact O-CD1 3.22Å; Y1035-L1246 WeakPolarHBondContact O-CD1 3.02Å; Y1035-A1312 PolarHBondContact N-O 3.42Å
1036	E	81.4	Confident	84.7	Confident	63 Å²	63	57.6 Å²	57.6	29%	0.294	28%	0.278	S	S	.	.			trans	-96.8	112.1	167.9	-68.6	-153.9	-143.1	0	0	110.1	Y1034 L1246 R1250 K1253	Y1034-E1036 PolarHBondContact O-N 2.92Å; E1036-L1246 HydrophobicContact CG-CD2 4.16Å; E1036-R1250 IonicContact OE2-CZ 2.84Å; E1036-R1250 VanDerWaalsContact OE2-CZ 3.27Å; E1036-R1250 IonicContact OE2-NE 4Å; E1036-R1250 PolarHBondContact OE2-NE 3.29Å; E1036-R1250 IonicContact OE2-NH2 3.63Å; E1036-R1250 PolarHBondContact OE2-NH2 3.4Å; E1036-K1253 IonicContact OE1-NZ 2.83Å; E1036-K1253 PolarHBondContact OE1-NZ 3.31Å
1037	P	70.2	Confident	84.9	Confident	35 Å²	35	56.9 Å²	56.9	23%	0.227	27%	0.273	C	S	.	.			trans	-66.1	141.9	177.7	-18.8	30.5	0	0	0	111.9	Y1035 L1238 W1243	Y1035-P1037 HydrophobicContact CE1-CG 3.99Å; Y1035-P1037 HydrophobicContact CE2-CB 4.47Å; Y1035-P1037 HydrophobicContact CE2-CG 4.41Å; Y1035-P1037 WeakPolarHBondContact O-CD 3.44Å; P1037-L1238 HydrophobicContact CG-CD1 3.43Å; P1037-L1238 VanDerWaalsContact CG-CD1 3.43Å; P1037-L1238 HydrophobicContact CG-CG 4.36Å; P1037-W1243 HydrophobicContact CB-CH2 4.43Å; P1037-W1243 HydrophobicContact CG-CH2 4Å; P1037-W1243 HydrophobicContact CG-CZ2 4.23Å
1038	N	76	Confident	85.1	Confident	70 Å²	70	51.8 Å²	51.8	37%	0.374	25%	0.254	S	S	.	.			trans	-143.7	161.8	168.8	70.3	51.7	0	0	0	113.3	K1040 N1041 L1042	N1038-K1040 PolarHBondContact O-N 2.83Å; N1038-K1040 WeakPolarHBondContact OD1-CA 3.3Å; N1038-K1040 PolarHBondContact OD1-N 3.46Å; N1038-N1041 PolarHBondContact O-N 3.25Å; N1038-N1041 VanDerWaalsContact O-N 3.09Å; N1038-N1041 PolarHBondContact OD1-N 2.97Å; N1038-L1042 PolarHBondContact ND2-O 3.23Å; N1038-L1042 PolarHBondContact OD1-N 2.91Å; N1038-L1042 VanDerWaalsContact OD1-N 3.16Å
1039	L	73	Confident	85.1	Confident	188 Å²	188	51 Å²	51	98%	0.984	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-10.7	-176.4	-62.6	169.4	0	0	0	114.9
1040	K	78.3	Confident	84.9	Confident	175 Å²	175	49.7 Å²	49.7	76%	0.761	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107	6.9	179.2	-64.4	-172.5	178.3	-176.9	0	112.9	N1038 L1042	N1038-K1040 PolarHBondContact O-N 2.83Å; N1038-K1040 WeakPolarHBondContact OD1-CA 3.3Å; N1038-K1040 PolarHBondContact OD1-N 3.46Å; K1040-L1042 PolarHBondContact O-N 2.84Å; K1040-L1042 VanDerWaalsContact O-N 3.08Å
1041	N	83.7	Confident	84.7	Confident	69 Å²	69	49.4 Å²	49.4	37%	0.369	25%	0.247	S	C	.	.			trans	55.8	20.3	-176	-82.8	-0.2	0	0	0	114.2	N1038 Y1230 V1231	N1038-N1041 PolarHBondContact O-N 3.25Å; N1038-N1041 VanDerWaalsContact O-N 3.09Å; N1038-N1041 PolarHBondContact OD1-N 2.97Å; N1041-Y1230 CarbonylContact O-C 3.46Å; N1041-Y1230 WeakPolarHBondContact O-CA 3.5Å; N1041-V1231 WeakPolarHBondContact CB-O 3.44Å; N1041-V1231 PolarHBondContact ND2-O 3.49Å; N1041-V1231 PolarHBondContact O-N 3.43Å
1042	L	87.4	Confident	84.3	Confident	40 Å²	40	52.1 Å²	52.1	21%	0.209	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	112.9	-177.5	179	76.5	0	0	0	110	N1038 K1040 R1045 E1228 A1229 Y1230	N1038-L1042 PolarHBondContact ND2-O 3.23Å; N1038-L1042 PolarHBondContact OD1-N 2.91Å; N1038-L1042 VanDerWaalsContact OD1-N 3.16Å; K1040-L1042 PolarHBondContact O-N 2.84Å; K1040-L1042 VanDerWaalsContact O-N 3.08Å; L1042-R1045 HydrophobicContact CD2-CB 4.39Å; L1042-E1228 HydrophobicContact CD1-CB 4.09Å; L1042-E1228 HydrophobicContact CD1-CG 4.23Å; L1042-A1229 CarbonylContact C-O 3.56Å; L1042-Y1230 HydrophobicContact CB-CD1 4.2Å; L1042-Y1230 HydrophobicContact CB-CE1 4.16Å; L1042-Y1230 HydrophobicContact CD1-CD1 4.05Å; L1042-Y1230 HydrophobicContact CD1-CE1 3.7Å; L1042-Y1230 HydrophobicContact CD1-CE2 4.32Å
1043	L	87.7	Confident	84	Confident	14 Å²	14	54.5 Å²	54.5	7%	0.073	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	-43.1	178.8	-175.8	67.3	0	0	0	112.6	Y1035 L1060 L1062 A1229 V1231 W1236 W1314	Y1035-L1043 HydrophobicContact CD2-CD1 3.55Å; Y1035-L1043 HydrophobicContact CE2-CD1 4.22Å; Y1035-L1043 HydrophobicContact CG-CD1 4.39Å; L1043-L1060 HydrophobicContact CD2-CD1 4.34Å; L1043-L1060 HydrophobicContact CD2-CD2 4.21Å; L1043-L1062 HydrophobicContact CD2-CD2 3.59Å; L1043-A1229 HydrophobicContact CB-CB 4.05Å; L1043-A1229 WeakPolarHBondContact CB-O 3.45Å; L1043-A1229 HydrophobicContact CD2-CB 4.16Å; L1043-A1229 PolarHBondContact N-O 2.97Å; L1043-V1231 HydrophobicContact CB-CG2 4.04Å; L1043-V1231 HydrophobicContact CD1-CG2 4.32Å; L1043-V1231 HydrophobicContact CD2-CG2 3.93Å; L1043-V1231 HydrophobicContact CG-CG2 4.33Å; L1043-W1236 HydrophobicContact CD1-CZ3 3.92Å; L1043-W1314 HydrophobicContact CD1-CG 4.2Å; L1043-W1314 HydrophobicContact CD2-CB 3.96Å; L1043-W1314 HydrophobicContact CD2-CD2 4.4Å; L1043-W1314 HydrophobicContact CD2-CG 3.86Å; L1043-W1314 HydrophobicContact CG-CG 4.12Å
1044	F	89.7	Confident	83.9	Confident	7 Å²	7	53.4 Å²	53.4	3%	0.031	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	158.7	171.9	57.4	-104.2	0	0	0	112	R1046 L1060 L1071 I1227 E1228 A1229 W1314 M1316	F1044-R1046 HydrophobicContact CB-CG 4.49Å; F1044-R1046 HydrophobicContact CD2-CG 3.85Å; F1044-R1046 HydrophobicContact CG-CG 4.41Å; F1044-L1060 HydrophobicContact CE1-CD1 3.79Å; F1044-L1060 HydrophobicContact CE1-CD2 4.42Å; F1044-L1060 HydrophobicContact CZ-CD1 4.16Å; F1044-L1071 HydrophobicContact CZ-CD1 4.43Å; F1044-I1227 HydrophobicContact CE2-CB 4.4Å; F1044-I1227 HydrophobicContact CE2-CG2 3.98Å; F1044-E1228 WeakPolarHBondContact O-CA 3.22Å; F1044-A1229 HydrophobicContact CD1-CB 3.96Å; F1044-A1229 HydrophobicContact CD2-CB 4.17Å; F1044-A1229 HydrophobicContact CE1-CB 3.54Å; F1044-A1229 HydrophobicContact CE2-CB 3.76Å; F1044-A1229 HydrophobicContact CG-CB 4.26Å; F1044-A1229 HydrophobicContact CZ-CB 3.43Å; F1044-A1229 VanDerWaalsContact CZ-CB 3.43Å; F1044-A1229 PolarHBondContact O-N 3.04Å; F1044-A1229 VanDerWaalsContact O-N 3.13Å; F1044-W1314 HydrophobicContact CB-CH2 4.39Å; F1044-W1314 HydrophobicContact CB-CZ2 3.97Å; F1044-W1314 AromaticContact CD1-CD2 3.78Å; F1044-W1314 HydrophobicContact CD1-CD2 3.78Å; F1044-W1314 AromaticContact CD1-CE2 3.55Å; F1044-W1314 AromaticContact CD1-CE3 3.84Å; F1044-W1314 HydrophobicContact CD1-CE3 3.84Å; F1044-W1314 AromaticContact CD1-CH2 3.47Å; F1044-W1314 HydrophobicContact CD1-CH2 3.47Å; F1044-W1314 VanDerWaalsContact CD1-CH2 3.47Å; F1044-W1314 AromaticContact CD1-CZ2 3.37Å; F1044-W1314 HydrophobicContact CD1-CZ2 3.37Å; F1044-W1314 AromaticContact CD1-CZ3 3.71Å; F1044-W1314 HydrophobicContact CD1-CZ3 3.71Å; F1044-W1314 AromaticContact CE1-CD2 3.88Å; F1044-W1314 HydrophobicContact CE1-CD2 3.88Å; F1044-W1314 AromaticContact CE1-CE3 3.56Å; F1044-W1314 HydrophobicContact CE1-CE3 3.56Å; F1044-W1314 AromaticContact CE1-CH2 3.83Å; F1044-W1314 HydrophobicContact CE1-CH2 3.83Å; F1044-W1314 HydrophobicContact CE1-CZ2 4.1Å; F1044-W1314 AromaticContact CE1-CZ3 3.56Å; F1044-W1314 HydrophobicContact CE1-CZ3 3.56Å; F1044-W1314 AromaticContact CG-CH2 3.98Å; F1044-W1314 HydrophobicContact CG-CH2 3.98Å; F1044-W1314 AromaticContact CG-CZ2 3.93Å; F1044-W1314 HydrophobicContact CG-CZ2 3.93Å; F1044-W1314 HydrophobicContact CZ-CZ3 4.28Å; F1044-M1316 HydrophobicContact CE2-CE 3.82Å; F1044-M1316 HydrophobicContact CE2-SD 3.89Å; F1044-M1316 HydrophobicContact CZ-CE 3.81Å; F1044-M1316 HydrophobicContact CZ-SD 3.54Å; F1044-M1316 VanDerWaalsContact CZ-SD 3.54Å
1045	R	88	Confident	83.9	Confident	62 Å²	62	52.9 Å²	52.9	23%	0.234	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	126.3	161.8	-175	179.4	-136.6	-146.8	3.5	108.6	L1042 W1226 I1227 E1228	L1042-R1045 HydrophobicContact CD2-CB 4.39Å; R1045-W1226 HydrophobicContact CG-CD2 4.23Å; R1045-W1226 HydrophobicContact CG-CE3 3.51Å; R1045-W1226 HydrophobicContact CG-CZ3 3.89Å; R1045-I1227 WeakPolarHBondContact CA-O 3.35Å; R1045-E1228 HydrophobicContact CB-CG 4.17Å; R1045-E1228 HydrophobicContact CG-CG 3.86Å; R1045-E1228 IonicContact CZ-OE1 3.86Å; R1045-E1228 VanDerWaalsContact CZ-OE1 3.27Å; R1045-E1228 IonicContact NE-OE1 2.74Å; R1045-E1228 PolarHBondContact NE-OE1 3.1Å; R1045-E1228 IonicContact NH2-OE1 3.87Å; R1045-E1228 PolarHBondContact NH2-OE1 3.4Å
1046	R	88.3	Confident	84.2	Confident	16 Å²	16	52.4 Å²	52.4	6%	0.06	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	128	-179.5	-60.6	-71.1	162.7	116.2	-2.5	109.5	D1033 F1044 I1227 I1328	D1033-R1046 IonicContact OD2-CZ 3.62Å; D1033-R1046 IonicContact OD2-NH1 2.71Å; D1033-R1046 IonicContact OD2-NH2 3.73Å; D1033-R1046 PolarHBondContact OD2-NH2 3.21Å; F1044-R1046 HydrophobicContact CB-CG 4.49Å; F1044-R1046 HydrophobicContact CD2-CG 3.85Å; F1044-R1046 HydrophobicContact CG-CG 4.41Å; R1046-I1227 PolarHBondContact N-O 3.12Å; R1046-I1227 PolarHBondContact O-N 3.43Å; R1046-I1328 HydrophobicContact CB-CG2 3.9Å
1047	R	88.3	Confident	84.7	Confident	33 Å²	33	49.5 Å²	49.5	13%	0.125	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	131	179.8	-159.6	177.2	97.5	161.8	9.3	109.8	Y1225 W1226 I1328 M1329 M1331	R1047-Y1225 WeakPolarHBondContact CA-O 3.49Å; R1047-Y1225 WeakPolarHBondContact CG-O 3.18Å; R1047-W1226 HydrophobicContact CB-CE3 3.84Å; R1047-W1226 HydrophobicContact CB-CH2 4.37Å; R1047-W1226 HydrophobicContact CB-CZ3 3.76Å; R1047-W1226 HydrophobicContact CG-CD2 4.39Å; R1047-W1226 HydrophobicContact CG-CE3 4.17Å; R1047-W1226 HydrophobicContact CG-CH2 4.46Å; R1047-W1226 HydrophobicContact CG-CZ3 4.23Å; R1047-I1328 CarbonylContact O-C 3.6Å; R1047-I1328 WeakPolarHBondContact O-CA 3.4Å; R1047-M1329 HydrophobicContact CB-CB 4.46Å; R1047-M1329 PolarHBondContact N-O 3.48Å; R1047-M1329 PolarHBondContact O-N 3.15Å; R1047-M1331 HydrophobicContact CB-CG 4.34Å
1048	I	89	Confident	85.8	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	144.2	165.9	-65.7	173.8	0	0	0	108.9	I1056 I1096 Y1225 I1227 I1326	I1048-I1056 HydrophobicContact CD1-CD1 4.25Å; I1048-I1096 HydrophobicContact CB-CD1 4.1Å; I1048-I1096 HydrophobicContact CD1-CD1 3.34Å; I1048-I1096 HydrophobicContact CG1-CD1 4.31Å; I1048-I1096 HydrophobicContact CG2-CD1 3.65Å; I1048-I1096 HydrophobicContact CG2-CG2 4.33Å; I1048-Y1225 PolarHBondContact N-O 3.49Å; I1048-I1227 HydrophobicContact CD1-CD1 3.74Å; I1048-I1227 HydrophobicContact CD1-CG1 3.52Å; I1048-I1227 HydrophobicContact CG1-CD1 3.92Å; I1048-I1227 HydrophobicContact CG1-CG1 3.81Å; I1048-I1326 HydrophobicContact CG2-CG2 3.83Å
1049	I	87.2	Confident	86.6	Confident	35 Å²	35	45.6 Å²	45.6	18%	0.179	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	126.3	167	-64.5	166.9	0	0	0	106.3	D1099 I1326 K1327 M1329	I1049-D1099 WeakPolarHBondContact CG2-OD2 3.15Å; I1049-I1326 WeakPolarHBondContact O-CA 3.49Å; I1049-K1327 HydrophobicContact CB-CB 4.33Å; I1049-K1327 PolarHBondContact N-O 3.37Å; I1049-K1327 PolarHBondContact O-N 3.37Å; I1049-M1329 HydrophobicContact CD1-CG 4.26Å; I1049-M1329 HydrophobicContact CD1-SD 3.65Å
1050	A	86.1	Confident	87.6	Confident	3 Å²	3	36.6 Å²	36.6	3%	0.025	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	133.6	175.2	0	0	0	0	0	111	I1096 A1098 D1099 D1325	A1050-I1096 HydrophobicContact CB-CB 4.37Å; A1050-I1096 HydrophobicContact CB-CG2 3.57Å; A1050-A1098 WeakPolarHBondContact O-CA 3.49Å; A1050-D1099 PolarHBondContact O-N 3.23Å; A1050-D1325 CarbonylContact C-O 3.49Å; A1050-D1325 WeakPolarHBondContact CA-O 3.27Å
1051	S	83	Confident	88.1	Confident	66 Å²	66	29 Å²	29	46%	0.462	15%	0.15	S	C	.	.	S	Bend	trans	-89.6	-23.8	-179.3	-43.2	0	0	0	0	112.3	N1324 D1325	S1051-N1324 PolarHBondContact OG-O 3.3Å; S1051-D1325 WeakPolarHBondContact CB-O 3.41Å; S1051-D1325 PolarHBondContact N-O 2.76Å; S1051-D1325 PolarHBondContact OG-O 3.35Å
1052	N	81	Confident	88.5	Confident	93 Å²	93	25.7 Å²	25.7	50%	0.497	13%	0.133	S	C	.	.	S	Bend	trans	-145.5	152.9	179.8	-65	-61.5	0	0	0	107.4	S1054 D1325	N1052-S1054 WeakPolarHBondContact O-CB 3.33Å; N1052-S1054 PolarHBondContact O-N 3.37Å; N1052-S1054 PolarHBondContact O-OG 3.07Å; N1052-D1325 PolarHBondContact ND2-OD1 2.81Å
1053	D	84.6	Confident	88.5	Confident	111 Å²	111	23.9 Å²	23.9	59%	0.594	12%	0.123	S	C	*	.			trans	-55.3	115.1	174.6	-69.6	-1.3	0	0	0	110.5	I1096 L1097 A1098	D1053-I1096 CarbonylContact C-O 3.58Å; D1053-I1096 WeakPolarHBondContact CA-O 3.03Å; D1053-L1097 WeakPolarHBondContact OD1-CA 2.97Å; D1053-A1098 PolarHBondContact OD1-N 3.3Å
1054	S	85.5	Confident	88.4	Confident	8 Å²	8	24 Å²	24	6%	0.056	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	113.1	-163.1	-70.8	0	0	0	0	111.8	N1052 I1056 I1096 D1325	N1052-S1054 WeakPolarHBondContact O-CB 3.33Å; N1052-S1054 PolarHBondContact O-N 3.37Å; N1052-S1054 PolarHBondContact O-OG 3.07Å; S1054-I1056 PolarHBondContact O-N 3.11Å; S1054-I1096 PolarHBondContact N-O 3.43Å; S1054-I1096 PolarHBondContact O-N 3.26Å; S1054-D1325 WeakPolarHBondContact OG-CB 3.34Å
1055	L	88.3	Confident	88	Confident	11 Å²	11	24.5 Å²	24.5	6%	0.058	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	131.6	163.8	-173.2	64.3	0	0	0	109.5	R913 A1093 Y1094 I1095	R913-L1055 HydrophobicContact CG-CD2 3.87Å; R913-L1055 PolarHBondContact NH1-O 3.23Å; R913-L1055 PolarHBondContact NH2-O 3.42Å; L1055-A1093 HydrophobicContact CD1-CB 4.12Å; L1055-Y1094 CarbonylContact C-O 3.23Å; L1055-Y1094 WeakPolarHBondContact CA-O 3.42Å; L1055-I1095 HydrophobicContact CD1-CG1 3.78Å
1056	I	91.3	Very high	87.7	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	156.7	177.2	57.2	155.5	0	0	0	112.5	R913 I1048 S1054 I1058 I1073 A1093 Y1094 I1096 I1319 C1320 I1326	R913-I1056 VanDerWaalsContact NH1-CA 3.31Å; I1048-I1056 HydrophobicContact CD1-CD1 4.25Å; S1054-I1056 PolarHBondContact O-N 3.11Å; I1056-I1058 HydrophobicContact CD1-CD1 3.85Å; I1056-I1058 HydrophobicContact CD1-CG1 3.9Å; I1056-I1073 HydrophobicContact CD1-CD1 3.82Å; I1056-A1093 CarbonylContact O-C 3.53Å; I1056-A1093 VanDerWaalsContact O-CA 3.31Å; I1056-A1093 WeakPolarHBondContact O-CA 3.33Å; I1056-Y1094 VanDerWaalsContact CG1-O 3.25Å; I1056-Y1094 WeakPolarHBondContact CG1-O 3.32Å; I1056-Y1094 PolarHBondContact N-O 2.91Å; I1056-Y1094 PolarHBondContact O-N 3.47Å; I1056-I1096 HydrophobicContact CD1-CD1 3.46Å; I1056-I1096 VanDerWaalsContact CD1-CD1 3.46Å; I1056-I1096 HydrophobicContact CD1-CG1 3.95Å; I1056-I1096 HydrophobicContact CG1-CD1 4.15Å; I1056-I1096 HydrophobicContact CG1-CG1 4.17Å; I1056-I1319 WeakPolarHBondContact CA-O 3.33Å; I1056-C1320 HydrophobicContact CG2-CB 4.44Å; I1056-I1326 HydrophobicContact CG2-CD1 3.2Å
1057	T	92.4	Very high	87.6	Confident	3 Å²	3	23.2 Å²	23.2	2%	0.018	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	123.7	172.4	-56.4	0	0	0	0	106.6	R913 I1091 Y1092 I1318 I1319	R913-T1057 VanDerWaalsContact CD-OG1 3.28Å; R913-T1057 WeakPolarHBondContact CD-OG1 3.21Å; R913-T1057 VanDerWaalsContact NH1-N 3.15Å; R913-T1057 PolarHBondContact NH1-OG1 2.96Å; T1057-I1091 CarbonylContact C-O 3.57Å; T1057-I1091 WeakPolarHBondContact CA-O 3.38Å; T1057-Y1092 VanDerWaalsContact CB-O 3.31Å; T1057-Y1092 WeakPolarHBondContact CB-O 3.48Å; T1057-Y1092 VanDerWaalsContact CG2-O 3.26Å; T1057-Y1092 WeakPolarHBondContact CG2-O 3.26Å; T1057-Y1092 PolarHBondContact OG1-O 3.44Å; T1057-I1318 WeakPolarHBondContact O-CA 3.45Å; T1057-I1319 PolarHBondContact N-O 3.06Å; T1057-I1319 VanDerWaalsContact N-O 3.08Å; T1057-I1319 PolarHBondContact O-N 2.83Å
1058	I	93.5	Very high	87.7	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.3	-177.9	-44.4	-172.8	0	0	0	109.2	I1056 L1071 I1073 C1090 I1091 I1227 M1316 R1317 I1318	I1056-I1058 HydrophobicContact CD1-CD1 3.85Å; I1056-I1058 HydrophobicContact CD1-CG1 3.9Å; I1058-L1071 HydrophobicContact CB-CD2 4.05Å; I1058-L1071 HydrophobicContact CG2-CD1 4.39Å; I1058-L1071 HydrophobicContact CG2-CD2 3.72Å; I1058-I1073 HydrophobicContact CD1-CD1 3.87Å; I1058-I1073 HydrophobicContact CD1-CG1 4.05Å; I1058-C1090 CarbonylContact O-C 3.58Å; I1058-C1090 VanDerWaalsContact O-CA 3.3Å; I1058-C1090 WeakPolarHBondContact O-CA 3.26Å; I1058-C1090 PolarHBondContact O-SG 3.38Å; I1058-I1091 HydrophobicContact CB-CB 4.41Å; I1058-I1091 PolarHBondContact N-O 3.35Å; I1058-I1091 PolarHBondContact O-N 2.93Å; I1058-I1227 HydrophobicContact CD1-CD1 4.21Å; I1058-I1227 HydrophobicContact CD1-CG1 4.21Å; I1058-I1227 HydrophobicContact CD1-CG2 4.2Å; I1058-M1316 HydrophobicContact CG2-CG 3.74Å; I1058-M1316 HydrophobicContact CG2-SD 3.57Å; I1058-M1316 VanDerWaalsContact CG2-SD 3.57Å; I1058-R1317 WeakPolarHBondContact CA-O 3.19Å; I1058-I1318 HydrophobicContact CB-CG1 4.38Å; I1058-I1318 HydrophobicContact CG1-CG1 4.14Å; I1058-I1318 HydrophobicContact CG2-CG1 3.87Å
1059	H	92.4	Very high	87.9	Confident	22 Å²	22	25.2 Å²	25.2	10%	0.102	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	116.5	170.4	-167.9	-145.5	0	0	0	109.9	W907 M1316 R1317	W907-H1059 HydrophobicContact CE3-CB 4.24Å; W907-H1059 AromaticContact CE3-ND1 3.19Å; W907-H1059 HydrophobicContact CZ3-CB 4.05Å; W907-H1059 AromaticContact CZ3-ND1 3.53Å; H1059-M1316 CarbonylContact O-C 3.53Å; H1059-M1316 WeakPolarHBondContact O-CA 3.44Å; H1059-R1317 PolarHBondContact N-O 2.94Å; H1059-R1317 PolarHBondContact O-N 3.08Å
1060	L	92.8	Very high	88.2	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	140.5	171.4	175.2	62.6	0	0	0	109.5	L1043 F1044 L1062 L1071 G1088 A1089 A1229 W1314 M1316	L1043-L1060 HydrophobicContact CD2-CD1 4.34Å; L1043-L1060 HydrophobicContact CD2-CD2 4.21Å; F1044-L1060 HydrophobicContact CE1-CD1 3.79Å; F1044-L1060 HydrophobicContact CE1-CD2 4.42Å; F1044-L1060 HydrophobicContact CZ-CD1 4.16Å; L1060-L1062 HydrophobicContact CD1-CD2 4.18Å; L1060-L1062 HydrophobicContact CD2-CD2 4.41Å; L1060-L1062 HydrophobicContact CG-CD2 4.21Å; L1060-L1071 HydrophobicContact CB-CD1 4.41Å; L1060-L1071 HydrophobicContact CB-CD2 4.06Å; L1060-L1071 HydrophobicContact CD2-CB 4.45Å; L1060-L1071 HydrophobicContact CD2-CD1 4.38Å; L1060-G1088 CarbonylContact O-C 3.55Å; L1060-G1088 WeakPolarHBondContact O-CA 2.99Å; L1060-A1089 PolarHBondContact N-O 3.36Å; L1060-A1089 PolarHBondContact O-N 2.83Å; L1060-A1229 HydrophobicContact CD2-CB 3.64Å; L1060-W1314 HydrophobicContact CD1-CB 4.39Å; L1060-W1314 HydrophobicContact CD1-CE3 4.24Å; L1060-M1316 HydrophobicContact CD1-CB 4.22Å
1061	R	90.2	Very high	88.6	Confident	15 Å²	15	26.3 Å²	26.3	6%	0.057	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	141.9	177.3	-125.4	-177.3	164	-170.1	-11.7	110.1	M888 K905 D906 W907 G1087 W1314 K1315	M888-R1061 HydrophobicContact CE-CB 3.91Å; M888-R1061 HydrophobicContact CE-CG 3.59Å; M888-R1061 HydrophobicContact SD-CB 3.75Å; M888-R1061 HydrophobicContact SD-CG 4.07Å; K905-R1061 VanDerWaalsContact O-CZ 3.26Å; K905-R1061 PolarHBondContact O-NE 3.22Å; K905-R1061 PolarHBondContact O-NH2 3.41Å; D906-R1061 IonicContact OD1-CZ 3.23Å; D906-R1061 IonicContact OD1-NH1 3.89Å; D906-R1061 PolarHBondContact OD1-NH1 2.69Å; D906-R1061 IonicContact OD1-NH2 3Å; D906-R1061 PolarHBondContact OD1-NH2 2.65Å; W907-R1061 VanDerWaalsContact CD1-NH1 3.34Å; W907-R1061 HydrophobicContact CH2-CB 4.05Å; W907-R1061 HydrophobicContact CZ2-CB 4.29Å; R1061-G1087 WeakPolarHBondContact CA-O 3.39Å; R1061-W1314 WeakPolarHBondContact O-CA 3.5Å; R1061-K1315 PolarHBondContact N-O 3.36Å; R1061-K1315 PolarHBondContact O-N 2.66Å
1062	L	90.9	Very high	89.2	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	144	-175.1	-51.3	-177.5	0	0	0	110.5	M888 L1043 L1060 V1064 V1067 T1069 G1087 V1231 W1236 W1314	M888-L1062 WeakPolarHBondContact CE-O 3.08Å; L1043-L1062 HydrophobicContact CD2-CD2 3.59Å; L1060-L1062 HydrophobicContact CD1-CD2 4.18Å; L1060-L1062 HydrophobicContact CD2-CD2 4.41Å; L1060-L1062 HydrophobicContact CG-CD2 4.21Å; L1062-V1064 PolarHBondContact O-N 3.19Å; L1062-V1067 HydrophobicContact CD1-CB 4.13Å; L1062-V1067 HydrophobicContact CD1-CG1 3.66Å; L1062-T1069 HydrophobicContact CD1-CG2 3.92Å; L1062-T1069 HydrophobicContact CG-CG2 4.45Å; L1062-G1087 PolarHBondContact N-O 3.5Å; L1062-V1231 HydrophobicContact CD1-CG2 3.86Å; L1062-W1236 HydrophobicContact CB-CH2 3.92Å; L1062-W1236 HydrophobicContact CB-CZ2 4.44Å; L1062-W1236 HydrophobicContact CB-CZ3 4.3Å; L1062-W1236 HydrophobicContact CD1-CZ3 4.07Å; L1062-W1236 HydrophobicContact CD2-CH2 4.04Å; L1062-W1236 HydrophobicContact CD2-CZ3 3.97Å; L1062-W1236 HydrophobicContact CG-CH2 4.38Å; L1062-W1236 HydrophobicContact CG-CZ3 4.34Å; L1062-W1314 HydrophobicContact CD2-CB 3.69Å
1063	S	88.1	Confident	89.8	Confident	2 Å²	2	18.8 Å²	18.8	1%	0.014	9%	0.091	C	C	.	.	S	Bend	trans	-66.2	5	-178.6	72.2	0	0	0	0	115.5	H889 H890 T891 H1313	H889-S1063 WeakPolarHBondContact O-CB 3.06Å; H890-S1063 CarbonylContact C-O 3.54Å; H890-S1063 WeakPolarHBondContact CA-O 3.28Å; T891-S1063 PolarHBondContact N-O 3.41Å; T891-S1063 PolarHBondContact OG1-O 3.32Å; T891-S1063 PolarHBondContact OG1-OG 3.39Å; S1063-H1313 VanDerWaalsContact CB-CE1 3.43Å; S1063-H1313 WeakPolarHBondContact CB-CE1 3.5Å; S1063-H1313 WeakPolarHBondContact CB-O 3.29Å; S1063-H1313 PolarHBondContact N-O 3.33Å; S1063-H1313 PolarHBondContact OG-N 3.31Å; S1063-H1313 VanDerWaalsContact OG-N 3.1Å; S1063-H1313 PolarHBondContact OG-O 2.94Å
1064	V	86.2	Confident	90.1	Very high	15 Å²	15	14.9 Å²	14.9	9%	0.091	7%	0.069	C	C	.	.			trans	-134.3	121.1	172.2	-174.6	0	0	0	0	109.5	L1062 V1067 W1236	L1062-V1064 PolarHBondContact O-N 3.19Å; V1064-V1067 HydrophobicContact CB-CG2 3.68Å; V1064-V1067 HydrophobicContact CG1-CG2 3.72Å; V1064-W1236 VanDerWaalsContact CG2-NE1 3.3Å
1065	P	80	Confident	90.2	Very high	18 Å²	18	17.6 Å²	17.6	12%	0.117	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-24.5	-171.1	30.4	-35.7	0	0	0	114	H890 V1067 Y1086 G1087	H890-P1065 WeakPolarHBondContact CD2-CD 3.42Å; H890-P1065 WeakPolarHBondContact NE2-CD 3.41Å; P1065-V1067 PolarHBondContact O-N 3.1Å; P1065-Y1086 CarbonylContact O-C 3.24Å; P1065-Y1086 WeakPolarHBondContact O-CB 3.28Å; P1065-G1087 WeakPolarHBondContact O-CA 3.41Å; P1065-G1087 PolarHBondContact O-N 2.89Å
1066	N	82.3	Confident	89.9	Confident	52 Å²	52	17.1 Å²	17.1	28%	0.278	8%	0.08	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	3.7	-177.5	-65.5	-4.4	0	0	0	113.3	F896	F896-N1066 WeakPolarHBondContact CG-ND2 3.38Å
1067	V	87.4	Confident	89.4	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.11	C	C	.	.			trans	-87.9	117.2	-176.7	173.9	0	0	0	0	110.5	L1062 V1064 P1065 Y1086 G1087 V1231 N1235 W1236	L1062-V1067 HydrophobicContact CD1-CB 4.13Å; L1062-V1067 HydrophobicContact CD1-CG1 3.66Å; V1064-V1067 HydrophobicContact CB-CG2 3.68Å; V1064-V1067 HydrophobicContact CG1-CG2 3.72Å; P1065-V1067 PolarHBondContact O-N 3.1Å; V1067-Y1086 CarbonylContact O-C 3.58Å; V1067-Y1086 WeakPolarHBondContact O-CA 3.5Å; V1067-G1087 PolarHBondContact O-N 3.07Å; V1067-V1231 HydrophobicContact CG1-CB 4.5Å; V1067-V1231 HydrophobicContact CG1-CG1 3.19Å; V1067-N1235 WeakPolarHBondContact CG2-O 3.46Å; V1067-W1236 HydrophobicContact CG1-CB 4.06Å; V1067-W1236 HydrophobicContact CG1-CD2 4.38Å; V1067-W1236 HydrophobicContact CG1-CE3 4.19Å; V1067-W1236 HydrophobicContact CG1-CG 4.42Å; V1067-W1236 HydrophobicContact CG2-CB 3.69Å; V1067-W1236 HydrophobicContact CG2-CD2 4.28Å; V1067-W1236 HydrophobicContact CG2-CG 3.82Å
1068	Y	90.6	Very high	89	Confident	76 Å²	76	29.3 Å²	29.3	30%	0.298	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	132.9	173.9	-179.2	-98.6	0	0	0	111.5	E1084 G1085 Y1086 D1232	Y1068-E1084 HydrophobicContact CE2-CB 4.27Å; Y1068-E1084 PolarHBondContact OH-OE1 3.18Å; Y1068-E1084 PolarHBondContact OH-OE2 3.16Å; Y1068-G1085 WeakPolarHBondContact CA-O 3.29Å; Y1068-Y1086 HydrophobicContact CD2-CD2 4.38Å; Y1068-Y1086 HydrophobicContact CD2-CE1 4.18Å; Y1068-Y1086 AromaticContact CD2-CE2 3.95Å; Y1068-Y1086 HydrophobicContact CD2-CE2 3.95Å; Y1068-Y1086 AromaticContact CD2-CZ 3.84Å; Y1068-Y1086 HydrophobicContact CG-CE1 4.45Å; Y1068-D1232 PolarHBondContact O-N 3.25Å
1069	T	92.2	Very high	88.8	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	144.2	-179.2	-175.3	0	0	0	0	112.9	L1062 E1084 G1085 A1089 Y1230	L1062-T1069 HydrophobicContact CD1-CG2 3.92Å; L1062-T1069 HydrophobicContact CG-CG2 4.45Å; T1069-E1084 WeakPolarHBondContact O-CA 3.27Å; T1069-G1085 PolarHBondContact N-O 2.78Å; T1069-G1085 PolarHBondContact O-N 3.49Å; T1069-A1089 HydrophobicContact CG2-CB 4.24Å; T1069-Y1230 CarbonylContact C-O 3.47Å; T1069-Y1230 WeakPolarHBondContact CA-O 3.32Å; T1069-Y1230 WeakPolarHBondContact CB-O 3.32Å; T1069-Y1230 PolarHBondContact OG1-O 2.71Å
1070	R	94	Very high	88.6	Confident	61 Å²	61	35.1 Å²	35.1	23%	0.23	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	124.4	172.5	-179.8	-178.2	-179.8	118.9	-11.8	108.9	E1079 F1082 A1083 E1084 A1229 Y1230	R1070-E1079 IonicContact CZ-OE1 2.65Å; R1070-E1079 IonicContact CZ-OE2 2.97Å; R1070-E1079 IonicContact NE-OE1 2.67Å; R1070-E1079 PolarHBondContact NE-OE1 3.45Å; R1070-E1079 VanDerWaalsContact NE-OE1 3.11Å; R1070-E1079 IonicContact NH2-OE1 2.59Å; R1070-E1079 PolarHBondContact NH2-OE1 2.81Å; R1070-E1079 IonicContact NH2-OE2 2.69Å; R1070-E1079 PolarHBondContact NH2-OE2 3.1Å; R1070-F1082 HydrophobicContact CG-CD2 4.41Å; R1070-F1082 VanDerWaalsContact CZ-CD2 3.49Å; R1070-A1083 CarbonylContact C-O 3.59Å; R1070-A1083 WeakPolarHBondContact CA-O 3.29Å; R1070-E1084 HydrophobicContact CB-CG 3.85Å; R1070-E1084 WeakPolarHBondContact CD-OE1 3.47Å; R1070-E1084 HydrophobicContact CG-CG 3.77Å; R1070-E1084 IonicContact CZ-OE1 2.87Å; R1070-E1084 IonicContact NE-OE1 3.04Å; R1070-E1084 IonicContact NH1-OE1 2.73Å; R1070-E1084 PolarHBondContact NH1-OE1 2.83Å; R1070-A1229 CarbonylContact O-C 3.57Å; R1070-A1229 WeakPolarHBondContact O-CA 3.43Å; R1070-Y1230 PolarHBondContact N-O 2.81Å; R1070-Y1230 PolarHBondContact O-N 3.44Å
1071	L	95.1	Very high	88.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	127.5	173.5	173.1	70.2	0	0	0	108.1	F1044 I1058 L1060 F1082 A1083 A1089 I1091 I1227 A1229 M1316	F1044-L1071 HydrophobicContact CZ-CD1 4.43Å; I1058-L1071 HydrophobicContact CB-CD2 4.05Å; I1058-L1071 HydrophobicContact CG2-CD1 4.39Å; I1058-L1071 HydrophobicContact CG2-CD2 3.72Å; L1060-L1071 HydrophobicContact CB-CD1 4.41Å; L1060-L1071 HydrophobicContact CB-CD2 4.06Å; L1060-L1071 HydrophobicContact CD2-CB 4.45Å; L1060-L1071 HydrophobicContact CD2-CD1 4.38Å; L1071-F1082 CarbonylContact O-C 3.59Å; L1071-F1082 VanDerWaalsContact O-CA 3.27Å; L1071-F1082 WeakPolarHBondContact O-CA 3.18Å; L1071-A1083 PolarHBondContact N-O 3.06Å; L1071-A1083 PolarHBondContact O-N 3.28Å; L1071-A1089 HydrophobicContact CB-CB 3.77Å; L1071-I1091 HydrophobicContact CD2-CD1 4.18Å; L1071-I1091 HydrophobicContact CD2-CG1 4.18Å; L1071-I1091 HydrophobicContact CG-CD1 4.02Å; L1071-I1091 HydrophobicContact CG-CG1 4.44Å; L1071-I1227 HydrophobicContact CD1-CG2 3.65Å; L1071-A1229 HydrophobicContact CD1-CB 4.32Å; L1071-M1316 HydrophobicContact CD1-SD 4.49Å
1072	C	94.3	Very high	88.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	158.3	176.8	66.1	0	0	0	0	114	E1079 I1081 F1082 I1227 E1228	C1072-E1079 HydrophobicContact CB-CG 3.98Å; C1072-E1079 WeakPolarHBondContact CB-OE1 3.38Å; C1072-E1079 PolarHBondContact SG-OE1 2.91Å; C1072-I1081 CarbonylContact C-O 3.59Å; C1072-I1081 VanDerWaalsContact CA-O 3.29Å; C1072-I1081 WeakPolarHBondContact CA-O 3.35Å; C1072-I1081 WeakPolarHBondContact CB-O 3Å; C1072-F1082 HydrophobicContact CB-CB 3.56Å; C1072-I1227 WeakPolarHBondContact O-CA 3.35Å; C1072-E1228 PolarHBondContact N-O 3.41Å; C1072-E1228 PolarHBondContact O-N 3.07Å
1073	I	93.6	Very high	88.7	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	127.6	169.5	-58.8	170.4	0	0	0	107	I1056 I1058 M1080 I1081 I1091 Y1094 Y1225 W1226	I1056-I1073 HydrophobicContact CD1-CD1 3.82Å; I1058-I1073 HydrophobicContact CD1-CD1 3.87Å; I1058-I1073 HydrophobicContact CD1-CG1 4.05Å; I1073-M1080 PolarHBondContact O-N 2.9Å; I1073-I1081 HydrophobicContact CB-CG2 3.9Å; I1073-I1081 HydrophobicContact CD1-CG2 3.84Å; I1073-I1081 HydrophobicContact CG1-CG2 4.13Å; I1073-I1081 PolarHBondContact N-O 3.02Å; I1073-I1081 PolarHBondContact O-N 3.26Å; I1073-I1091 HydrophobicContact CD1-CD1 4.07Å; I1073-I1091 HydrophobicContact CD1-CG2 4.48Å; I1073-I1091 HydrophobicContact CG1-CD1 3.9Å; I1073-Y1094 HydrophobicContact CD1-CD1 3.7Å; I1073-Y1094 HydrophobicContact CD1-CE1 4.44Å; I1073-Y1094 HydrophobicContact CD1-CG 3.87Å; I1073-Y1094 HydrophobicContact CG2-CD1 4.45Å; I1073-Y1094 HydrophobicContact CG2-CE1 4.16Å; I1073-Y1225 HydrophobicContact CG2-CD1 4.31Å; I1073-W1226 CarbonylContact C-O 3.59Å; I1073-W1226 WeakPolarHBondContact CA-O 3.31Å
1074	K	90.7	Very high	88.9	Confident	30 Å²	30	46.4 Å²	46.4	13%	0.13	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	152.9	172.4	-56.1	-170.5	178.3	162.8	0	110.5	K1078 E1079 Y1225 W1226 E1228 Y1230	K1074-K1078 CarbonylContact C-O 3.57Å; K1074-K1078 WeakPolarHBondContact CA-O 3.33Å; K1074-K1078 WeakPolarHBondContact CB-O 3.31Å; K1074-E1079 HydrophobicContact CG-CB 4.39Å; K1074-E1079 HydrophobicContact CG-CG 4.46Å; K1074-Y1225 WeakPolarHBondContact O-CA 3.29Å; K1074-W1226 HydrophobicContact CB-CB 4.46Å; K1074-W1226 PolarHBondContact N-O 3.26Å; K1074-W1226 PolarHBondContact O-N 2.94Å; K1074-E1228 VanDerWaalsContact CE-OE2 3.27Å; K1074-E1228 WeakPolarHBondContact CE-OE2 3.45Å; K1074-E1228 IonicContact NZ-OE2 2.71Å; K1074-E1228 PolarHBondContact NZ-OE2 3.19Å; K1074-Y1230 PolarHBondContact NZ-OH 2.9Å
1075	M	87.6	Confident	89	Confident	64 Å²	64	46.5 Å²	46.5	32%	0.315	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	110.2	162.2	-161.3	172.6	81.2	0	0	105.5	N1077 K1078 M1080 E1222 Y1224 Y1225	M1075-N1077 PolarHBondContact O-N 2.88Å; M1075-K1078 PolarHBondContact N-O 3.07Å; M1075-K1078 WeakPolarHBondContact O-CB 3.36Å; M1075-K1078 PolarHBondContact O-N 3.27Å; M1075-M1080 HydrophobicContact CB-CG 3.93Å; M1075-M1080 HydrophobicContact CB-SD 4.31Å; M1075-E1222 CarbonylContact C-O 3.58Å; M1075-Y1224 WeakPolarHBondContact CA-O 3.49Å; M1075-Y1225 HydrophobicContact CB-CD1 4.03Å; M1075-Y1225 HydrophobicContact CB-CE1 3.9Å; M1075-Y1225 HydrophobicContact CG-CD1 4Å; M1075-Y1225 HydrophobicContact CG-CE1 3.75Å; M1075-Y1225 HydrophobicContact SD-CD1 4.42Å; M1075-Y1225 HydrophobicContact SD-CE1 3.6Å; M1075-Y1225 VanDerWaalsContact SD-CE1 3.6Å; M1075-Y1225 HydrophobicContact SD-CE2 4.4Å
1076	G	82.8	Confident	89.4	Confident	2 Å²	2	52.8 Å²	52.8	2%	0.021	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	-126.4	-165.5	0	0	0	0	0	112.7	E1221 E1222 Y1224	G1076-E1221 WeakPolarHBondContact CA-O 3.43Å; G1076-E1222 WeakPolarHBondContact CA-O 3.29Å; G1076-E1222 PolarHBondContact N-O 3.37Å; G1076-Y1224 PolarHBondContact N-O 3.36Å
1077	N	81	Confident	89.6	Confident	121 Å²	121	50.7 Å²	50.7	65%	0.647	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-14.6	173.7	-67.5	-52.1	0	0	0	113.6	M1075	M1075-N1077 PolarHBondContact O-N 2.88Å
1078	K	84.4	Confident	89.7	Confident	138 Å²	138	51.3 Å²	51.3	60%	0.6	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	122	-174.4	-177.3	-177.6	176.1	-175.1	0	111.6	K1074 M1075 M1080	K1074-K1078 CarbonylContact C-O 3.57Å; K1074-K1078 WeakPolarHBondContact CA-O 3.33Å; K1074-K1078 WeakPolarHBondContact CB-O 3.31Å; M1075-K1078 PolarHBondContact N-O 3.07Å; M1075-K1078 WeakPolarHBondContact O-CB 3.36Å; M1075-K1078 PolarHBondContact O-N 3.27Å; K1078-M1080 HydrophobicContact CD-SD 4.1Å; K1078-M1080 HydrophobicContact CG-SD 4.31Å
1079	E	88.4	Confident	89.8	Confident	74 Å²	74	48 Å²	48	35%	0.346	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	126.8	172.4	-160.1	171.4	-149.4	0	0	110.7	R1070 C1072 K1074	R1070-E1079 IonicContact CZ-OE1 2.65Å; R1070-E1079 IonicContact CZ-OE2 2.97Å; R1070-E1079 IonicContact NE-OE1 2.67Å; R1070-E1079 PolarHBondContact NE-OE1 3.45Å; R1070-E1079 VanDerWaalsContact NE-OE1 3.11Å; R1070-E1079 IonicContact NH2-OE1 2.59Å; R1070-E1079 PolarHBondContact NH2-OE1 2.81Å; R1070-E1079 IonicContact NH2-OE2 2.69Å; R1070-E1079 PolarHBondContact NH2-OE2 3.1Å; C1072-E1079 HydrophobicContact CB-CG 3.98Å; C1072-E1079 WeakPolarHBondContact CB-OE1 3.38Å; C1072-E1079 PolarHBondContact SG-OE1 2.91Å; K1074-E1079 HydrophobicContact CG-CB 4.39Å; K1074-E1079 HydrophobicContact CG-CG 4.46Å
1080	M	88.1	Confident	89.8	Confident	69 Å²	69	48.9 Å²	48.9	34%	0.34	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	-39.9	-175.3	-65.4	-63.4	-66.4	0	0	112	I1073 M1075 K1078 Y1094	I1073-M1080 PolarHBondContact O-N 2.9Å; M1075-M1080 HydrophobicContact CB-CG 3.93Å; M1075-M1080 HydrophobicContact CB-SD 4.31Å; K1078-M1080 HydrophobicContact CD-SD 4.1Å; K1078-M1080 HydrophobicContact CG-SD 4.31Å; M1080-Y1094 HydrophobicContact CB-CE2 4.11Å; M1080-Y1094 WeakPolarHBondContact CE-OH 3.48Å
1081	I	90.7	Very high	89.7	Confident	53 Å²	53	46.2 Å²	46.2	27%	0.272	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	148.2	174.4	-175.4	162	0	0	0	109.7	C1072 I1073 I1091 Y1094	C1072-I1081 CarbonylContact C-O 3.59Å; C1072-I1081 VanDerWaalsContact CA-O 3.29Å; C1072-I1081 WeakPolarHBondContact CA-O 3.35Å; C1072-I1081 WeakPolarHBondContact CB-O 3Å; I1073-I1081 HydrophobicContact CB-CG2 3.9Å; I1073-I1081 HydrophobicContact CD1-CG2 3.84Å; I1073-I1081 HydrophobicContact CG1-CG2 4.13Å; I1073-I1081 PolarHBondContact N-O 3.02Å; I1073-I1081 PolarHBondContact O-N 3.26Å; I1081-I1091 HydrophobicContact CD1-CG2 4.02Å; I1081-I1091 HydrophobicContact CG1-CG2 4.38Å; I1081-I1091 HydrophobicContact CG2-CD1 4.33Å; I1081-I1091 HydrophobicContact CG2-CG2 4.29Å; I1081-Y1094 HydrophobicContact CB-CD2 4.13Å; I1081-Y1094 HydrophobicContact CB-CE2 4.49Å; I1081-Y1094 HydrophobicContact CD1-CD2 4.47Å; I1081-Y1094 HydrophobicContact CG2-CD2 3.44Å; I1081-Y1094 VanDerWaalsContact CG2-CD2 3.44Å; I1081-Y1094 HydrophobicContact CG2-CE2 3.94Å; I1081-Y1094 HydrophobicContact CG2-CG 3.88Å
1082	F	92.7	Very high	89.5	Confident	100 Å²	100	49.8 Å²	49.8	44%	0.439	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	162	174.6	73.3	-86.3	0	0	0	112.1	R1070 L1071 C1072 E1084	R1070-F1082 HydrophobicContact CG-CD2 4.41Å; R1070-F1082 VanDerWaalsContact CZ-CD2 3.49Å; L1071-F1082 CarbonylContact O-C 3.59Å; L1071-F1082 VanDerWaalsContact O-CA 3.27Å; L1071-F1082 WeakPolarHBondContact O-CA 3.18Å; C1072-F1082 HydrophobicContact CB-CB 3.56Å; F1082-E1084 HydrophobicContact CD2-CG 4.01Å; F1082-E1084 HydrophobicContact CE2-CG 4.21Å
1083	A	92.1	Very high	89.3	Confident	16 Å²	16	50.1 Å²	50.1	13%	0.132	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	145.9	173.1	0	0	0	0	0	109.6	R1070 L1071 A1089 C1090 I1091	R1070-A1083 CarbonylContact C-O 3.59Å; R1070-A1083 WeakPolarHBondContact CA-O 3.29Å; L1071-A1083 PolarHBondContact N-O 3.06Å; L1071-A1083 PolarHBondContact O-N 3.28Å; A1083-A1089 HydrophobicContact CB-CB 4.4Å; A1083-C1090 WeakPolarHBondContact CB-O 3.28Å; A1083-I1091 HydrophobicContact CB-CG1 3.8Å
1084	E	92.3	Very high	89.2	Confident	85 Å²	85	51.7 Å²	51.7	40%	0.397	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	151.4	-175.6	-70.8	174	164.2	0	0	111	Y1068 T1069 R1070 F1082	Y1068-E1084 HydrophobicContact CE2-CB 4.27Å; Y1068-E1084 PolarHBondContact OH-OE1 3.18Å; Y1068-E1084 PolarHBondContact OH-OE2 3.16Å; T1069-E1084 WeakPolarHBondContact O-CA 3.27Å; R1070-E1084 HydrophobicContact CB-CG 3.85Å; R1070-E1084 WeakPolarHBondContact CD-OE1 3.47Å; R1070-E1084 HydrophobicContact CG-CG 3.77Å; R1070-E1084 IonicContact CZ-OE1 2.87Å; R1070-E1084 IonicContact NE-OE1 3.04Å; R1070-E1084 IonicContact NH1-OE1 2.73Å; R1070-E1084 PolarHBondContact NH1-OE1 2.83Å; F1082-E1084 HydrophobicContact CD2-CG 4.01Å; F1082-E1084 HydrophobicContact CE2-CG 4.21Å
1085	G	89.1	Confident	89	Confident	18 Å²	18	52.2 Å²	52.2	19%	0.186	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.8	-179.5	178.8	0	0	0	0	0	113.5	Y1068 T1069 G1088	Y1068-G1085 WeakPolarHBondContact CA-O 3.29Å; T1069-G1085 PolarHBondContact N-O 2.78Å; T1069-G1085 PolarHBondContact O-N 3.49Å; G1085-G1088 CarbonylContact C-O 3.56Å; G1085-G1088 WeakPolarHBondContact CA-O 3.29Å
1086	Y	89	Confident	89	Confident	150 Å²	150	49.2 Å²	49.2	59%	0.588	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	130.5	174.2	-70.1	-93	0	0	0	108.6	P1065 V1067 Y1068 G1088	P1065-Y1086 CarbonylContact O-C 3.24Å; P1065-Y1086 WeakPolarHBondContact O-CB 3.28Å; V1067-Y1086 CarbonylContact O-C 3.58Å; V1067-Y1086 WeakPolarHBondContact O-CA 3.5Å; Y1068-Y1086 HydrophobicContact CD2-CD2 4.38Å; Y1068-Y1086 HydrophobicContact CD2-CE1 4.18Å; Y1068-Y1086 AromaticContact CD2-CE2 3.95Å; Y1068-Y1086 HydrophobicContact CD2-CE2 3.95Å; Y1068-Y1086 AromaticContact CD2-CZ 3.84Å; Y1068-Y1086 HydrophobicContact CG-CE1 4.45Å; Y1086-G1088 PolarHBondContact O-N 3.42Å; Y1086-G1088 VanDerWaalsContact O-N 3.08Å
1087	G	86	Confident	89.1	Confident	8 Å²	8	53.3 Å²	53.3	8%	0.082	26%	0.263	C	S	.	.	S	Bend	trans	73.6	-6.9	-178.4	0	0	0	0	0	115	R1061 L1062 P1065 V1067	R1061-G1087 WeakPolarHBondContact CA-O 3.39Å; L1062-G1087 PolarHBondContact N-O 3.5Å; P1065-G1087 WeakPolarHBondContact O-CA 3.41Å; P1065-G1087 PolarHBondContact O-N 2.89Å; V1067-G1087 PolarHBondContact O-N 3.07Å
1088	G	89.2	Confident	89.1	Confident	13 Å²	13	48.9 Å²	48.9	13%	0.134	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171	166.5	-178.6	0	0	0	0	0	112.2	L1060 G1085 Y1086	L1060-G1088 CarbonylContact O-C 3.55Å; L1060-G1088 WeakPolarHBondContact O-CA 2.99Å; G1085-G1088 CarbonylContact C-O 3.56Å; G1085-G1088 WeakPolarHBondContact CA-O 3.29Å; Y1086-G1088 PolarHBondContact O-N 3.42Å; Y1086-G1088 VanDerWaalsContact O-N 3.08Å
1089	A	92.2	Very high	88.2	Confident	5 Å²	5	44.8 Å²	44.8	4%	0.041	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	147.6	178.4	0	0	0	0	0	109.8	L1060 T1069 L1071 A1083	L1060-A1089 PolarHBondContact N-O 3.36Å; L1060-A1089 PolarHBondContact O-N 2.83Å; T1069-A1089 HydrophobicContact CG2-CB 4.24Å; L1071-A1089 HydrophobicContact CB-CB 3.77Å; A1083-A1089 HydrophobicContact CB-CB 4.4Å
1090	C	92.1	Very high	86.4	Confident	20 Å²	20	47.2 Å²	47.2	14%	0.135	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	125.7	-177.3	-159.9	0	0	0	0	113.6	I908 I1058 A1083	I908-C1090 HydrophobicContact CD1-CB 3.92Å; I908-C1090 WeakPolarHBondContact CD1-SG 3.3Å; I1058-C1090 CarbonylContact O-C 3.58Å; I1058-C1090 VanDerWaalsContact O-CA 3.3Å; I1058-C1090 WeakPolarHBondContact O-CA 3.26Å; I1058-C1090 PolarHBondContact O-SG 3.38Å; A1083-C1090 WeakPolarHBondContact CB-O 3.28Å
1091	I	93.4	Very high	84.3	Confident	4 Å²	4	51 Å²	51	2%	0.021	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	102.9	166.4	-62.1	171.5	0	0	0	106.8	T1057 I1058 L1071 I1073 I1081 A1083 A1093	T1057-I1091 CarbonylContact C-O 3.57Å; T1057-I1091 WeakPolarHBondContact CA-O 3.38Å; I1058-I1091 HydrophobicContact CB-CB 4.41Å; I1058-I1091 PolarHBondContact N-O 3.35Å; I1058-I1091 PolarHBondContact O-N 2.93Å; L1071-I1091 HydrophobicContact CD2-CD1 4.18Å; L1071-I1091 HydrophobicContact CD2-CG1 4.18Å; L1071-I1091 HydrophobicContact CG-CD1 4.02Å; L1071-I1091 HydrophobicContact CG-CG1 4.44Å; I1073-I1091 HydrophobicContact CD1-CD1 4.07Å; I1073-I1091 HydrophobicContact CD1-CG2 4.48Å; I1073-I1091 HydrophobicContact CG1-CD1 3.9Å; I1081-I1091 HydrophobicContact CD1-CG2 4.02Å; I1081-I1091 HydrophobicContact CG1-CG2 4.38Å; I1081-I1091 HydrophobicContact CG2-CD1 4.33Å; I1081-I1091 HydrophobicContact CG2-CG2 4.29Å; A1083-I1091 HydrophobicContact CB-CG1 3.8Å; I1091-A1093 PolarHBondContact O-N 2.97Å
1092	Y	90.5	Very high	81.8	Confident	75 Å²	75	54.7 Å²	54.7	29%	0.294	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	-42.7	-175.2	-69	-78.3	0	0	0	113.4	I908 L949 I951 L982 I984 T1057	I908-Y1092 HydrophobicContact CD1-CD1 4.2Å; I908-Y1092 HydrophobicContact CD1-CE1 3.59Å; L949-Y1092 HydrophobicContact CD2-CD1 4.15Å; L949-Y1092 HydrophobicContact CD2-CD2 4.34Å; L949-Y1092 HydrophobicContact CD2-CE1 4.48Å; L949-Y1092 HydrophobicContact CD2-CG 4.08Å; I951-Y1092 HydrophobicContact CD1-CG 4.41Å; L982-Y1092 WeakPolarHBondContact CD2-O 3.43Å; I984-Y1092 HydrophobicContact CD1-CD1 3.76Å; I984-Y1092 HydrophobicContact CD1-CE1 3.86Å; T1057-Y1092 VanDerWaalsContact CB-O 3.31Å; T1057-Y1092 WeakPolarHBondContact CB-O 3.48Å; T1057-Y1092 VanDerWaalsContact CG2-O 3.26Å; T1057-Y1092 WeakPolarHBondContact CG2-O 3.26Å; T1057-Y1092 PolarHBondContact OG1-O 3.44Å
1093	A	90.5	Very high	78.8	Confident	7 Å²	7	57.8 Å²	57.8	6%	0.058	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	135.9	-178.1	0	0	0	0	0	110.4	I951 L982 L1055 I1056 I1091	I951-A1093 HydrophobicContact CD1-CB 4Å; L982-A1093 HydrophobicContact CD1-CB 4.42Å; L1055-A1093 HydrophobicContact CD1-CB 4.12Å; I1056-A1093 CarbonylContact O-C 3.53Å; I1056-A1093 VanDerWaalsContact O-CA 3.31Å; I1056-A1093 WeakPolarHBondContact O-CA 3.33Å; I1091-A1093 PolarHBondContact O-N 2.97Å
1094	Y	89.9	Confident	75.8	Confident	33 Å²	33	65.3 Å²	65.3	13%	0.129	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	145.1	163.8	-176.5	-100	0	0	0	108.7	L1055 I1056 I1073 M1080 I1081 I1096 Y1225	L1055-Y1094 CarbonylContact C-O 3.23Å; L1055-Y1094 WeakPolarHBondContact CA-O 3.42Å; I1056-Y1094 VanDerWaalsContact CG1-O 3.25Å; I1056-Y1094 WeakPolarHBondContact CG1-O 3.32Å; I1056-Y1094 PolarHBondContact N-O 2.91Å; I1056-Y1094 PolarHBondContact O-N 3.47Å; I1073-Y1094 HydrophobicContact CD1-CD1 3.7Å; I1073-Y1094 HydrophobicContact CD1-CE1 4.44Å; I1073-Y1094 HydrophobicContact CD1-CG 3.87Å; I1073-Y1094 HydrophobicContact CG2-CD1 4.45Å; I1073-Y1094 HydrophobicContact CG2-CE1 4.16Å; M1080-Y1094 HydrophobicContact CB-CE2 4.11Å; M1080-Y1094 WeakPolarHBondContact CE-OH 3.48Å; I1081-Y1094 HydrophobicContact CB-CD2 4.13Å; I1081-Y1094 HydrophobicContact CB-CE2 4.49Å; I1081-Y1094 HydrophobicContact CD1-CD2 4.47Å; I1081-Y1094 HydrophobicContact CG2-CD2 3.44Å; I1081-Y1094 VanDerWaalsContact CG2-CD2 3.44Å; I1081-Y1094 HydrophobicContact CG2-CE2 3.94Å; I1081-Y1094 HydrophobicContact CG2-CG 3.88Å; Y1094-I1096 HydrophobicContact CD1-CG1 3.72Å; Y1094-I1096 HydrophobicContact CE1-CG1 3.84Å; Y1094-Y1225 HydrophobicContact CE1-CE1 4.32Å
1095	I	87.5	Confident	72.8	Confident	41 Å²	41	69.6 Å²	69.6	21%	0.21	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	118.5	176	-61	174.5	0	0	0	108.2	C915 L1055 L1097	C915-I1095 HydrophobicContact CB-CD1 4.47Å; L1055-I1095 HydrophobicContact CD1-CG1 3.78Å; I1095-L1097 HydrophobicContact CG2-CD2 4.45Å
1096	I	87.9	Confident	69.9	Low	1 Å²	1	78.3 Å²	78.3	1%	0.005	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	122.9	169.6	-63.7	-175	0	0	0	107.7	I1048 A1050 D1053 S1054 I1056 Y1094 Y1225	I1048-I1096 HydrophobicContact CB-CD1 4.1Å; I1048-I1096 HydrophobicContact CD1-CD1 3.34Å; I1048-I1096 HydrophobicContact CG1-CD1 4.31Å; I1048-I1096 HydrophobicContact CG2-CD1 3.65Å; I1048-I1096 HydrophobicContact CG2-CG2 4.33Å; A1050-I1096 HydrophobicContact CB-CB 4.37Å; A1050-I1096 HydrophobicContact CB-CG2 3.57Å; D1053-I1096 CarbonylContact C-O 3.58Å; D1053-I1096 WeakPolarHBondContact CA-O 3.03Å; S1054-I1096 PolarHBondContact N-O 3.43Å; S1054-I1096 PolarHBondContact O-N 3.26Å; I1056-I1096 HydrophobicContact CD1-CD1 3.46Å; I1056-I1096 VanDerWaalsContact CD1-CD1 3.46Å; I1056-I1096 HydrophobicContact CD1-CG1 3.95Å; I1056-I1096 HydrophobicContact CG1-CD1 4.15Å; I1056-I1096 HydrophobicContact CG1-CG1 4.17Å; Y1094-I1096 HydrophobicContact CD1-CG1 3.72Å; Y1094-I1096 HydrophobicContact CE1-CG1 3.84Å; I1096-Y1225 HydrophobicContact CG2-CD2 3.59Å; I1096-Y1225 HydrophobicContact CG2-CE2 3.8Å; I1096-Y1225 HydrophobicContact CG2-CG 4.19Å
1097	L	83.9	Confident	67	Low	89 Å²	89	82.8 Å²	82.8	47%	0.466	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-72.8	150.5	176	-58.2	177	0	0	0	110.5	D1053 I1095	D1053-L1097 WeakPolarHBondContact OD1-CA 2.97Å; I1095-L1097 HydrophobicContact CG2-CD2 4.45Å
1098	A	80.7	Confident	64.4	Low	27 Å²	27	91.4 Å²	91.4	22%	0.223	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-62.8	138.4	174.7	0	0	0	0	0	111.5	A1050 D1053 T1100	A1050-A1098 WeakPolarHBondContact O-CA 3.49Å; D1053-A1098 PolarHBondContact OD1-N 3.3Å; A1098-T1100 PolarHBondContact O-N 3.47Å
1099	D	67	Low	61.5	Low	52 Å²	52	96.3 Å²	96.3	28%	0.278	47%	0.467	S	S	.	.			trans	-66	97.8	171	-77.9	-24.9	0	0	0	108.7	I1049 A1050 I1101	I1049-D1099 WeakPolarHBondContact CG2-OD2 3.15Å; A1050-D1099 PolarHBondContact O-N 3.23Å; D1099-I1101 VanDerWaalsContact C-N 3.27Å; D1099-I1101 PolarHBondContact O-N 2.98Å
1100	T	49.2	Very low	58.4	Low	125 Å²	125	102.1 Å²	102.1	77%	0.767	50%	0.504	S	S	*	.			trans	-71.7	83.8	174.4	44.7	0	0	0	0	109.9	A1098 I1102	A1098-T1100 PolarHBondContact O-N 3.47Å; T1100-I1102 VanDerWaalsContact C-N 3.32Å; T1100-I1102 PolarHBondContact O-N 3.42Å
1101	I	44.8	Very low	55.4	Low	150 Å²	150	108.3 Å²	108.3	77%	0.769	54%	0.536	S	S	*	.			trans	-61.8	95	171.1	-57.3	174.5	0	0	0	108.2	D1099 E1103	D1099-I1101 VanDerWaalsContact C-N 3.27Å; D1099-I1101 PolarHBondContact O-N 2.98Å; I1101-E1103 PolarHBondContact O-N 3.48Å
1102	I	38.1	Very low	52.5	Low	130 Å²	130	114 Å²	114	67%	0.667	58%	0.575	S	S	*	*			trans	-69.4	110.2	165.3	-56.1	179.6	0	0	0	106.2	T1100 E1104	T1100-I1102 VanDerWaalsContact C-N 3.32Å; T1100-I1102 PolarHBondContact O-N 3.42Å; I1102-E1104 HydrophobicContact CG2-CG 3.65Å; I1102-E1104 PolarHBondContact O-N 3.44Å
1103	E	28.6	Very low	49.6	Very low	164 Å²	164	114 Å²	114	77%	0.766	60%	0.599	S	S	*	*			trans	-69	83.6	166.6	-74.9	-157	133.1	0	0	109.4	I1101 K1105	I1101-E1103 PolarHBondContact O-N 3.48Å; E1103-K1105 PolarHBondContact O-N 3.28Å
1104	E	30.5	Very low	46.8	Very low	174 Å²	174	125.1 Å²	125.1	81%	0.813	64%	0.639	S	S	*	*			trans	-73.4	62.8	165.9	-71	-144.8	124.3	0	0	111.3	I1102	I1102-E1104 HydrophobicContact CG2-CG 3.65Å; I1102-E1104 PolarHBondContact O-N 3.44Å
1105	K	29.7	Very low	43.8	Very low	176 Å²	176	130.6 Å²	130.6	77%	0.765	67%	0.67	S	S	*	*			trans	-110.8	107.5	158.4	-85.5	177.3	176.8	165.4	0	108.7	E1103	E1103-K1105 PolarHBondContact O-N 3.28Å
1106	K	27.9	Very low	41	Very low	201 Å²	201	135.2 Å²	135.2	87%	0.874	69%	0.694	S	S	*	*			trans	81.1	86.1	179.1	-49	170.5	-178.3	176.2	0	115.6
1107	R	27.3	Very low	38	Very low	243 Å²	243	143.2 Å²	143.2	92%	0.917	73%	0.732	S	S	*	*				-129.4	96.6	129.3	-71.5	-162.2	175.5	-152.4	-2.2	110.6
1108	Q	31.4	Very low	35.3	Very low	190 Å²	190	144.3 Å²	144.3	89%	0.888	74%	0.742	S	S	*	*			trans	-69.5	153	155.2	-74.6	175.3	-39.9	0	0	108.9
1109	T	28.3	Very low	32.7	Very low	116 Å²	116	149.3 Å²	149.3	71%	0.712	77%	0.765	S	S	*	*			trans	-68.8	137.3	-175.5	45.3	0	0	0	0	113
1110	P	27.9	Very low	30.8	Very low	127 Å²	127	155.4 Å²	155.4	83%	0.825	79%	0.789	S	S	*	*			trans	-87.5	98.8	155.1	32.4	-27.2	0	0	0	109	S1112	P1110-S1112 PolarHBondContact O-N 3.42Å
1111	N	29.2	Very low	29.6	Very low	150 Å²	150	155.2 Å²	155.2	80%	0.802	79%	0.788	S	S	*	*			trans	-67.9	111.2	173.5	-85.2	-6.3	0	0	0	111.1
1112	S	32.6	Very low	28.8	Very low	122 Å²	122	155.3 Å²	155.3	85%	0.853	79%	0.79	S	S	*	*			trans	-161.5	107.5	156.3	179.2	0	0	0	0	110.7	P1110	P1110-S1112 PolarHBondContact O-N 3.42Å
1113	G	28	Very low	28.2	Very low	77 Å²	77	152.4 Å²	152.4	79%	0.794	79%	0.792	S	S	*	*			trans	-106.8	127.2	-178.6	0	0	0	0	0	114.1
1114	R	31.5	Very low	28.1	Very low	239 Å²	239	152.5 Å²	152.5	90%	0.902	80%	0.796	S	S	*	*			trans	-165.4	107.7	153.6	-134.5	167	178.8	163.2	-0.1	107.3
1115	L	28.3	Very low	27.7	Very low	149 Å²	149	151.4 Å²	151.4	78%	0.78	79%	0.788	S	S	*	*				91.5	118	52.2	-170.9	132.8	0	0	0	112.4
1116	L	28.7	Very low	27.6	Very low	137 Å²	137	151.8 Å²	151.8	72%	0.717	80%	0.798	S	S	*	*			trans	78.2	96.2	174	-61.4	175.7	0	0	0	121.1
1117	E	24.8	Very low	27.4	Very low	170 Å²	170	147 Å²	147	79%	0.794	79%	0.79	S	S	*	*				67.5	150	101.9	-141.2	179	-151.3	0	0	123.2
1118	V	26.9	Very low	27.3	Very low	112 Å²	112	143.1 Å²	143.1	68%	0.679	79%	0.786	S	S	*	*			trans	89.1	123.5	160.3	-174.2	0	0	0	0	120
1119	N	26	Very low	26.9	Very low	131 Å²	131	142.6 Å²	142.6	70%	0.701	78%	0.781	S	S	*	*			trans	75	99.7	158.6	-76.3	-28.1	0	0	0	122.8
1120	K	26	Very low	26.8	Very low	181 Å²	181	144.2 Å²	144.2	79%	0.787	79%	0.785	S	S	*	*				62.1	142.7	115.9	-72.4	179.9	175.3	176.1	0	122.9
1121	T	24.2	Very low	26.8	Very low	121 Å²	121	144 Å²	144	74%	0.742	78%	0.781	S	S	*	*			trans	77.9	137.3	151.7	32.5	0	0	0	0	120.3
1122	D	28.5	Very low	26.6	Very low	152 Å²	152	143.9 Å²	143.9	81%	0.813	79%	0.786	S	S	*	*			trans	66.8	88.1	152.9	-52.8	-10.7	0	0	0	121
1123	G	25	Very low	26.2	Very low	68 Å²	68	142.9 Å²	142.9	70%	0.701	78%	0.779	S	S	*	*				83.7	120.3	90.5	0	0	0	0	0	120.7
1124	I	26.3	Very low	26.2	Very low	166 Å²	166	144.7 Å²	144.7	85%	0.851	78%	0.779	S	S	*	*			trans	67.9	109.5	142.4	-50	164.8	0	0	0	117.6
1125	K	23.7	Very low	25.8	Very low	151 Å²	151	143 Å²	143	66%	0.657	78%	0.778	S	S	*	*				172.3	112.9	93	-149	168.7	-177.5	-175.6	0	110.6	E925	E925-K1125 IonicContact OE1-NZ 3.38Å; E925-K1125 PolarHBondContact OE1-NZ 3.27Å
1126	L	26.3	Very low	25.9	Very low	185 Å²	185	142.5 Å²	142.5	97%	0.969	78%	0.781	S	S	*	*			trans	-99.7	119.4	162.1	-82.3	173.9	0	0	0	108.6
1127	S	24.9	Very low	25.7	Very low	100 Å²	100	141.3 Å²	141.3	70%	0.699	78%	0.78	S	S	*	*			trans	-98.6	118.2	-177.1	54.9	0	0	0	0	111.4	K1129	S1127-K1129 PolarHBondContact O-N 3.08Å
1128	L	25.6	Very low	25.8	Very low	161 Å²	161	140.2 Å²	140.2	84%	0.843	78%	0.779	S	S	*	*			trans	-83.8	101.2	167.8	-135.8	78.6	0	0	0	110.1
1129	K	22	Very low	25.9	Very low	179 Å²	179	140.5 Å²	140.5	78%	0.778	78%	0.777	S	S	*	*			trans	-134.4	157.7	160.5	-82.7	-178.2	178.4	166.8	0	107.6	S1127	S1127-K1129 PolarHBondContact O-N 3.08Å
1130	D	26.1	Very low	25.9	Very low	151 Å²	151	143 Å²	143	81%	0.807	78%	0.781	S	S	*	*			trans	67.4	131.5	-156.2	-49.2	-29	0	0	0	111.2
1131	V	29.2	Very low	26.1	Very low	122 Å²	122	142.2 Å²	142.2	74%	0.739	79%	0.785	S	S	*	*			cis	-129.2	126.9	16.4	174.7	0	0	0	0	111.8
1132	V	23.3	Very low	26.2	Very low	147 Å²	147	143 Å²	143	89%	0.891	78%	0.784	S	S	*	*			trans	-136.1	77.8	157.5	-174.6	0	0	0	0	110.3
1133	S	24.4	Very low	26.1	Very low	101 Å²	101	142.1 Å²	142.1	71%	0.706	78%	0.784	S	S	*	*			trans	-166.9	137.7	161.7	-80	0	0	0	0	106.5
1134	S	29.5	Very low	26.4	Very low	115 Å²	115	144.1 Å²	144.1	80%	0.804	79%	0.788	S	S	*	*			cis	-144.3	164.6	30.4	-58	0	0	0	0	112.7
1135	K	22.1	Very low	26.3	Very low	203 Å²	203	144.4 Å²	144.4	88%	0.883	78%	0.783	S	S	*	*			trans	-129.3	105.1	174.2	-174.4	179.6	-175.8	177.9	0	109.9
1136	V	30.6	Very low	26.7	Very low	139 Å²	139	144.8 Å²	144.8	84%	0.842	79%	0.791	S	S	*	*			trans	-128.4	130	177.6	180	0	0	0	0	110
1137	T	23.5	Very low	26.6	Very low	112 Å²	112	141.2 Å²	141.2	69%	0.687	78%	0.781	S	S	*	*			trans	-102.8	137.1	174.7	47.8	0	0	0	0	110.5
1138	L	28.8	Very low	27.5	Very low	147 Å²	147	141.8 Å²	141.8	77%	0.77	78%	0.782	S	S	*	*				-174.8	136.6	126.6	-121.5	70.2	0	0	0	115.4
1139	N	27.3	Very low	27.6	Very low	119 Å²	119	144 Å²	144	64%	0.636	78%	0.779	S	S	*	*			trans	48.5	124.8	136.3	-71.5	-15.2	0	0	0	124.4
1140	K	26.6	Very low	27.8	Very low	184 Å²	184	145 Å²	145	80%	0.8	78%	0.778	S	S	*	*				52	125.7	125.1	-61.8	179	175.6	177.8	0	118.4
1141	L	29.7	Very low	28.2	Very low	164 Å²	164	143.3 Å²	143.3	86%	0.859	78%	0.778	S	S	*	*				-161.6	-174.7	66.3	-122.8	164	0	0	0	113
1142	N	26.5	Very low	28.3	Very low	136 Å²	136	142.1 Å²	142.1	73%	0.727	78%	0.781	S	S	*	*			trans	-105.8	165.5	-167.5	-86.3	-27.5	0	0	0	114.7
1143	T	26.8	Very low	28.7	Very low	134 Å²	134	140.2 Å²	140.2	82%	0.822	77%	0.774	S	S	*	*			trans	60.8	119.8	151.3	46.4	0	0	0	0	120.3
1144	S	30.5	Very low	29.1	Very low	110 Å²	110	141.2 Å²	141.2	77%	0.769	78%	0.776	S	S	*	*				-163	160.6	103.1	49.2	0	0	0	0	111.9
1145	K	25.1	Very low	29.2	Very low	172 Å²	172	144.2 Å²	144.2	75%	0.748	77%	0.774	S	S	*	*			trans	-110.7	134.4	173.7	-60.5	177.1	-178.2	178.8	0	108.7	T1293	K1145-T1293 PolarHBondContact NZ-OG1 3.35Å
1146	I	32.3	Very low	29.6	Very low	160 Å²	160	143.5 Å²	143.5	82%	0.821	77%	0.771	S	S	*	*			trans	-133.8	138.5	154.7	-78.6	97.2	0	0	0	110.4
1147	S	23.5	Very low	29.6	Very low	109 Å²	109	144.1 Å²	144.1	76%	0.762	77%	0.77	S	S	*	*			trans	-157.6	175.3	167.8	-134.6	0	0	0	0	107.6
1148	P	44.1	Very low	30.2	Very low	112 Å²	112	147.5 Å²	147.5	73%	0.727	78%	0.78	S	S	*	*				-122.1	179.5	-111.2	40.2	-26.1	0	0	0	114.1
1149	R	27.2	Very low	30.4	Very low	207 Å²	207	149.8 Å²	149.8	78%	0.781	78%	0.783	S	S	*	*			trans	-170.6	132.5	152.2	-113	172	-178.6	-163.1	2.2	118.9
1150	R	27.6	Very low	30.8	Very low	202 Å²	202	149.9 Å²	149.9	76%	0.762	79%	0.791	S	S	*	*			trans	43.2	122.3	133.2	-70.6	174.8	177.5	-172.9	-5.2	123.4
1151	S	34.1	Very low	31	Very low	115 Å²	115	144.5 Å²	144.5	80%	0.804	79%	0.788	S	S	*	*				176.9	138.4	110.6	39	0	0	0	0	108.4
1152	A	29.9	Very low	30.9	Very low	96 Å²	96	142.4 Å²	142.4	79%	0.793	79%	0.787	S	S	*	*				66.3	127.6	56	0	0	0	0	0	112.5
1153	S	33.5	Very low	31.2	Very low	107 Å²	107	141.6 Å²	141.6	75%	0.748	79%	0.791	S	S	*	*			cis	-167.6	168.8	13.9	64.9	0	0	0	0	115.7
1154	V	32.8	Very low	31.3	Very low	122 Å²	122	140.6 Å²	140.6	74%	0.739	79%	0.79	S	S	*	*			trans	81.5	119.2	148.5	168.9	0	0	0	0	123.5
1155	K	29.9	Very low	31.3	Very low	178 Å²	178	140.3 Å²	140.3	77%	0.774	79%	0.788	S	S	*	*			trans	43.5	116.4	143.2	-64.6	179.6	-177.9	178.9	0	121
1156	K	31.1	Very low	31.9	Very low	189 Å²	189	137.2 Å²	137.2	82%	0.822	79%	0.788	S	S	*	*				79.7	108.2	75.3	-81.6	-166.7	176.1	-171.6	0	115.8
1157	N	30.8	Very low	31.9	Very low	151 Å²	151	135 Å²	135	81%	0.807	79%	0.786	S	S	*	*				173.4	167.3	112.9	-94.4	-5.5	0	0	0	114.8
1158	M	36.2	Very low	32.3	Very low	184 Å²	184	136.7 Å²	136.7	91%	0.906	79%	0.793	S	S	*	*			trans	83.4	114.3	163.1	-50.9	-148	73.8	0	0	120.9
1159	K	32.2	Very low	31.7	Very low	194 Å²	194	135.1 Å²	135.1	84%	0.843	80%	0.796	S	S	*	*			trans	-82.1	176.6	147.3	-99.9	-177.6	177.7	-176.7	0	108.9
1160	P	36.8	Very low	32	Very low	122 Å²	122	129.1 Å²	129.1	79%	0.792	80%	0.8	S	S	*	*			cis	-132.1	-177.2	-21.6	38	-21.6	0	0	0	113
1161	G	29.4	Very low	32.2	Very low	71 Å²	71	124.5 Å²	124.5	73%	0.732	80%	0.798	S	S	*	*			trans	101.7	135.3	141.7	0	0	0	0	0	118.6
1162	S	29.2	Very low	32	Very low	120 Å²	120	124.8 Å²	124.8	84%	0.839	80%	0.795	S	S	*	*			trans	-36.6	154.1	159.1	52.1	0	0	0	0	115.4
1163	S	31.2	Very low	32.5	Very low	118 Å²	118	127.3 Å²	127.3	83%	0.825	80%	0.801	S	S	*	*			cis	-155	173.2	34.4	52	0	0	0	0	114.4
1164	S	29.7	Very low	32.5	Very low	114 Å²	114	125.4 Å²	125.4	80%	0.797	80%	0.798	S	S	*	*			trans	-98.8	142.7	179.2	48.5	0	0	0	0	113.7
1165	S	30.6	Very low	32.7	Very low	104 Å²	104	126.1 Å²	126.1	73%	0.727	81%	0.808	S	S	*	*			trans	-166.7	138.4	148	32.3	0	0	0	0	107.7
1166	S	38	Very low	32.9	Very low	107 Å²	107	120.8 Å²	120.8	75%	0.748	80%	0.804	S	S	*	*			cis	73	133.7	26.3	89.1	0	0	0	0	115.2
1167	S	33.1	Very low	33.1	Very low	112 Å²	112	124.4 Å²	124.4	78%	0.783	81%	0.813	S	S	*	*			trans	-158.5	114.3	169.6	-54.7	0	0	0	0	107.3
1168	T	30	Very low	33.2	Very low	146 Å²	146	120.4 Å²	120.4	90%	0.896	81%	0.807	S	S	*	*				81.2	130.8	74.4	-60.3	0	0	0	0	111.3
1169	G	32.5	Very low	33.1	Very low	78 Å²	78	117.5 Å²	117.5	80%	0.804	81%	0.805	S	S	*	*			cis	-156	-165.1	-2.8	0	0	0	0	0	108.4
1170	G	32.3	Very low	33.1	Very low	82 Å²	82	113.4 Å²	113.4	85%	0.845	80%	0.8	S	S	*	*			cis	176.4	-168.2	2.7	0	0	0	0	0	106.2
1171	S	32.3	Very low	32.9	Very low	104 Å²	104	112.6 Å²	112.6	73%	0.727	80%	0.798	S	S	*	*			cis	-167.2	155.1	-15.2	-165	0	0	0	0	109
1172	T	31	Very low	32.9	Very low	121 Å²	121	114.9 Å²	114.9	74%	0.742	80%	0.798	S	S	*	*			trans	63.9	153.9	159.2	47.5	0	0	0	0	122.6
1173	T	40.9	Very low	32.8	Very low	149 Å²	149	116 Å²	116	91%	0.914	79%	0.794	S	S	*	*			trans	77	138.3	177.6	75	0	0	0	0	116.6
1174	G	32.1	Very low	32.6	Very low	67 Å²	67	115.5 Å²	115.5	69%	0.691	79%	0.791	S	S	*	*			cis	176.4	144.4	-10.1	0	0	0	0	0	112.7
1175	S	37.3	Very low	32.7	Very low	137 Å²	137	114.2 Å²	114.2	96%	0.958	79%	0.787	S	S	*	*			trans	66.1	147.1	-176.2	-62	0	0	0	0	116.9
1176	G	33.7	Very low	32.5	Very low	67 Å²	67	116.2 Å²	116.2	69%	0.691	79%	0.789	S	S	*	*			cis	162.6	130.9	-13.5	0	0	0	0	0	115.2
1177	R	35.4	Very low	32	Very low	265 Å²	265	117.9 Å²	117.9	100%	1	79%	0.789	S	S	*	*			trans	68	130.7	170.9	-59	173.7	171.5	164	-3.9	116.6
1178	G	32.4	Very low	32.1	Very low	66 Å²	66	120.4 Å²	120.4	68%	0.68	79%	0.788	S	S	*	*			cis	174.2	163.8	-9.3	0	0	0	0	0	114.7
1179	S	34.7	Very low	32	Very low	124 Å²	124	123.9 Å²	123.9	87%	0.867	79%	0.785	S	S	*	*			trans	69.3	146.6	167.3	-53.7	0	0	0	0	117.6
1180	S	33.2	Very low	31.8	Very low	107 Å²	107	125.4 Å²	125.4	75%	0.748	78%	0.779	S	S	*	*			cis	-177	152.5	-11.7	44.3	0	0	0	0	109.5
1181	S	31.1	Very low	31.7	Very low	105 Å²	105	129.2 Å²	129.2	73%	0.734	77%	0.774	S	S	*	*			cis	-168.6	120.3	-15.9	47.6	0	0	0	0	111.9
1182	T	29.9	Very low	31.5	Very low	119 Å²	119	130.6 Å²	130.6	73%	0.73	77%	0.769	S	S	*	*			trans	15	134.4	145.3	54.5	0	0	0	0	123.2
1183	N	27.7	Very low	31.4	Very low	144 Å²	144	133.4 Å²	133.4	77%	0.77	77%	0.767	S	S	*	*			trans	66.5	140.2	131.9	-62.4	-0.3	0	0	0	124
1184	S	27.1	Very low	30.8	Very low	107 Å²	107	133.7 Å²	133.7	75%	0.748	76%	0.758	S	S	*	*			trans	55.3	110.9	140.2	62.2	0	0	0	0	122
1185	A	30.9	Very low	30.7	Very low	87 Å²	87	137.2 Å²	137.2	72%	0.719	76%	0.756	S	S	*	*			trans	28.1	117.3	134.3	0	0	0	0	0	120.6
1186	N	26.7	Very low	30.3	Very low	146 Å²	146	136 Å²	136	78%	0.781	75%	0.748	S	S	*	*				-170.7	146.4	110.6	-101.3	-30	0	0	0	113.8
1187	I	27.5	Very low	30	Very low	143 Å²	143	139.3 Å²	139.3	73%	0.733	75%	0.75	S	S	*	*			trans	48.8	131	141.5	-57.2	169.5	0	0	0	120
1188	E	34.8	Very low	29.8	Very low	164 Å²	164	132.7 Å²	132.7	77%	0.766	74%	0.739	S	S	*	*			trans	-39.3	144.3	170.5	-47.6	167.1	140.5	0	0	116.5
1189	R	29.1	Very low	29.8	Very low	220 Å²	220	134.8 Å²	134.8	83%	0.83	74%	0.743	S	S	*	*				177.4	143.3	105.6	-97.1	-179.7	-172.8	-179.3	3.3	115.5
1190	T	28.1	Very low	29.6	Very low	110 Å²	110	134.2 Å²	134.2	68%	0.675	74%	0.739	S	S	*	*			trans	42.8	116.1	144.4	63.1	0	0	0	0	122.3
1191	H	30.6	Very low	29.8	Very low	162 Å²	162	133.9 Å²	133.9	75%	0.75	74%	0.735	S	S	*	*				71.2	140.4	126	-82.6	-97	0	0	0	123.9
1192	H	26.5	Very low	29.6	Very low	132 Å²	132	136.9 Å²	136.9	61%	0.611	74%	0.737	S	S	*	*			trans	100.7	128.7	133.4	-95.5	-62	0	0	0	122.1
1193	Y	30.5	Very low	29.5	Very low	181 Å²	181	135.3 Å²	135.3	71%	0.71	73%	0.731	S	S	*	*			trans	69.6	138.3	155.6	-70.4	-61.7	0	0	0	119
1194	E	28.1	Very low	29.7	Very low	154 Å²	154	137.1 Å²	137.1	72%	0.72	73%	0.734	S	S	*	*			cis	-147.9	175.2	-3.7	-163	146.6	-128	0	0	112.3
1195	Q	28.5	Very low	29.9	Very low	141 Å²	141	138.3 Å²	138.3	66%	0.659	73%	0.73	S	S	*	*			trans	-87.3	150.5	-170.3	-49.7	110.7	-38.3	0	0	115.3
1196	S	30.1	Very low	30	Very low	113 Å²	113	141.4 Å²	141.4	79%	0.79	73%	0.733	S	S	*	*				-158.8	114.1	117.6	-5.5	0	0	0	0	108.6
1197	N	27.7	Very low	30.5	Very low	136 Å²	136	139.8 Å²	139.8	73%	0.727	72%	0.724	S	S	*	*				66.2	114.5	75.1	-64.7	-11.1	0	0	0	111.9
1198	T	30.3	Very low	31	Very low	126 Å²	126	134.8 Å²	134.8	77%	0.773	70%	0.702	S	S	*	*			cis	-142.9	177.2	-3.4	63	0	0	0	0	108.6
1199	S	32.3	Very low	31.4	Very low	110 Å²	110	133.1 Å²	133.1	77%	0.769	69%	0.694	S	S	*	*			cis	-150	169.1	13.7	-38.6	0	0	0	0	112.3
1200	S	30.2	Very low	31.9	Very low	112 Å²	112	128.7 Å²	128.7	78%	0.783	68%	0.678	S	S	*	*			trans	-118.3	-174.9	154.3	-140.3	0	0	0	0	107
1201	P	37.4	Very low	32.5	Very low	100 Å²	100	127.5 Å²	127.5	65%	0.649	67%	0.667	S	S	*	*			cis	-129.8	162.6	1.5	32.1	-9.1	0	0	0	114.4
1202	H	28	Very low	33.1	Very low	167 Å²	167	124.4 Å²	124.4	77%	0.773	65%	0.652	S	S	*	*				-163.8	158.6	67.2	-114.6	-75.1	0	0	0	115.9	H1204	H1202-H1204 PolarHBondContact O-N 2.89Å
1203	S	27.6	Very low	34	Very low	87 Å²	87	124.2 Å²	124.2	61%	0.608	65%	0.652	S	S	*	*			trans	-44.9	117.8	163.8	49.8	0	0	0	0	115.6
1204	H	31.2	Very low	34.8	Very low	181 Å²	181	120.1 Å²	120.1	84%	0.838	64%	0.639	S	S	*	*			trans	178.5	86.2	145.4	-91	-63	0	0	0	109.7	H1202	H1202-H1204 PolarHBondContact O-N 2.89Å
1205	M	31.6	Very low	35.6	Very low	133 Å²	133	117.8 Å²	117.8	66%	0.655	63%	0.628	S	S	*	*			trans	-149.8	-18.5	171.6	-89.6	-142.7	75.6	0	0	117.1	N1207 S1208	M1205-N1207 VanDerWaalsContact C-N 3.28Å; M1205-N1207 PolarHBondContact O-N 3.48Å; M1205-S1208 WeakPolarHBondContact O-CB 3.19Å; M1205-S1208 PolarHBondContact O-N 3.22Å
1206	L	33.4	Very low	36.7	Very low	152 Å²	152	117.5 Å²	117.5	80%	0.796	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-18.9	177	-88.9	165.3	0	0	0	114
1207	N	36.7	Very low	37.5	Very low	111 Å²	111	118.9 Å²	118.9	59%	0.594	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-26.4	166.6	-93.3	20.3	0	0	0	112.6	M1205 R1210 L1211	M1205-N1207 VanDerWaalsContact C-N 3.28Å; M1205-N1207 PolarHBondContact O-N 3.48Å; N1207-R1210 PolarHBondContact O-N 3.18Å; N1207-L1211 HydrophobicContact CB-CD1 4.16Å; N1207-L1211 WeakPolarHBondContact O-CB 3.36Å; N1207-L1211 WeakPolarHBondContact O-CG 3.36Å; N1207-L1211 PolarHBondContact O-N 3.32Å
1208	S	38.3	Very low	38.7	Very low	38 Å²	38	119 Å²	119	27%	0.266	62%	0.617	S	S	.	*	H	α-helix	trans	-62.7	-52.5	-171.9	-57.5	0	0	0	0	111.7	M1205 R1210 L1211 E1212	M1205-S1208 WeakPolarHBondContact O-CB 3.19Å; M1205-S1208 PolarHBondContact O-N 3.22Å; S1208-R1210 PolarHBondContact O-N 2.98Å; S1208-L1211 PolarHBondContact O-N 3.28Å; S1208-E1212 VanDerWaalsContact O-CB 3.32Å; S1208-E1212 WeakPolarHBondContact O-CB 3.4Å; S1208-E1212 VanDerWaalsContact O-CD 3.29Å; S1208-E1212 WeakPolarHBondContact O-CG 3.5Å; S1208-E1212 PolarHBondContact O-N 3.49Å
1209	Q	42.9	Very low	39.8	Very low	129 Å²	129	118.3 Å²	118.3	60%	0.603	61%	0.605	S	S	*	*	H	α-helix	trans	-67.6	-19.8	-178.6	-67.5	-172.1	-41.1	0	0	114.3	E1212 Q1213	Q1209-E1212 WeakPolarHBondContact CA-OE2 3.47Å; Q1209-Q1213 WeakPolarHBondContact O-CG 3.49Å; Q1209-Q1213 PolarHBondContact O-N 3.44Å
1210	R	40.4	Very low	41	Very low	127 Å²	127	118.4 Å²	118.4	48%	0.479	59%	0.594	S	S	.	*	H	α-helix	trans	-86.1	-42.5	174.6	-173.6	170.6	179.7	173.9	-1.9	111.8	N1207 S1208 E1212 Q1213 E1214	N1207-R1210 PolarHBondContact O-N 3.18Å; S1208-R1210 PolarHBondContact O-N 2.98Å; R1210-E1212 VanDerWaalsContact C-N 3.29Å; R1210-Q1213 PolarHBondContact O-N 3.46Å; R1210-E1214 HydrophobicContact CG-CG 4.46Å; R1210-E1214 IonicContact CZ-OE1 2.68Å; R1210-E1214 IonicContact NE-OE1 2.7Å; R1210-E1214 PolarHBondContact NE-OE1 3.46Å; R1210-E1214 IonicContact NE-OE2 3.66Å; R1210-E1214 IonicContact NH2-OE1 2.82Å; R1210-E1214 PolarHBondContact NH2-OE1 2.99Å; R1210-E1214 WeakPolarHBondContact O-CB 3.4Å; R1210-E1214 WeakPolarHBondContact O-CG 3.48Å; R1210-E1214 PolarHBondContact O-N 2.95Å
1211	L	39.8	Very low	42.5	Very low	86 Å²	86	117.6 Å²	117.6	45%	0.45	58%	0.577	S	S	.	*	H	α-helix	trans	-60.8	-40.4	170	-75	167.5	0	0	0	110.7	N1207 S1208 Q1213 E1214 Q1215	N1207-L1211 HydrophobicContact CB-CD1 4.16Å; N1207-L1211 WeakPolarHBondContact O-CB 3.36Å; N1207-L1211 WeakPolarHBondContact O-CG 3.36Å; N1207-L1211 PolarHBondContact O-N 3.32Å; S1208-L1211 PolarHBondContact O-N 3.28Å; L1211-Q1213 PolarHBondContact O-N 2.87Å; L1211-E1214 PolarHBondContact O-N 2.84Å; L1211-Q1215 WeakPolarHBondContact O-CA 3.44Å; L1211-Q1215 WeakPolarHBondContact O-CB 3.23Å; L1211-Q1215 WeakPolarHBondContact O-CG 3.18Å; L1211-Q1215 PolarHBondContact O-N 2.9Å; L1211-Q1215 PolarHBondContact O-OE1 3.34Å
1212	E	43.5	Very low	43.9	Very low	96 Å²	96	117.7 Å²	117.7	45%	0.449	57%	0.569	S	S	.	*	H	α-helix	trans	-58.4	-45.2	174.7	-75.4	155.3	-161.4	0	0	111.5	S1208 Q1209 R1210 E1216	S1208-E1212 VanDerWaalsContact O-CB 3.32Å; S1208-E1212 WeakPolarHBondContact O-CB 3.4Å; S1208-E1212 VanDerWaalsContact O-CD 3.29Å; S1208-E1212 WeakPolarHBondContact O-CG 3.5Å; S1208-E1212 PolarHBondContact O-N 3.49Å; Q1209-E1212 WeakPolarHBondContact CA-OE2 3.47Å; R1210-E1212 VanDerWaalsContact C-N 3.29Å; E1212-E1216 WeakPolarHBondContact O-CB 3.37Å; E1212-E1216 VanDerWaalsContact O-CG 3.29Å; E1212-E1216 WeakPolarHBondContact O-CG 3.36Å; E1212-E1216 PolarHBondContact O-N 2.85Å
1213	Q	46.4	Very low	46	Very low	129 Å²	129	116.9 Å²	116.9	60%	0.603	56%	0.559	S	S	*	*	H	α-helix	trans	-75.3	-33.2	178.4	-72.4	-177.9	6.3	0	0	114.4	Q1209 R1210 L1211 Q1217	Q1209-Q1213 WeakPolarHBondContact O-CG 3.49Å; Q1209-Q1213 PolarHBondContact O-N 3.44Å; R1210-Q1213 PolarHBondContact O-N 3.46Å; L1211-Q1213 PolarHBondContact O-N 2.87Å; Q1213-Q1217 PolarHBondContact O-N 3.38Å
1214	E	46.7	Very low	48.6	Very low	94 Å²	94	115 Å²	115	44%	0.439	54%	0.539	S	S	.	.	H	α-helix	trans	-74.4	-35.1	175.4	-70.1	171.6	179.4	0	0	109.9	R1210 L1211 Q1217 E1218	R1210-E1214 HydrophobicContact CG-CG 4.46Å; R1210-E1214 IonicContact CZ-OE1 2.68Å; R1210-E1214 IonicContact NE-OE1 2.7Å; R1210-E1214 PolarHBondContact NE-OE1 3.46Å; R1210-E1214 IonicContact NE-OE2 3.66Å; R1210-E1214 IonicContact NH2-OE1 2.82Å; R1210-E1214 PolarHBondContact NH2-OE1 2.99Å; R1210-E1214 WeakPolarHBondContact O-CB 3.4Å; R1210-E1214 WeakPolarHBondContact O-CG 3.48Å; R1210-E1214 PolarHBondContact O-N 2.95Å; L1211-E1214 PolarHBondContact O-N 2.84Å; E1214-Q1217 PolarHBondContact O-N 2.94Å; E1214-E1218 PolarHBondContact O-N 2.85Å
1215	Q	45.6	Very low	51.4	Low	105 Å²	105	107.1 Å²	107.1	49%	0.491	50%	0.502	S	S	.	.	H	α-helix	trans	-71.1	-38.9	171.3	-72.6	175.9	-41.6	0	0	113.1	L1211 Q1217 E1218 E1219	L1211-Q1215 WeakPolarHBondContact O-CA 3.44Å; L1211-Q1215 WeakPolarHBondContact O-CB 3.23Å; L1211-Q1215 WeakPolarHBondContact O-CG 3.18Å; L1211-Q1215 PolarHBondContact O-N 2.9Å; L1211-Q1215 PolarHBondContact O-OE1 3.34Å; Q1215-Q1217 PolarHBondContact O-N 2.9Å; Q1215-E1218 PolarHBondContact O-N 3.22Å; Q1215-E1219 VanDerWaalsContact O-CB 3.29Å; Q1215-E1219 WeakPolarHBondContact O-CB 3.35Å; Q1215-E1219 WeakPolarHBondContact O-CG 3.48Å; Q1215-E1219 PolarHBondContact O-N 3.28Å
1216	E	51.1	Low	54.1	Low	135 Å²	135	101 Å²	101	63%	0.631	47%	0.472	S	S	*	.	H	α-helix	trans	-59.7	-35.2	173.1	-83.9	179.1	166.7	0	0	111.5	E1212 E1220	E1212-E1216 WeakPolarHBondContact O-CB 3.37Å; E1212-E1216 VanDerWaalsContact O-CG 3.29Å; E1212-E1216 WeakPolarHBondContact O-CG 3.36Å; E1212-E1216 PolarHBondContact O-N 2.85Å; E1216-E1220 PolarHBondContact O-N 2.9Å
1217	Q	47.6	Very low	57	Low	142 Å²	142	93.8 Å²	93.8	66%	0.664	43%	0.434	S	S	*	.	H	α-helix	trans	-76.8	-38.1	175.9	-71.4	-174.6	18	0	0	113.2	Q1213 E1214 Q1215 E1220 E1221	Q1213-Q1217 PolarHBondContact O-N 3.38Å; E1214-Q1217 PolarHBondContact O-N 2.94Å; Q1215-Q1217 PolarHBondContact O-N 2.9Å; Q1217-E1220 PolarHBondContact O-N 3.42Å; Q1217-E1221 PolarHBondContact O-N 3.41Å
1218	E	51.4	Low	59.6	Low	140 Å²	140	88.9 Å²	88.9	65%	0.654	41%	0.407	S	S	*	.	H	α-helix	trans	-65.2	-42.2	171.4	-71.5	-170.6	146.5	0	0	111.2	E1214 Q1215 E1220 E1221 E1222	E1214-E1218 PolarHBondContact O-N 2.85Å; Q1215-E1218 PolarHBondContact O-N 3.22Å; E1218-E1220 PolarHBondContact O-N 3.49Å; E1218-E1221 PolarHBondContact O-N 3.07Å; E1218-E1222 WeakPolarHBondContact O-CB 3.45Å; E1218-E1222 WeakPolarHBondContact O-CG 3.47Å; E1218-E1222 PolarHBondContact O-N 3.19Å
1219	E	54	Low	62.2	Low	110 Å²	110	87 Å²	87	51%	0.514	40%	0.395	S	S	.	.	H	α-helix	trans	-65.6	-30	174.6	-82	-158.3	-160.4	0	0	113.9	Q1215 R1223	Q1215-E1219 VanDerWaalsContact O-CB 3.29Å; Q1215-E1219 WeakPolarHBondContact O-CB 3.35Å; Q1215-E1219 WeakPolarHBondContact O-CG 3.48Å; Q1215-E1219 PolarHBondContact O-N 3.28Å; E1219-R1223 WeakPolarHBondContact O-CD 3.4Å; E1219-R1223 VanDerWaalsContact O-CG 3.29Å; E1219-R1223 WeakPolarHBondContact O-CG 3.39Å; E1219-R1223 PolarHBondContact O-NE 3.02Å; E1219-R1223 IonicContact OE2-NH2 3.21Å; E1219-R1223 PolarHBondContact OE2-NH2 2.93Å
1220	E	57	Low	64.6	Low	113 Å²	113	84.1 Å²	84.1	53%	0.528	38%	0.379	S	S	.	.	H	α-helix	trans	-69	-48.1	168.2	-90.1	-145.4	160.3	0	0	111.3	E1216 Q1217 E1218 E1222 R1223 Y1224	E1216-E1220 PolarHBondContact O-N 2.9Å; Q1217-E1220 PolarHBondContact O-N 3.42Å; E1218-E1220 PolarHBondContact O-N 3.49Å; E1220-E1222 VanDerWaalsContact C-N 3.25Å; E1220-E1222 PolarHBondContact O-N 3Å; E1220-R1223 PolarHBondContact O-N 3.45Å; E1220-Y1224 HydrophobicContact CB-CE2 4.46Å; E1220-Y1224 VanDerWaalsContact O-CD2 3.24Å; E1220-Y1224 WeakPolarHBondContact O-CD2 3.47Å; E1220-Y1224 WeakPolarHBondContact O-CE2 3.49Å; E1220-Y1224 PolarHBondContact OE2-OH 3.26Å
1221	E	61.7	Low	67	Low	95 Å²	95	78.3 Å²	78.3	44%	0.444	36%	0.357	S	S	.	.	H	α-helix	trans	-60.2	-35.7	178.1	-78.1	-111.1	142.4	0	0	111.8	G1076 Q1217 E1218 R1223 Y1224	G1076-E1221 WeakPolarHBondContact CA-O 3.43Å; Q1217-E1221 PolarHBondContact O-N 3.41Å; E1218-E1221 PolarHBondContact O-N 3.07Å; E1221-R1223 VanDerWaalsContact C-N 3.25Å; E1221-R1223 PolarHBondContact O-N 3.37Å; E1221-Y1224 PolarHBondContact O-N 3.03Å
1222	E	66.9	Low	69.1	Low	102 Å²	102	76.4 Å²	76.4	48%	0.477	35%	0.347	S	S	.	.	H	α-helix	trans	-64.9	-23.4	180	-71.9	-123.7	127.2	0	0	114.1	M1075 G1076 E1218 E1220	M1075-E1222 CarbonylContact C-O 3.58Å; G1076-E1222 WeakPolarHBondContact CA-O 3.29Å; G1076-E1222 PolarHBondContact N-O 3.37Å; E1218-E1222 WeakPolarHBondContact O-CB 3.45Å; E1218-E1222 WeakPolarHBondContact O-CG 3.47Å; E1218-E1222 PolarHBondContact O-N 3.19Å; E1220-E1222 VanDerWaalsContact C-N 3.25Å; E1220-E1222 PolarHBondContact O-N 3Å
1223	R	71.8	Confident	70.5	Confident	150 Å²	150	72.9 Å²	72.9	57%	0.566	34%	0.337	S	S	*	.	H	α-helix	trans	-83.1	-21.6	-177.4	-66.4	166.7	-153.1	-159.2	2.7	113.7	E1219 E1220 E1221	E1219-R1223 WeakPolarHBondContact O-CD 3.4Å; E1219-R1223 VanDerWaalsContact O-CG 3.29Å; E1219-R1223 WeakPolarHBondContact O-CG 3.39Å; E1219-R1223 PolarHBondContact O-NE 3.02Å; E1219-R1223 IonicContact OE2-NH2 3.21Å; E1219-R1223 PolarHBondContact OE2-NH2 2.93Å; E1220-R1223 PolarHBondContact O-N 3.45Å; E1221-R1223 VanDerWaalsContact C-N 3.25Å; E1221-R1223 PolarHBondContact O-N 3.37Å
1224	Y	82.1	Confident	72	Confident	48 Å²	48	75.1 Å²	75.1	19%	0.188	35%	0.345	C	S	.	.	S	Bend	trans	-81.7	140.8	-171.8	-61.6	-56.2	0	0	0	114	M1075 G1076 E1220 E1221 W1226	M1075-Y1224 WeakPolarHBondContact CA-O 3.49Å; G1076-Y1224 PolarHBondContact N-O 3.36Å; E1220-Y1224 HydrophobicContact CB-CE2 4.46Å; E1220-Y1224 VanDerWaalsContact O-CD2 3.24Å; E1220-Y1224 WeakPolarHBondContact O-CD2 3.47Å; E1220-Y1224 WeakPolarHBondContact O-CE2 3.49Å; E1220-Y1224 PolarHBondContact OE2-OH 3.26Å; E1221-Y1224 PolarHBondContact O-N 3.03Å; Y1224-W1226 VanDerWaalsContact O-CD1 3.22Å
1225	Y	89.7	Confident	73.4	Confident	15 Å²	15	74.6 Å²	74.6	6%	0.059	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	127.7	169.8	-71.2	-68.5	0	0	0	112.6	R1047 I1048 I1073 K1074 M1075 Y1094 I1096	R1047-Y1225 WeakPolarHBondContact CA-O 3.49Å; R1047-Y1225 WeakPolarHBondContact CG-O 3.18Å; I1048-Y1225 PolarHBondContact N-O 3.49Å; I1073-Y1225 HydrophobicContact CG2-CD1 4.31Å; K1074-Y1225 WeakPolarHBondContact O-CA 3.29Å; M1075-Y1225 HydrophobicContact CB-CD1 4.03Å; M1075-Y1225 HydrophobicContact CB-CE1 3.9Å; M1075-Y1225 HydrophobicContact CG-CD1 4Å; M1075-Y1225 HydrophobicContact CG-CE1 3.75Å; M1075-Y1225 HydrophobicContact SD-CD1 4.42Å; M1075-Y1225 HydrophobicContact SD-CE1 3.6Å; M1075-Y1225 VanDerWaalsContact SD-CE1 3.6Å; M1075-Y1225 HydrophobicContact SD-CE2 4.4Å; Y1094-Y1225 HydrophobicContact CE1-CE1 4.32Å; I1096-Y1225 HydrophobicContact CG2-CD2 3.59Å; I1096-Y1225 HydrophobicContact CG2-CE2 3.8Å; I1096-Y1225 HydrophobicContact CG2-CG 4.19Å
1226	W	89.6	Confident	75.1	Confident	5 Å²	5	69.9 Å²	69.9	2%	0.019	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	132.1	179	-61.4	100.8	0	0	0	110.6	R1045 R1047 I1073 K1074 Y1224 M1331	R1045-W1226 HydrophobicContact CG-CD2 4.23Å; R1045-W1226 HydrophobicContact CG-CE3 3.51Å; R1045-W1226 HydrophobicContact CG-CZ3 3.89Å; R1047-W1226 HydrophobicContact CB-CE3 3.84Å; R1047-W1226 HydrophobicContact CB-CH2 4.37Å; R1047-W1226 HydrophobicContact CB-CZ3 3.76Å; R1047-W1226 HydrophobicContact CG-CD2 4.39Å; R1047-W1226 HydrophobicContact CG-CE3 4.17Å; R1047-W1226 HydrophobicContact CG-CH2 4.46Å; R1047-W1226 HydrophobicContact CG-CZ3 4.23Å; I1073-W1226 CarbonylContact C-O 3.59Å; I1073-W1226 WeakPolarHBondContact CA-O 3.31Å; K1074-W1226 HydrophobicContact CB-CB 4.46Å; K1074-W1226 PolarHBondContact N-O 3.26Å; K1074-W1226 PolarHBondContact O-N 2.94Å; Y1224-W1226 VanDerWaalsContact O-CD1 3.22Å; W1226-M1331 HydrophobicContact CH2-CB 4.42Å; W1226-M1331 HydrophobicContact CH2-CE 4.15Å; W1226-M1331 HydrophobicContact CH2-CG 3.85Å; W1226-M1331 HydrophobicContact CZ3-CB 4.28Å; W1226-M1331 HydrophobicContact CZ3-CG 3.73Å
1227	I	93.4	Very high	76.1	Confident	0 Å²	0	68 Å²	68	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	129	158	-39.7	166.4	0	0	0	107.2	F1044 R1045 R1046 I1048 I1058 L1071 C1072 M1316 I1318	F1044-I1227 HydrophobicContact CE2-CB 4.4Å; F1044-I1227 HydrophobicContact CE2-CG2 3.98Å; R1045-I1227 WeakPolarHBondContact CA-O 3.35Å; R1046-I1227 PolarHBondContact N-O 3.12Å; R1046-I1227 PolarHBondContact O-N 3.43Å; I1048-I1227 HydrophobicContact CD1-CD1 3.74Å; I1048-I1227 HydrophobicContact CD1-CG1 3.52Å; I1048-I1227 HydrophobicContact CG1-CD1 3.92Å; I1048-I1227 HydrophobicContact CG1-CG1 3.81Å; I1058-I1227 HydrophobicContact CD1-CD1 4.21Å; I1058-I1227 HydrophobicContact CD1-CG1 4.21Å; I1058-I1227 HydrophobicContact CD1-CG2 4.2Å; L1071-I1227 HydrophobicContact CD1-CG2 3.65Å; C1072-I1227 WeakPolarHBondContact O-CA 3.35Å; I1227-M1316 HydrophobicContact CD1-CE 3.79Å; I1227-M1316 HydrophobicContact CD1-SD 4.08Å; I1227-M1316 HydrophobicContact CG2-SD 4.17Å; I1227-I1318 HydrophobicContact CD1-CD1 3.59Å
1228	E	92	Very high	77.4	Confident	7 Å²	7	62.3 Å²	62.3	3%	0.033	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	140.2	170.2	-72.5	172.7	-155.5	0	0	109.5	L1042 F1044 R1045 C1072 K1074 Y1230	L1042-E1228 HydrophobicContact CD1-CB 4.09Å; L1042-E1228 HydrophobicContact CD1-CG 4.23Å; F1044-E1228 WeakPolarHBondContact O-CA 3.22Å; R1045-E1228 HydrophobicContact CB-CG 4.17Å; R1045-E1228 HydrophobicContact CG-CG 3.86Å; R1045-E1228 IonicContact CZ-OE1 3.86Å; R1045-E1228 VanDerWaalsContact CZ-OE1 3.27Å; R1045-E1228 IonicContact NE-OE1 2.74Å; R1045-E1228 PolarHBondContact NE-OE1 3.1Å; R1045-E1228 IonicContact NH2-OE1 3.87Å; R1045-E1228 PolarHBondContact NH2-OE1 3.4Å; C1072-E1228 PolarHBondContact N-O 3.41Å; C1072-E1228 PolarHBondContact O-N 3.07Å; K1074-E1228 VanDerWaalsContact CE-OE2 3.27Å; K1074-E1228 WeakPolarHBondContact CE-OE2 3.45Å; K1074-E1228 IonicContact NZ-OE2 2.71Å; K1074-E1228 PolarHBondContact NZ-OE2 3.19Å; E1228-Y1230 HydrophobicContact CB-CE2 4.08Å; E1228-Y1230 PolarHBondContact OE2-OH 3.4Å
1229	A	93.4	Very high	78.5	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	137.1	172.9	0	0	0	0	0	109.3	L1042 L1043 F1044 L1060 R1070 L1071	L1042-A1229 CarbonylContact C-O 3.56Å; L1043-A1229 HydrophobicContact CB-CB 4.05Å; L1043-A1229 WeakPolarHBondContact CB-O 3.45Å; L1043-A1229 HydrophobicContact CD2-CB 4.16Å; L1043-A1229 PolarHBondContact N-O 2.97Å; F1044-A1229 HydrophobicContact CD1-CB 3.96Å; F1044-A1229 HydrophobicContact CD2-CB 4.17Å; F1044-A1229 HydrophobicContact CE1-CB 3.54Å; F1044-A1229 HydrophobicContact CE2-CB 3.76Å; F1044-A1229 HydrophobicContact CG-CB 4.26Å; F1044-A1229 HydrophobicContact CZ-CB 3.43Å; F1044-A1229 VanDerWaalsContact CZ-CB 3.43Å; F1044-A1229 PolarHBondContact O-N 3.04Å; F1044-A1229 VanDerWaalsContact O-N 3.13Å; L1060-A1229 HydrophobicContact CD2-CB 3.64Å; R1070-A1229 CarbonylContact O-C 3.57Å; R1070-A1229 WeakPolarHBondContact O-CA 3.43Å; L1071-A1229 HydrophobicContact CD1-CB 4.32Å
1230	Y	92	Very high	79.6	Confident	68 Å²	68	59.7 Å²	59.7	27%	0.267	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	149.8	178.8	-62.4	-90.6	0	0	0	110.5	N1041 L1042 T1069 R1070 K1074 E1228	N1041-Y1230 CarbonylContact O-C 3.46Å; N1041-Y1230 WeakPolarHBondContact O-CA 3.5Å; L1042-Y1230 HydrophobicContact CB-CD1 4.2Å; L1042-Y1230 HydrophobicContact CB-CE1 4.16Å; L1042-Y1230 HydrophobicContact CD1-CD1 4.05Å; L1042-Y1230 HydrophobicContact CD1-CE1 3.7Å; L1042-Y1230 HydrophobicContact CD1-CE2 4.32Å; T1069-Y1230 CarbonylContact C-O 3.47Å; T1069-Y1230 WeakPolarHBondContact CA-O 3.32Å; T1069-Y1230 WeakPolarHBondContact CB-O 3.32Å; T1069-Y1230 PolarHBondContact OG1-O 2.71Å; R1070-Y1230 PolarHBondContact N-O 2.81Å; R1070-Y1230 PolarHBondContact O-N 3.44Å; K1074-Y1230 PolarHBondContact NZ-OH 2.9Å; E1228-Y1230 HydrophobicContact CB-CE2 4.08Å; E1228-Y1230 PolarHBondContact OE2-OH 3.4Å
1231	V	90.9	Very high	80.4	Confident	5 Å²	5	57.7 Å²	57.7	3%	0.03	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	137.6	-177.2	173.8	0	0	0	0	110	N1041 L1043 L1062 V1067 G1233 W1236	N1041-V1231 WeakPolarHBondContact CB-O 3.44Å; N1041-V1231 PolarHBondContact ND2-O 3.49Å; N1041-V1231 PolarHBondContact O-N 3.43Å; L1043-V1231 HydrophobicContact CB-CG2 4.04Å; L1043-V1231 HydrophobicContact CD1-CG2 4.32Å; L1043-V1231 HydrophobicContact CD2-CG2 3.93Å; L1043-V1231 HydrophobicContact CG-CG2 4.33Å; L1062-V1231 HydrophobicContact CD1-CG2 3.86Å; V1067-V1231 HydrophobicContact CG1-CB 4.5Å; V1067-V1231 HydrophobicContact CG1-CG1 3.19Å; V1231-G1233 PolarHBondContact O-N 2.87Å; V1231-W1236 HydrophobicContact CG1-CB 4.49Å; V1231-W1236 HydrophobicContact CG1-CE3 3.83Å; V1231-W1236 HydrophobicContact CG2-CZ3 4.46Å
1232	D	84.9	Confident	81.2	Confident	45 Å²	45	53.5 Å²	53.5	24%	0.241	27%	0.272	C	S	.	.			trans	-71.9	98.1	169.9	-171.7	0.1	0	0	0	110.9	Y1068 K1234 N1235 W1236	Y1068-D1232 PolarHBondContact O-N 3.25Å; D1232-K1234 PolarHBondContact O-N 3.39Å; D1232-K1234 WeakPolarHBondContact OD1-CB 3.34Å; D1232-K1234 PolarHBondContact OD1-N 3.47Å; D1232-K1234 VanDerWaalsContact OD1-N 3.1Å; D1232-N1235 PolarHBondContact O-N 2.74Å; D1232-N1235 PolarHBondContact OD2-ND2 3.02Å; D1232-W1236 PolarHBondContact O-N 3.16Å
1233	G	72	Confident	81.7	Confident	22 Å²	22	54.3 Å²	54.3	23%	0.227	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-13.9	179.8	0	0	0	0	0	114.9	Y1035 V1231 N1235	Y1035-G1233 WeakPolarHBondContact OH-CA 3.11Å; V1231-G1233 PolarHBondContact O-N 2.87Å; G1233-N1235 VanDerWaalsContact C-N 3.33Å
1234	K	77.9	Confident	82	Confident	177 Å²	177	50.9 Å²	50.9	77%	0.77	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-31	170.9	-63	177.2	-179.3	176.6	0	112.6	D1232	D1232-K1234 PolarHBondContact O-N 3.39Å; D1232-K1234 WeakPolarHBondContact OD1-CB 3.34Å; D1232-K1234 PolarHBondContact OD1-N 3.47Å; D1232-K1234 VanDerWaalsContact OD1-N 3.1Å
1235	N	75.4	Confident	82.1	Confident	82 Å²	82	50.5 Å²	50.5	44%	0.439	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-6.9	-176.6	-56.8	-37.6	0	0	0	112.4	V1067 D1232 G1233 P1237	V1067-N1235 WeakPolarHBondContact CG2-O 3.46Å; D1232-N1235 PolarHBondContact O-N 2.74Å; D1232-N1235 PolarHBondContact OD2-ND2 3.02Å; G1233-N1235 VanDerWaalsContact C-N 3.33Å; N1235-P1237 VanDerWaalsContact O-CD 3.32Å; N1235-P1237 WeakPolarHBondContact O-CD 3.28Å
1236	W	82.5	Confident	81.7	Confident	6 Å²	6	50 Å²	50	2%	0.023	27%	0.267	C	S	.	.	S	Bend	trans	-114.7	60.8	170.2	-157.9	-2.3	0	0	0	111.8	Y1035 L1043 L1062 V1064 V1067 V1231 D1232 L1238 A1312 H1313	Y1035-W1236 HydrophobicContact CD1-CB 4.48Å; Y1035-W1236 AromaticContact CD1-CD2 3.38Å; Y1035-W1236 HydrophobicContact CD1-CD2 3.38Å; Y1035-W1236 AromaticContact CD1-CE2 3.79Å; Y1035-W1236 AromaticContact CD1-CE3 3.46Å; Y1035-W1236 HydrophobicContact CD1-CE3 3.46Å; Y1035-W1236 VanDerWaalsContact CD1-CE3 3.46Å; Y1035-W1236 AromaticContact CD1-CG 3.8Å; Y1035-W1236 HydrophobicContact CD1-CG 3.8Å; Y1035-W1236 HydrophobicContact CD1-CH2 4.44Å; Y1035-W1236 HydrophobicContact CD1-CZ2 4.32Å; Y1035-W1236 HydrophobicContact CD1-CZ3 4.02Å; Y1035-W1236 AromaticContact CD2-CE3 3.82Å; Y1035-W1236 HydrophobicContact CD2-CE3 3.82Å; Y1035-W1236 AromaticContact CD2-CZ3 3.88Å; Y1035-W1236 HydrophobicContact CD2-CZ3 3.88Å; Y1035-W1236 HydrophobicContact CE1-CB 3.87Å; Y1035-W1236 AromaticContact CE1-CD2 3.66Å; Y1035-W1236 HydrophobicContact CE1-CD2 3.66Å; Y1035-W1236 AromaticContact CE1-CE3 3.71Å; Y1035-W1236 HydrophobicContact CE1-CE3 3.71Å; Y1035-W1236 AromaticContact CE1-CG 3.69Å; Y1035-W1236 HydrophobicContact CE1-CG 3.69Å; Y1035-W1236 WeakPolarHBondContact CE1-O 3.39Å; Y1035-W1236 HydrophobicContact CE2-CE3 4.04Å; Y1035-W1236 HydrophobicContact CE2-CZ3 4.47Å; Y1035-W1236 AromaticContact CG-CD2 3.91Å; Y1035-W1236 HydrophobicContact CG-CD2 3.91Å; Y1035-W1236 AromaticContact CG-CE3 3.53Å; Y1035-W1236 HydrophobicContact CG-CE3 3.53Å; Y1035-W1236 HydrophobicContact CG-CH2 4.05Å; Y1035-W1236 HydrophobicContact CG-CZ2 4.31Å; Y1035-W1236 AromaticContact CG-CZ3 3.63Å; Y1035-W1236 HydrophobicContact CG-CZ3 3.63Å; Y1035-W1236 AromaticContact CZ-CE3 3.99Å; L1043-W1236 HydrophobicContact CD1-CZ3 3.92Å; L1062-W1236 HydrophobicContact CB-CH2 3.92Å; L1062-W1236 HydrophobicContact CB-CZ2 4.44Å; L1062-W1236 HydrophobicContact CB-CZ3 4.3Å; L1062-W1236 HydrophobicContact CD1-CZ3 4.07Å; L1062-W1236 HydrophobicContact CD2-CH2 4.04Å; L1062-W1236 HydrophobicContact CD2-CZ3 3.97Å; L1062-W1236 HydrophobicContact CG-CH2 4.38Å; L1062-W1236 HydrophobicContact CG-CZ3 4.34Å; V1064-W1236 VanDerWaalsContact CG2-NE1 3.3Å; V1067-W1236 HydrophobicContact CG1-CB 4.06Å; V1067-W1236 HydrophobicContact CG1-CD2 4.38Å; V1067-W1236 HydrophobicContact CG1-CE3 4.19Å; V1067-W1236 HydrophobicContact CG1-CG 4.42Å; V1067-W1236 HydrophobicContact CG2-CB 3.69Å; V1067-W1236 HydrophobicContact CG2-CD2 4.28Å; V1067-W1236 HydrophobicContact CG2-CG 3.82Å; V1231-W1236 HydrophobicContact CG1-CB 4.49Å; V1231-W1236 HydrophobicContact CG1-CE3 3.83Å; V1231-W1236 HydrophobicContact CG2-CZ3 4.46Å; D1232-W1236 PolarHBondContact O-N 3.16Å; W1236-L1238 PolarHBondContact O-N 2.79Å; W1236-A1312 HydrophobicContact CZ2-CB 4.14Å; W1236-H1313 WeakPolarHBondContact CH2-O 3.18Å
1237	P	71.6	Confident	80.9	Confident	97 Å²	97	54.2 Å²	54.2	63%	0.63	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-61.3	129.4	172.9	28.2	-34.1	0	0	0	109.9	N1235	N1235-P1237 VanDerWaalsContact O-CD 3.32Å; N1235-P1237 WeakPolarHBondContact O-CD 3.28Å
1238	L	75.4	Confident	80.3	Confident	21 Å²	21	59.8 Å²	59.8	11%	0.11	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-79.4	134.9	171	-69.9	169.9	0	0	0	109.7	Y1035 P1037 W1236 N1242 W1243 L1246 A1312	Y1035-L1238 HydrophobicContact CD1-CD2 3.87Å; Y1035-L1238 HydrophobicContact CD1-CG 4.2Å; Y1035-L1238 HydrophobicContact CE1-CD2 4.45Å; Y1035-L1238 HydrophobicContact CE1-CG 4.31Å; P1037-L1238 HydrophobicContact CG-CD1 3.43Å; P1037-L1238 VanDerWaalsContact CG-CD1 3.43Å; P1037-L1238 HydrophobicContact CG-CG 4.36Å; W1236-L1238 PolarHBondContact O-N 2.79Å; L1238-N1242 HydrophobicContact CB-CB 4.42Å; L1238-N1242 HydrophobicContact CD2-CB 3.99Å; L1238-W1243 HydrophobicContact CB-CD2 4.46Å; L1238-W1243 HydrophobicContact CB-CG 4.19Å; L1238-W1243 HydrophobicContact CD1-CD2 4Å; L1238-W1243 HydrophobicContact CD1-CE3 4.39Å; L1238-W1243 HydrophobicContact CD1-CG 4.41Å; L1238-W1243 HydrophobicContact CD1-CH2 4.46Å; L1238-W1243 HydrophobicContact CD1-CZ2 4.07Å; L1238-L1246 HydrophobicContact CD1-CD1 3.46Å; L1238-L1246 VanDerWaalsContact CD1-CD1 3.46Å; L1238-L1246 HydrophobicContact CD2-CD1 4.06Å; L1238-L1246 HydrophobicContact CG-CD1 4.42Å; L1238-A1312 HydrophobicContact CD2-CB 3.41Å; L1238-A1312 VanDerWaalsContact CD2-CB 3.41Å
1239	S	75	Confident	79.6	Confident	52 Å²	52	61.8 Å²	61.8	36%	0.364	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-63.8	159.8	166.7	60.1	0	0	0	0	111.2	S1241 N1242 W1243	S1239-S1241 PolarHBondContact O-N 3.24Å; S1239-S1241 PolarHBondContact OG-OG 3.07Å; S1239-N1242 PolarHBondContact O-N 3.49Å; S1239-N1242 PolarHBondContact OG-N 3.28Å; S1239-N1242 PolarHBondContact OG-OD1 3.03Å; S1239-W1243 PolarHBondContact O-N 3.32Å
1240	I	75.5	Confident	78.5	Confident	144 Å²	144	64.4 Å²	64.4	74%	0.738	33%	0.333	S	S	*	.	H	α-helix	trans	-57.7	-38.4	177.8	-64.5	168.1	0	0	0	111.2	N1242 W1243 S1244	I1240-N1242 VanDerWaalsContact C-N 3.29Å; I1240-N1242 PolarHBondContact O-N 2.93Å; I1240-W1243 PolarHBondContact O-N 3.34Å; I1240-S1244 PolarHBondContact O-N 2.89Å; I1240-S1244 PolarHBondContact O-OG 2.97Å
1241	S	74.9	Confident	77.4	Confident	70 Å²	70	64.2 Å²	64.2	49%	0.49	34%	0.34	S	S	.	.	H	α-helix	trans	-59.3	-39	174.3	56.7	0	0	0	0	112.9	S1239 F1245	S1239-S1241 PolarHBondContact O-N 3.24Å; S1239-S1241 PolarHBondContact OG-OG 3.07Å; S1241-F1245 WeakPolarHBondContact O-CB 3.38Å; S1241-F1245 PolarHBondContact O-N 3.21Å
1242	N	77.8	Confident	76.5	Confident	8 Å²	8	67.6 Å²	67.6	4%	0.043	36%	0.358	C	S	.	.	H	α-helix	trans	-80.7	-33.7	-175.4	-61.6	18	0	0	0	110.8	L1238 S1239 I1240 L1246 Q1311 A1312	L1238-N1242 HydrophobicContact CB-CB 4.42Å; L1238-N1242 HydrophobicContact CD2-CB 3.99Å; S1239-N1242 PolarHBondContact O-N 3.49Å; S1239-N1242 PolarHBondContact OG-N 3.28Å; S1239-N1242 PolarHBondContact OG-OD1 3.03Å; I1240-N1242 VanDerWaalsContact C-N 3.29Å; I1240-N1242 PolarHBondContact O-N 2.93Å; N1242-L1246 VanDerWaalsContact O-CB 3.3Å; N1242-L1246 WeakPolarHBondContact O-CB 3.22Å; N1242-L1246 WeakPolarHBondContact O-CD1 3.49Å; N1242-L1246 VanDerWaalsContact O-CG 3.25Å; N1242-L1246 WeakPolarHBondContact O-CG 3.42Å; N1242-L1246 PolarHBondContact O-N 3.25Å; N1242-Q1311 VanDerWaalsContact CA-OE1 3.27Å; N1242-Q1311 PolarHBondContact OD1-OE1 3.03Å; N1242-Q1311 VanDerWaalsContact OD1-OE1 3.14Å; N1242-A1312 PolarHBondContact ND2-N 2.99Å
1243	W	78.7	Confident	75.6	Confident	118 Å²	118	69.3 Å²	69.3	45%	0.447	36%	0.364	S	S	.	.	H	α-helix	trans	-59.5	-50.8	166.3	-87.7	115.1	0	0	0	111.9	P1037 L1238 S1239 I1240 F1245 L1246 E1247	P1037-W1243 HydrophobicContact CB-CH2 4.43Å; P1037-W1243 HydrophobicContact CG-CH2 4Å; P1037-W1243 HydrophobicContact CG-CZ2 4.23Å; L1238-W1243 HydrophobicContact CB-CD2 4.46Å; L1238-W1243 HydrophobicContact CB-CG 4.19Å; L1238-W1243 HydrophobicContact CD1-CD2 4Å; L1238-W1243 HydrophobicContact CD1-CE3 4.39Å; L1238-W1243 HydrophobicContact CD1-CG 4.41Å; L1238-W1243 HydrophobicContact CD1-CH2 4.46Å; L1238-W1243 HydrophobicContact CD1-CZ2 4.07Å; S1239-W1243 PolarHBondContact O-N 3.32Å; I1240-W1243 PolarHBondContact O-N 3.34Å; W1243-F1245 VanDerWaalsContact C-N 3.33Å; W1243-F1245 PolarHBondContact O-N 3.01Å; W1243-L1246 PolarHBondContact O-N 3.27Å; W1243-E1247 WeakPolarHBondContact O-CB 3.25Å; W1243-E1247 PolarHBondContact O-N 2.84Å
1244	S	78.1	Confident	75.2	Confident	78 Å²	78	73.3 Å²	73.3	55%	0.545	38%	0.379	S	S	.	.	H	α-helix	trans	-59.2	-43.1	178	-62.1	0	0	0	0	112.2	I1240 E1247 E1248	I1240-S1244 PolarHBondContact O-N 2.89Å; I1240-S1244 PolarHBondContact O-OG 2.97Å; S1244-E1247 PolarHBondContact O-N 3.09Å; S1244-E1248 WeakPolarHBondContact O-CB 3.4Å; S1244-E1248 PolarHBondContact O-N 3.38Å
1245	F	84.3	Confident	74.3	Confident	41 Å²	41	69.8 Å²	69.8	18%	0.18	37%	0.366	C	S	.	.	H	α-helix	trans	-65.5	-40	176.5	172.4	-97.5	0	0	0	113.3	Y1034 S1241 W1243 E1248 Q1249 Q1311	Y1034-F1245 AromaticContact CD1-CE1 3.85Å; Y1034-F1245 HydrophobicContact CD1-CE1 3.85Å; Y1034-F1245 HydrophobicContact CD2-CE1 4.17Å; Y1034-F1245 AromaticContact CE1-CE1 3.55Å; Y1034-F1245 HydrophobicContact CE1-CE1 3.55Å; Y1034-F1245 AromaticContact CE1-CZ 3.94Å; Y1034-F1245 HydrophobicContact CE1-CZ 3.94Å; Y1034-F1245 AromaticContact CE2-CE1 3.89Å; Y1034-F1245 HydrophobicContact CE2-CE1 3.89Å; Y1034-F1245 AromaticContact CE2-CZ 3.92Å; Y1034-F1245 HydrophobicContact CE2-CZ 3.92Å; Y1034-F1245 HydrophobicContact CG-CE1 4.15Å; Y1034-F1245 AromaticContact CZ-CE1 3.56Å; Y1034-F1245 AromaticContact CZ-CZ 3.53Å; S1241-F1245 WeakPolarHBondContact O-CB 3.38Å; S1241-F1245 PolarHBondContact O-N 3.21Å; W1243-F1245 VanDerWaalsContact C-N 3.33Å; W1243-F1245 PolarHBondContact O-N 3.01Å; F1245-E1248 PolarHBondContact O-N 3.35Å; F1245-Q1249 HydrophobicContact CD1-CG 4.46Å; F1245-Q1249 HydrophobicContact CE1-CG 3.84Å; F1245-Q1249 HydrophobicContact CE2-CG 4.35Å; F1245-Q1249 HydrophobicContact CZ-CG 3.78Å; F1245-Q1249 WeakPolarHBondContact O-CB 3.4Å; F1245-Q1249 PolarHBondContact O-N 2.73Å; F1245-Q1311 HydrophobicContact CD1-CB 4.16Å; F1245-Q1311 VanDerWaalsContact CD1-CD 3.45Å; F1245-Q1311 HydrophobicContact CD1-CG 3.61Å; F1245-Q1311 HydrophobicContact CD2-CG 4.41Å; F1245-Q1311 HydrophobicContact CE1-CB 4.19Å; F1245-Q1311 HydrophobicContact CE1-CG 3.79Å; F1245-Q1311 VanDerWaalsContact CG-CD 3.46Å; F1245-Q1311 HydrophobicContact CG-CG 3.95Å; F1245-Q1311 HydrophobicContact CZ-CG 4.26Å
1246	L	80	Confident	73.3	Confident	4 Å²	4	72.9 Å²	72.9	2%	0.021	38%	0.377	C	S	.	.	H	α-helix	trans	-68.4	-36.5	177.4	-78.7	165.5	0	0	0	112.1	Y1035 E1036 L1238 N1242 W1243 Q1249 R1250	Y1035-L1246 VanDerWaalsContact O-CD1 3.22Å; Y1035-L1246 WeakPolarHBondContact O-CD1 3.02Å; E1036-L1246 HydrophobicContact CG-CD2 4.16Å; L1238-L1246 HydrophobicContact CD1-CD1 3.46Å; L1238-L1246 VanDerWaalsContact CD1-CD1 3.46Å; L1238-L1246 HydrophobicContact CD2-CD1 4.06Å; L1238-L1246 HydrophobicContact CG-CD1 4.42Å; N1242-L1246 VanDerWaalsContact O-CB 3.3Å; N1242-L1246 WeakPolarHBondContact O-CB 3.22Å; N1242-L1246 WeakPolarHBondContact O-CD1 3.49Å; N1242-L1246 VanDerWaalsContact O-CG 3.25Å; N1242-L1246 WeakPolarHBondContact O-CG 3.42Å; N1242-L1246 PolarHBondContact O-N 3.25Å; W1243-L1246 PolarHBondContact O-N 3.27Å; L1246-Q1249 WeakPolarHBondContact O-CB 3.3Å; L1246-Q1249 PolarHBondContact O-N 3.36Å; L1246-R1250 WeakPolarHBondContact O-CG 3.4Å; L1246-R1250 PolarHBondContact O-N 2.7Å
1247	E	73.6	Confident	71.8	Confident	94 Å²	94	75.5 Å²	75.5	44%	0.439	40%	0.396	S	S	.	.	H	α-helix	trans	-73.3	-36.1	175.8	-144.1	59.4	-160.3	0	0	111.1	W1243 S1244 R1250 C1251	W1243-E1247 WeakPolarHBondContact O-CB 3.25Å; W1243-E1247 PolarHBondContact O-N 2.84Å; S1244-E1247 PolarHBondContact O-N 3.09Å; E1247-R1250 PolarHBondContact O-N 3.16Å; E1247-R1250 WeakPolarHBondContact OE2-CD 3.29Å; E1247-R1250 IonicContact OE2-NH1 2.75Å; E1247-R1250 PolarHBondContact OE2-NH1 3.48Å; E1247-C1251 WeakPolarHBondContact O-CB 3.32Å; E1247-C1251 PolarHBondContact O-N 2.98Å; E1247-C1251 PolarHBondContact O-SG 3.39Å; E1247-C1251 VanDerWaalsContact O-SG 3.39Å
1248	E	81.2	Confident	70.6	Confident	116 Å²	116	76.4 Å²	76.4	54%	0.542	39%	0.391	S	S	.	.	H	α-helix	trans	-61.3	-42.9	167.7	-160.8	-159.6	141.2	0	0	111.5	S1244 F1245 R1250 C1251 N1252	S1244-E1248 WeakPolarHBondContact O-CB 3.4Å; S1244-E1248 PolarHBondContact O-N 3.38Å; F1245-E1248 PolarHBondContact O-N 3.35Å; E1248-R1250 VanDerWaalsContact C-N 3.31Å; E1248-R1250 PolarHBondContact O-N 2.67Å; E1248-C1251 PolarHBondContact O-N 3.2Å; E1248-N1252 VanDerWaalsContact O-CB 3.22Å; E1248-N1252 WeakPolarHBondContact O-CB 3.48Å; E1248-N1252 PolarHBondContact O-N 3.37Å; E1248-N1252 PolarHBondContact O-ND2 3.01Å; E1248-N1252 VanDerWaalsContact O-ND2 3.1Å; E1248-N1252 PolarHBondContact OE1-ND2 3.48Å
1249	Q	76.6	Confident	69.1	Low	49 Å²	49	78.8 Å²	78.8	23%	0.229	41%	0.407	C	S	.	.	H	α-helix	trans	-57.7	-40.4	171.5	-95.2	-83.4	-33.4	0	0	112.1	F1245 L1246 K1253	F1245-Q1249 HydrophobicContact CD1-CG 4.46Å; F1245-Q1249 HydrophobicContact CE1-CG 3.84Å; F1245-Q1249 HydrophobicContact CE2-CG 4.35Å; F1245-Q1249 HydrophobicContact CZ-CG 3.78Å; F1245-Q1249 WeakPolarHBondContact O-CB 3.4Å; F1245-Q1249 PolarHBondContact O-N 2.73Å; L1246-Q1249 WeakPolarHBondContact O-CB 3.3Å; L1246-Q1249 PolarHBondContact O-N 3.36Å; Q1249-K1253 WeakPolarHBondContact O-CB 3.48Å; Q1249-K1253 WeakPolarHBondContact O-CG 3.33Å; Q1249-K1253 PolarHBondContact O-N 3.34Å; Q1249-K1253 VanDerWaalsContact OE1-CE 3.23Å
1250	R	70.7	Confident	67.5	Low	56 Å²	56	82.5 Å²	82.5	21%	0.211	42%	0.423	C	S	.	.	H	α-helix	trans	-71.7	-44.4	178.2	-75.4	169.5	179.2	156.5	-2.7	112.2	E1036 L1246 E1247 E1248 N1252 K1253 L1254	E1036-R1250 IonicContact OE2-CZ 2.84Å; E1036-R1250 VanDerWaalsContact OE2-CZ 3.27Å; E1036-R1250 IonicContact OE2-NE 4Å; E1036-R1250 PolarHBondContact OE2-NE 3.29Å; E1036-R1250 IonicContact OE2-NH2 3.63Å; E1036-R1250 PolarHBondContact OE2-NH2 3.4Å; L1246-R1250 WeakPolarHBondContact O-CG 3.4Å; L1246-R1250 PolarHBondContact O-N 2.7Å; E1247-R1250 PolarHBondContact O-N 3.16Å; E1247-R1250 WeakPolarHBondContact OE2-CD 3.29Å; E1247-R1250 IonicContact OE2-NH1 2.75Å; E1247-R1250 PolarHBondContact OE2-NH1 3.48Å; E1248-R1250 VanDerWaalsContact C-N 3.31Å; E1248-R1250 PolarHBondContact O-N 2.67Å; R1250-N1252 VanDerWaalsContact C-N 3.34Å; R1250-N1252 PolarHBondContact O-N 3.36Å; R1250-K1253 PolarHBondContact O-N 2.92Å; R1250-L1254 WeakPolarHBondContact O-CB 3.15Å; R1250-L1254 VanDerWaalsContact O-CG 3.27Å; R1250-L1254 WeakPolarHBondContact O-CG 3.26Å; R1250-L1254 PolarHBondContact O-N 2.98Å
1251	C	69.2	Low	65.7	Low	64 Å²	64	80.2 Å²	80.2	43%	0.432	41%	0.412	S	S	.	.	H	α-helix	trans	-56.9	-47.8	170.6	-71.4	0	0	0	0	110.8	E1247 E1248 K1253 L1254 E1255	E1247-C1251 WeakPolarHBondContact O-CB 3.32Å; E1247-C1251 PolarHBondContact O-N 2.98Å; E1247-C1251 PolarHBondContact O-SG 3.39Å; E1247-C1251 VanDerWaalsContact O-SG 3.39Å; E1248-C1251 PolarHBondContact O-N 3.2Å; C1251-K1253 PolarHBondContact O-N 3.41Å; C1251-L1254 CarbonylContact O-C 3.59Å; C1251-L1254 WeakPolarHBondContact O-CB 3.09Å; C1251-L1254 PolarHBondContact O-N 3.36Å; C1251-L1254 VanDerWaalsContact O-N 3.15Å; C1251-E1255 WeakPolarHBondContact O-CB 3.4Å; C1251-E1255 WeakPolarHBondContact O-CG 3.45Å; C1251-E1255 PolarHBondContact O-N 3.04Å
1252	N	71.1	Confident	63.9	Low	75 Å²	75	82 Å²	82	40%	0.401	42%	0.42	S	S	.	.	H	α-helix	trans	-63.4	-38.7	176.9	-75	-36.3	0	0	0	113	E1248 R1250 E1255 E1256	E1248-N1252 VanDerWaalsContact O-CB 3.22Å; E1248-N1252 WeakPolarHBondContact O-CB 3.48Å; E1248-N1252 PolarHBondContact O-N 3.37Å; E1248-N1252 PolarHBondContact O-ND2 3.01Å; E1248-N1252 VanDerWaalsContact O-ND2 3.1Å; E1248-N1252 PolarHBondContact OE1-ND2 3.48Å; R1250-N1252 VanDerWaalsContact C-N 3.34Å; R1250-N1252 PolarHBondContact O-N 3.36Å; N1252-E1255 PolarHBondContact O-N 2.89Å; N1252-E1256 WeakPolarHBondContact O-CB 3.2Å; N1252-E1256 PolarHBondContact O-N 2.87Å
1253	K	66	Low	61.7	Low	82 Å²	82	87.6 Å²	87.6	36%	0.357	46%	0.455	S	S	.	.	H	α-helix	trans	-64.6	-39.4	172.2	-74.9	169.6	-170.8	-178.2	0	111.6	E1036 Q1249 R1250 C1251 C1257	E1036-K1253 IonicContact OE1-NZ 2.83Å; E1036-K1253 PolarHBondContact OE1-NZ 3.31Å; Q1249-K1253 WeakPolarHBondContact O-CB 3.48Å; Q1249-K1253 WeakPolarHBondContact O-CG 3.33Å; Q1249-K1253 PolarHBondContact O-N 3.34Å; Q1249-K1253 VanDerWaalsContact OE1-CE 3.23Å; R1250-K1253 PolarHBondContact O-N 2.92Å; C1251-K1253 PolarHBondContact O-N 3.41Å; K1253-C1257 PolarHBondContact O-N 2.98Å; K1253-C1257 PolarHBondContact O-SG 2.93Å
1254	L	63.6	Low	59.5	Low	105 Å²	105	87 Å²	87	55%	0.55	47%	0.468	S	S	.	.	H	α-helix	trans	-70.6	-36.7	176.4	-72.5	167.6	0	0	0	112.1	R1250 C1251 C1257 Q1258	R1250-L1254 WeakPolarHBondContact O-CB 3.15Å; R1250-L1254 VanDerWaalsContact O-CG 3.27Å; R1250-L1254 WeakPolarHBondContact O-CG 3.26Å; R1250-L1254 PolarHBondContact O-N 2.98Å; C1251-L1254 CarbonylContact O-C 3.59Å; C1251-L1254 WeakPolarHBondContact O-CB 3.09Å; C1251-L1254 PolarHBondContact O-N 3.36Å; C1251-L1254 VanDerWaalsContact O-N 3.15Å; L1254-C1257 CarbonylContact O-C 3.56Å; L1254-C1257 WeakPolarHBondContact O-CB 3.45Å; L1254-C1257 PolarHBondContact O-N 3.16Å; L1254-Q1258 WeakPolarHBondContact O-CG 3.47Å; L1254-Q1258 PolarHBondContact O-N 3.39Å; L1254-Q1258 PolarHBondContact O-NE2 2.73Å
1255	E	58.4	Low	57.4	Low	104 Å²	104	94.6 Å²	94.6	49%	0.486	49%	0.485	S	S	.	.	H	α-helix	trans	-72.9	-39.8	174.8	-78.2	-167	-166.5	0	0	112.1	C1251 N1252 C1257 Q1258 V1259	C1251-E1255 WeakPolarHBondContact O-CB 3.4Å; C1251-E1255 WeakPolarHBondContact O-CG 3.45Å; C1251-E1255 PolarHBondContact O-N 3.04Å; N1252-E1255 PolarHBondContact O-N 2.89Å; E1255-C1257 PolarHBondContact O-N 3.02Å; E1255-Q1258 CarbonylContact O-C 3.58Å; E1255-Q1258 WeakPolarHBondContact O-CA 3.25Å; E1255-Q1258 PolarHBondContact O-N 2.84Å; E1255-V1259 HydrophobicContact CB-CG2 4.29Å; E1255-V1259 WeakPolarHBondContact O-CB 3.49Å; E1255-V1259 VanDerWaalsContact O-CG2 3.25Å; E1255-V1259 WeakPolarHBondContact O-CG2 3.37Å; E1255-V1259 PolarHBondContact O-N 2.9Å
1256	E	55.2	Low	54.8	Low	146 Å²	146	98 Å²	98	68%	0.682	51%	0.514	S	S	*	.	H	α-helix	trans	-62.1	-27.6	172.6	-164.9	172.4	-149.4	0	0	111	N1252 Q1258 N1260	N1252-E1256 WeakPolarHBondContact O-CB 3.2Å; N1252-E1256 PolarHBondContact O-N 2.87Å; E1256-Q1258 VanDerWaalsContact C-N 3.29Å; E1256-Q1258 PolarHBondContact O-N 3.48Å; E1256-N1260 PolarHBondContact O-ND2 3.11Å; E1256-N1260 VanDerWaalsContact O-ND2 3.08Å
1257	C	49.9	Very low	52.6	Low	61 Å²	61	104.1 Å²	104.1	41%	0.412	55%	0.552	S	S	.	*	H	α-helix	trans	-79.5	4.1	169.3	-63.7	0	0	0	0	115.3	K1253 L1254 E1255 R1343	K1253-C1257 PolarHBondContact O-N 2.98Å; K1253-C1257 PolarHBondContact O-SG 2.93Å; L1254-C1257 CarbonylContact O-C 3.56Å; L1254-C1257 WeakPolarHBondContact O-CB 3.45Å; L1254-C1257 PolarHBondContact O-N 3.16Å; E1255-C1257 PolarHBondContact O-N 3.02Å; C1257-R1343 PolarHBondContact O-NH1 3.39Å
1258	Q	48.1	Very low	50.8	Low	116 Å²	116	105.2 Å²	105.2	54%	0.542	57%	0.57	S	S	.	*	H	α-helix	trans	-126.6	-37.4	177	-69.9	174.6	52.3	0	0	113.2	L1254 E1255 E1256 N1260 N1261	L1254-Q1258 WeakPolarHBondContact O-CG 3.47Å; L1254-Q1258 PolarHBondContact O-N 3.39Å; L1254-Q1258 PolarHBondContact O-NE2 2.73Å; E1255-Q1258 CarbonylContact O-C 3.58Å; E1255-Q1258 WeakPolarHBondContact O-CA 3.25Å; E1255-Q1258 PolarHBondContact O-N 2.84Å; E1256-Q1258 VanDerWaalsContact C-N 3.29Å; E1256-Q1258 PolarHBondContact O-N 3.48Å; Q1258-N1260 PolarHBondContact O-N 3.5Å; Q1258-N1261 WeakPolarHBondContact O-CB 3.46Å; Q1258-N1261 PolarHBondContact O-N 3.37Å
1259	V	43.4	Very low	48.5	Very low	72 Å²	72	103.9 Å²	103.9	44%	0.436	58%	0.578	S	S	.	*	H	α-helix	trans	-69.3	-15.5	-172	167.7	0	0	0	0	113.2	E1255 N1261 T1262	E1255-V1259 HydrophobicContact CB-CG2 4.29Å; E1255-V1259 WeakPolarHBondContact O-CB 3.49Å; E1255-V1259 VanDerWaalsContact O-CG2 3.25Å; E1255-V1259 WeakPolarHBondContact O-CG2 3.37Å; E1255-V1259 PolarHBondContact O-N 2.9Å; V1259-N1261 PolarHBondContact O-N 3.02Å; V1259-N1261 VanDerWaalsContact O-N 3.1Å; V1259-T1262 PolarHBondContact O-N 3.44Å; V1259-T1262 PolarHBondContact O-OG1 3.3Å
1260	N	41.5	Very low	46.6	Very low	129 Å²	129	107.5 Å²	107.5	69%	0.69	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	-18.8	165.8	-74.9	-56.8	0	0	0	113.1	E1256 Q1258	E1256-N1260 PolarHBondContact O-ND2 3.11Å; E1256-N1260 VanDerWaalsContact O-ND2 3.08Å; Q1258-N1260 PolarHBondContact O-N 3.5Å
1261	N	37.5	Very low	45.1	Very low	97 Å²	97	113 Å²	113	52%	0.519	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.4	-4.1	-177.1	-68.6	-9.8	0	0	0	115.6	Q1258 V1259 E1347	Q1258-N1261 WeakPolarHBondContact O-CB 3.46Å; Q1258-N1261 PolarHBondContact O-N 3.37Å; V1259-N1261 PolarHBondContact O-N 3.02Å; V1259-N1261 VanDerWaalsContact O-N 3.1Å; N1261-E1347 PolarHBondContact ND2-OE1 2.85Å
1262	T	36.3	Very low	43.5	Very low	107 Å²	107	114.8 Å²	114.8	66%	0.656	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.9	-23.2	-177	54.5	0	0	0	0	115.3	V1259 S1264	V1259-T1262 PolarHBondContact O-N 3.44Å; V1259-T1262 PolarHBondContact O-OG1 3.3Å; T1262-S1264 PolarHBondContact O-N 3.25Å
1263	T	31.3	Very low	41.9	Very low	126 Å²	126	116.4 Å²	116.4	77%	0.773	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	52.7	-172.5	-49.7	0	0	0	0	113.6
1264	S	33.3	Very low	40.5	Very low	104 Å²	104	119.2 Å²	119.2	73%	0.727	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.9	9.8	176.6	65.3	0	0	0	0	117.1	T1262	T1262-S1264 PolarHBondContact O-N 3.25Å
1265	R	33.8	Very low	39.1	Very low	238 Å²	238	117.9 Å²	117.9	90%	0.898	67%	0.674	S	S	*	*			trans	-140.7	49	-169.4	-145.1	169.9	-172.7	165.6	0.7	117.5
1266	S	30.1	Very low	38.2	Very low	114 Å²	114	123.4 Å²	123.4	80%	0.797	69%	0.69	S	S	*	*			trans	-140.4	56.7	179	51.6	0	0	0	0	115.6
1267	T	34.4	Very low	37.2	Very low	131 Å²	131	122.4 Å²	122.4	80%	0.804	69%	0.694	S	S	*	*			trans	-137.9	103	164.4	39.1	0	0	0	0	114.7
1268	S	35	Very low	36.7	Very low	118 Å²	118	126.5 Å²	126.5	83%	0.825	71%	0.71	S	S	*	*			trans	65.7	147.1	157.8	72.1	0	0	0	0	120.2
1269	A	33.9	Very low	36.1	Very low	87 Å²	87	129.8 Å²	129.8	72%	0.719	72%	0.723	S	S	*	*			cis	-175.9	148.6	-22.7	0	0	0	0	0	108.6
1270	D	36.8	Very low	35.7	Very low	125 Å²	125	131.3 Å²	131.3	67%	0.668	74%	0.737	S	S	*	*			trans	-169.3	129.6	134.5	-121.2	-18	0	0	0	113.7
1271	K	38	Very low	35.3	Very low	173 Å²	173	129.8 Å²	129.8	75%	0.752	74%	0.742	S	S	*	*			trans	57.3	142.3	151.4	-66.3	144.2	-169.3	154.3	0	119.9
1272	S	35.2	Very low	35.3	Very low	101 Å²	101	131.3 Å²	131.3	71%	0.706	76%	0.755	S	S	*	*			cis	-159.7	169.7	-0.2	49.2	0	0	0	0	112.4
1273	S	37.1	Very low	35.3	Very low	108 Å²	108	135 Å²	135	76%	0.755	76%	0.762	S	S	*	*			trans	63.4	141	168.4	41.9	0	0	0	0	117.5
1274	D	38.1	Very low	35.3	Very low	141 Å²	141	134.5 Å²	134.5	75%	0.754	76%	0.764	S	S	*	*			cis	-144.7	-179.9	-3.3	-145.6	-70	0	0	0	112
1275	S	33.8	Very low	35.6	Very low	78 Å²	78	135.9 Å²	135.9	55%	0.545	77%	0.77	S	S	.	*			trans	-59.9	161.4	176.7	60	0	0	0	0	114.1
1276	R	38.5	Very low	35.5	Very low	220 Å²	220	128.1 Å²	128.1	83%	0.83	76%	0.764	S	S	*	*			cis	-160.1	149.7	47.2	-68.7	174.6	-172	166.8	4	114.3
1277	T	35.1	Very low	35.5	Very low	125 Å²	125	130 Å²	130	77%	0.767	77%	0.766	S	S	*	*			trans	29.1	128.9	136.6	-20.2	0	0	0	0	119.3
1278	I	38.5	Very low	35.5	Very low	147 Å²	147	132.6 Å²	132.6	75%	0.754	77%	0.766	S	S	*	*				-167.6	149.4	74	-82.9	171.9	0	0	0	113.6
1279	K	36.3	Very low	35.5	Very low	184 Å²	184	132.4 Å²	132.4	80%	0.8	76%	0.76	S	S	*	*			trans	-10.7	163.3	152.8	-48.7	171.9	-172.4	174.7	0	120.2
1280	S	35.3	Very low	35.5	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	77%	0.768	S	S	*	*			cis	179.9	136.3	-26.6	59.3	0	0	0	0	112.2
1281	A	32.8	Very low	35.2	Very low	96 Å²	96	133.9 Å²	133.9	79%	0.793	77%	0.77	S	S	*	*			trans	44.9	130.9	149.2	0	0	0	0	0	124.1
1282	T	38.8	Very low	34.7	Very low	129 Å²	129	132.2 Å²	132.2	79%	0.791	77%	0.774	S	S	*	*			trans	-159.8	137.4	134.5	16.1	0	0	0	0	115.2
1283	K	34.9	Very low	34.6	Very low	186 Å²	186	132.8 Å²	132.8	81%	0.809	77%	0.773	S	S	*	*			trans	10	130.2	148.2	-54.8	164.2	-174.1	174.7	0	118.6
1284	S	30.9	Very low	34.2	Very low	115 Å²	115	130.9 Å²	130.9	80%	0.804	77%	0.771	S	S	*	*			cis	73.5	150.6	47.9	-56.1	0	0	0	0	115.5
1285	P	40.1	Very low	33.9	Very low	132 Å²	132	133.6 Å²	133.6	86%	0.857	78%	0.779	S	S	*	*			cis	-145.5	177.1	-27.9	39.9	-21.7	0	0	0	116.7
1286	G	32.1	Very low	33.5	Very low	76 Å²	76	140 Å²	140	78%	0.784	80%	0.797	S	S	*	*			trans	115.7	164.2	148.8	0	0	0	0	0	118.3
1287	N	30.4	Very low	33	Very low	154 Å²	154	135.1 Å²	135.1	82%	0.824	80%	0.797	S	S	*	*			cis	-171.8	130.3	-15.7	-175.5	9.4	0	0	0	111.2
1288	K	33.2	Very low	32.6	Very low	185 Å²	185	132.8 Å²	132.8	80%	0.804	80%	0.798	S	S	*	*			trans	167	141.1	143	-97.6	168.5	-177.9	177.9	0	116.3
1289	T	37	Very low	32	Very low	114 Å²	114	131 Å²	131	70%	0.699	80%	0.798	S	S	*	*			trans	36.2	122.2	145.8	58.4	0	0	0	0	120.4
1290	I	32.3	Very low	31.6	Very low	173 Å²	173	128.8 Å²	128.8	89%	0.887	80%	0.8	S	S	*	*				59.5	114.6	53	-50.3	170.3	0	0	0	112.5
1291	G	31.4	Very low	31.1	Very low	70 Å²	70	135.2 Å²	135.2	72%	0.722	81%	0.808	S	S	*	*			cis	177.8	155.2	-5.1	0	0	0	0	0	111.5
1292	V	27.4	Very low	30.9	Very low	137 Å²	137	132.6 Å²	132.6	83%	0.83	79%	0.791	S	S	*	*			trans	-132.3	129.6	-175.2	176.5	0	0	0	0	111.8
1293	T	32.9	Very low	30.5	Very low	113 Å²	113	131.1 Å²	131.1	69%	0.693	78%	0.782	S	S	*	*			trans	-142.4	126.8	155.1	72.9	0	0	0	0	108.4	K1145	K1145-T1293 PolarHBondContact NZ-OG1 3.35Å
1294	G	28.6	Very low	30.8	Very low	69 Å²	69	127.9 Å²	127.9	71%	0.711	78%	0.783	S	S	*	*			cis	141.9	135.3	-4.5	0	0	0	0	0	111.3
1295	Q	32.7	Very low	31.8	Very low	198 Å²	198	126.2 Å²	126.2	93%	0.925	78%	0.775	S	S	*	*			trans	-140.3	139	168.2	-99.7	175.5	-17.2	0	0	108.8
1296	K	24.4	Very low	33	Very low	213 Å²	213	129.6 Å²	129.6	93%	0.926	78%	0.777	S	S	*	*			trans	-111.4	115.6	173.8	-73	-174.4	174.9	-173.2	0	108.6
1297	S	28.6	Very low	35.1	Very low	116 Å²	116	126.7 Å²	126.7	81%	0.811	74%	0.743	S	S	*	*			trans	-84	160.4	158.4	-60.7	0	0	0	0	109.6	S1299	S1297-S1299 PolarHBondContact O-N 3.26Å
1298	G	26.7	Very low	37.3	Very low	77 Å²	77	122.3 Å²	122.3	79%	0.794	72%	0.72	S	S	*	*			trans	-59.5	134.8	-176.5	0	0	0	0	0	112.7	T1300	G1298-T1300 PolarHBondContact O-N 3.48Å
1299	S	24.9	Very low	39.6	Very low	109 Å²	109	117 Å²	117	76%	0.762	70%	0.695	S	S	*	*			trans	-84.1	98.4	177.7	-177.5	0	0	0	0	110.3	S1297 R1301	S1297-S1299 PolarHBondContact O-N 3.26Å; S1299-R1301 PolarHBondContact O-N 3.01Å; S1299-R1301 VanDerWaalsContact O-N 3.11Å
1300	T	27.9	Very low	41.6	Very low	137 Å²	137	116.8 Å²	116.8	84%	0.84	69%	0.689	S	S	*	*			trans	-69.1	97.5	157	-49.2	0	0	0	0	107	G1298 G1302	G1298-T1300 PolarHBondContact O-N 3.48Å; T1300-G1302 PolarHBondContact O-N 3.24Å; T1300-G1302 VanDerWaalsContact O-N 3.13Å
1301	R	25.8	Very low	43.9	Very low	240 Å²	240	109.5 Å²	109.5	91%	0.906	65%	0.652	S	S	*	*			trans	-85.9	82.9	-173.7	-172	179.4	175.9	-172.9	-4.6	110.8	S1299	S1299-R1301 PolarHBondContact O-N 3.01Å; S1299-R1301 VanDerWaalsContact O-N 3.11Å
1302	G	27.5	Very low	46.6	Very low	41 Å²	41	106.3 Å²	106.3	42%	0.423	62%	0.619	S	S	.	*	S	Bend	trans	-177.3	150.3	174	0	0	0	0	0	110.4	T1300	T1300-G1302 PolarHBondContact O-N 3.24Å; T1300-G1302 VanDerWaalsContact O-N 3.13Å
1303	T	31.9	Very low	49.5	Very low	99 Å²	99	100 Å²	100	61%	0.607	58%	0.58	S	S	*	*	S	Bend	trans	49.5	71.7	178.1	61.3	0	0	0	0	115.7
1304	S	40.2	Very low	52.3	Low	118 Å²	118	94.7 Å²	94.7	83%	0.825	55%	0.547	S	S	*	.			trans	-150.4	38.8	154.9	83.9	0	0	0	0	113
1305	A	52.4	Low	55.2	Low	79 Å²	79	92.7 Å²	92.7	65%	0.653	52%	0.519	S	S	*	.	S	Bend	trans	-64.9	138.8	154.6	0	0	0	0	0	107.2	I1307	A1305-I1307 PolarHBondContact O-N 2.93Å
1306	K	64.7	Low	58	Low	203 Å²	203	83.3 Å²	83.3	88%	0.883	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-62.4	123.5	171.2	-86.1	-173	169.3	-171.8	0	108.1
1307	I	75.6	Confident	61.2	Low	16 Å²	16	73.6 Å²	73.6	8%	0.082	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-64.9	134.6	171.4	-74.7	-177.6	0	0	0	109.2	E1032 Y1034 A1305 Y1309 H1313	E1032-I1307 HydrophobicContact CB-CD1 3.73Å; E1032-I1307 HydrophobicContact CG-CD1 3.69Å; Y1034-I1307 HydrophobicContact CD1-CG2 4.46Å; Y1034-I1307 HydrophobicContact CE1-CB 4.42Å; Y1034-I1307 HydrophobicContact CE1-CG1 4.37Å; Y1034-I1307 HydrophobicContact CE1-CG2 3.78Å; Y1034-I1307 HydrophobicContact CE2-CG1 4.35Å; Y1034-I1307 WeakPolarHBondContact OH-CA 3.44Å; A1305-I1307 PolarHBondContact O-N 2.93Å; I1307-Y1309 HydrophobicContact CG2-CD1 4.43Å; I1307-Y1309 PolarHBondContact O-N 3.44Å; I1307-H1313 HydrophobicContact CG2-CB 4.05Å
1308	D	78.1	Confident	64.2	Low	61 Å²	61	68.1 Å²	68.1	33%	0.326	39%	0.394	S	S	.	.			trans	-76	108.4	165.6	-180	8.9	0	0	0	108.5	Y1034 N1310 Q1311	Y1034-D1308 PolarHBondContact OH-N 3.45Å; Y1034-D1308 VanDerWaalsContact OH-N 3.13Å; D1308-N1310 PolarHBondContact O-N 2.94Å; D1308-N1310 VanDerWaalsContact O-N 3.11Å; D1308-N1310 WeakPolarHBondContact OD1-CB 3.5Å; D1308-N1310 PolarHBondContact OD1-N 2.9Å; D1308-N1310 VanDerWaalsContact OD1-N 3.08Å; D1308-N1310 PolarHBondContact OD1-ND2 3.45Å; D1308-Q1311 HydrophobicContact CB-CG 3.89Å; D1308-Q1311 WeakPolarHBondContact O-CB 3.44Å; D1308-Q1311 PolarHBondContact O-N 3.49Å
1309	Y	79.9	Confident	67.2	Low	75 Å²	75	65.1 Å²	65.1	29%	0.294	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-10.4	-178.2	-65.3	-65.2	0	0	0	114	H889 T891 I1307 Q1311 H1313	H889-Y1309 VanDerWaalsContact CB-O 3.26Å; H889-Y1309 WeakPolarHBondContact CB-O 3.24Å; T891-Y1309 WeakPolarHBondContact CG2-O 3.32Å; I1307-Y1309 HydrophobicContact CG2-CD1 4.43Å; I1307-Y1309 PolarHBondContact O-N 3.44Å; Y1309-Q1311 VanDerWaalsContact C-N 3.34Å; Y1309-H1313 AromaticContact CD1-CE1 3.97Å; Y1309-H1313 AromaticContact CD1-NE2 3.8Å; Y1309-H1313 PolarHBondContact O-CE1 2.99Å
1310	N	78.9	Confident	70.2	Confident	108 Å²	108	60 Å²	60	58%	0.578	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-20	171.6	-54.5	-68.8	0	0	0	112.6	T891 D1308	T891-N1310 WeakPolarHBondContact CG2-O 3.29Å; D1308-N1310 PolarHBondContact O-N 2.94Å; D1308-N1310 VanDerWaalsContact O-N 3.11Å; D1308-N1310 WeakPolarHBondContact OD1-CB 3.5Å; D1308-N1310 PolarHBondContact OD1-N 2.9Å; D1308-N1310 VanDerWaalsContact OD1-N 3.08Å; D1308-N1310 PolarHBondContact OD1-ND2 3.45Å
1311	Q	82.3	Confident	72.7	Confident	21 Å²	21	56.6 Å²	56.6	10%	0.098	30%	0.301	C	S	.	.	S	Bend	trans	-85.6	150.3	178.5	-62	-67.1	-18.3	0	0	110.9	Y1034 N1242 F1245 D1308 Y1309 H1313	Y1034-Q1311 HydrophobicContact CD1-CB 3.99Å; Y1034-Q1311 HydrophobicContact CE1-CB 3.77Å; Y1034-Q1311 HydrophobicContact CE1-CG 4.36Å; N1242-Q1311 VanDerWaalsContact CA-OE1 3.27Å; N1242-Q1311 PolarHBondContact OD1-OE1 3.03Å; N1242-Q1311 VanDerWaalsContact OD1-OE1 3.14Å; F1245-Q1311 HydrophobicContact CD1-CB 4.16Å; F1245-Q1311 VanDerWaalsContact CD1-CD 3.45Å; F1245-Q1311 HydrophobicContact CD1-CG 3.61Å; F1245-Q1311 HydrophobicContact CD2-CG 4.41Å; F1245-Q1311 HydrophobicContact CE1-CB 4.19Å; F1245-Q1311 HydrophobicContact CE1-CG 3.79Å; F1245-Q1311 VanDerWaalsContact CG-CD 3.46Å; F1245-Q1311 HydrophobicContact CG-CG 3.95Å; F1245-Q1311 HydrophobicContact CZ-CG 4.26Å; D1308-Q1311 HydrophobicContact CB-CG 3.89Å; D1308-Q1311 WeakPolarHBondContact O-CB 3.44Å; D1308-Q1311 PolarHBondContact O-N 3.49Å; Y1309-Q1311 VanDerWaalsContact C-N 3.34Å; Q1311-H1313 PolarHBondContact O-N 2.87Å; Q1311-H1313 VanDerWaalsContact O-N 3.14Å; Q1311-H1313 PolarHBondContact O-ND1 3.09Å
1312	A	86.3	Confident	75.2	Confident	3 Å²	3	48.9 Å²	48.9	3%	0.025	28%	0.278	C	S	.	.			trans	-62.2	117.2	178.5	0	0	0	0	0	110.9	Y1035 W1236 L1238 N1242	Y1035-A1312 PolarHBondContact N-O 3.42Å; W1236-A1312 HydrophobicContact CZ2-CB 4.14Å; L1238-A1312 HydrophobicContact CD2-CB 3.41Å; L1238-A1312 VanDerWaalsContact CD2-CB 3.41Å; N1242-A1312 PolarHBondContact ND2-N 2.99Å
1313	H	88.7	Confident	77.3	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.019	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	161.2	-171.4	65.1	-86.5	0	0	0	111.9	D1033 Y1034 S1063 W1236 I1307 Y1309 Q1311	D1033-H1313 WeakPolarHBondContact O-CA 3.29Å; Y1034-H1313 HydrophobicContact CD1-CB 4.46Å; S1063-H1313 VanDerWaalsContact CB-CE1 3.43Å; S1063-H1313 WeakPolarHBondContact CB-CE1 3.5Å; S1063-H1313 WeakPolarHBondContact CB-O 3.29Å; S1063-H1313 PolarHBondContact N-O 3.33Å; S1063-H1313 PolarHBondContact OG-N 3.31Å; S1063-H1313 VanDerWaalsContact OG-N 3.1Å; S1063-H1313 PolarHBondContact OG-O 2.94Å; W1236-H1313 WeakPolarHBondContact CH2-O 3.18Å; I1307-H1313 HydrophobicContact CG2-CB 4.05Å; Y1309-H1313 AromaticContact CD1-CE1 3.97Å; Y1309-H1313 AromaticContact CD1-NE2 3.8Å; Y1309-H1313 PolarHBondContact O-CE1 2.99Å; Q1311-H1313 PolarHBondContact O-N 2.87Å; Q1311-H1313 VanDerWaalsContact O-N 3.14Å; Q1311-H1313 PolarHBondContact O-ND1 3.09Å
1314	W	91.3	Very high	79.2	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.008	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	153.8	171.9	59.3	-91.9	0	0	0	110.5	L1031 E1032 D1033 Y1034 L1043 F1044 L1060 R1061 L1062 M1316	L1031-W1314 HydrophobicContact CB-CZ3 4.4Å; E1032-W1314 WeakPolarHBondContact CA-O 3.06Å; D1033-W1314 HydrophobicContact CB-CD2 4.29Å; D1033-W1314 VanDerWaalsContact CB-CE2 3.4Å; D1033-W1314 HydrophobicContact CB-CH2 3.92Å; D1033-W1314 HydrophobicContact CB-CZ2 3.21Å; D1033-W1314 PolarHBondContact N-O 3.31Å; D1033-W1314 PolarHBondContact O-N 3.28Å; Y1034-W1314 PolarHBondContact O-NE1 3.33Å; Y1034-W1314 VanDerWaalsContact O-NE1 3.14Å; L1043-W1314 HydrophobicContact CD1-CG 4.2Å; L1043-W1314 HydrophobicContact CD2-CB 3.96Å; L1043-W1314 HydrophobicContact CD2-CD2 4.4Å; L1043-W1314 HydrophobicContact CD2-CG 3.86Å; L1043-W1314 HydrophobicContact CG-CG 4.12Å; F1044-W1314 HydrophobicContact CB-CH2 4.39Å; F1044-W1314 HydrophobicContact CB-CZ2 3.97Å; F1044-W1314 AromaticContact CD1-CD2 3.78Å; F1044-W1314 HydrophobicContact CD1-CD2 3.78Å; F1044-W1314 AromaticContact CD1-CE2 3.55Å; F1044-W1314 AromaticContact CD1-CE3 3.84Å; F1044-W1314 HydrophobicContact CD1-CE3 3.84Å; F1044-W1314 AromaticContact CD1-CH2 3.47Å; F1044-W1314 HydrophobicContact CD1-CH2 3.47Å; F1044-W1314 VanDerWaalsContact CD1-CH2 3.47Å; F1044-W1314 AromaticContact CD1-CZ2 3.37Å; F1044-W1314 HydrophobicContact CD1-CZ2 3.37Å; F1044-W1314 AromaticContact CD1-CZ3 3.71Å; F1044-W1314 HydrophobicContact CD1-CZ3 3.71Å; F1044-W1314 AromaticContact CE1-CD2 3.88Å; F1044-W1314 HydrophobicContact CE1-CD2 3.88Å; F1044-W1314 AromaticContact CE1-CE3 3.56Å; F1044-W1314 HydrophobicContact CE1-CE3 3.56Å; F1044-W1314 AromaticContact CE1-CH2 3.83Å; F1044-W1314 HydrophobicContact CE1-CH2 3.83Å; F1044-W1314 HydrophobicContact CE1-CZ2 4.1Å; F1044-W1314 AromaticContact CE1-CZ3 3.56Å; F1044-W1314 HydrophobicContact CE1-CZ3 3.56Å; F1044-W1314 AromaticContact CG-CH2 3.98Å; F1044-W1314 HydrophobicContact CG-CH2 3.98Å; F1044-W1314 AromaticContact CG-CZ2 3.93Å; F1044-W1314 HydrophobicContact CG-CZ2 3.93Å; F1044-W1314 HydrophobicContact CZ-CZ3 4.28Å; L1060-W1314 HydrophobicContact CD1-CB 4.39Å; L1060-W1314 HydrophobicContact CD1-CE3 4.24Å; R1061-W1314 WeakPolarHBondContact O-CA 3.5Å; L1062-W1314 HydrophobicContact CD2-CB 3.69Å; W1314-M1316 HydrophobicContact CE3-CB 4.29Å; W1314-M1316 HydrophobicContact CZ3-CB 4.01Å
1315	K	91	Very high	80.7	Confident	27 Å²	27	45.8 Å²	45.8	12%	0.117	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	125	177.7	-171	154.4	-178.6	156.9	0	110.4	W907 E1030 L1031 E1032 R1061	W907-K1315 HydrophobicContact CH2-CB 4.3Å; W907-K1315 HydrophobicContact CH2-CG 3.96Å; W907-K1315 HydrophobicContact CZ2-CB 4.33Å; W907-K1315 HydrophobicContact CZ2-CD 4.24Å; W907-K1315 HydrophobicContact CZ2-CG 3.95Å; E1030-K1315 VanDerWaalsContact CD-CE 3.49Å; E1030-K1315 WeakPolarHBondContact OE2-CE 3.4Å; E1030-K1315 IonicContact OE2-NZ 2.69Å; E1030-K1315 PolarHBondContact OE2-NZ 2.8Å; L1031-K1315 CarbonylContact O-C 3.58Å; L1031-K1315 WeakPolarHBondContact O-CA 3.35Å; E1032-K1315 HydrophobicContact CB-CB 4.39Å; E1032-K1315 HydrophobicContact CB-CD 4.25Å; E1032-K1315 HydrophobicContact CB-CG 4.17Å; E1032-K1315 WeakPolarHBondContact OE2-CD 3.4Å; E1032-K1315 VanDerWaalsContact OE2-CE 3.29Å; E1032-K1315 WeakPolarHBondContact OE2-CE 3.31Å; E1032-K1315 IonicContact OE2-NZ 3.66Å; E1032-K1315 PolarHBondContact OE2-NZ 2.76Å; R1061-K1315 PolarHBondContact N-O 3.36Å; R1061-K1315 PolarHBondContact O-N 2.66Å
1316	M	91.9	Very high	82.2	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	130.8	177.6	-178.3	172.6	56.8	0	0	110	L1031 F1044 I1058 H1059 L1060 L1071 I1227 W1314 I1318	L1031-M1316 HydrophobicContact CD1-CE 3.89Å; L1031-M1316 PolarHBondContact N-O 2.9Å; L1031-M1316 PolarHBondContact O-N 3.5Å; F1044-M1316 HydrophobicContact CE2-CE 3.82Å; F1044-M1316 HydrophobicContact CE2-SD 3.89Å; F1044-M1316 HydrophobicContact CZ-CE 3.81Å; F1044-M1316 HydrophobicContact CZ-SD 3.54Å; F1044-M1316 VanDerWaalsContact CZ-SD 3.54Å; I1058-M1316 HydrophobicContact CG2-CG 3.74Å; I1058-M1316 HydrophobicContact CG2-SD 3.57Å; I1058-M1316 VanDerWaalsContact CG2-SD 3.57Å; H1059-M1316 CarbonylContact O-C 3.53Å; H1059-M1316 WeakPolarHBondContact O-CA 3.44Å; L1060-M1316 HydrophobicContact CD1-CB 4.22Å; L1071-M1316 HydrophobicContact CD1-SD 4.49Å; I1227-M1316 HydrophobicContact CD1-CE 3.79Å; I1227-M1316 HydrophobicContact CD1-SD 4.08Å; I1227-M1316 HydrophobicContact CG2-SD 4.17Å; W1314-M1316 HydrophobicContact CE3-CB 4.29Å; W1314-M1316 HydrophobicContact CZ3-CB 4.01Å; M1316-I1318 HydrophobicContact CE-CD1 3.88Å; M1316-I1318 HydrophobicContact CG-CD1 4.45Å; M1316-I1318 HydrophobicContact CG-CG1 4.31Å; M1316-I1318 HydrophobicContact SD-CD1 4.14Å; M1316-I1318 HydrophobicContact SD-CG1 4.43Å
1317	R	90.5	Very high	83.1	Confident	9 Å²	9	39.4 Å²	39.4	3%	0.034	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	130.2	172	-174.7	-177.6	-71.4	162	6.5	109.8	P885 W907 T1028 I1029 E1030 I1058 H1059 I1319	P885-R1317 VanDerWaalsContact CG-NH2 3.3Å; W907-R1317 HydrophobicContact CE3-CB 3.86Å; W907-R1317 HydrophobicContact CH2-CB 4.09Å; W907-R1317 HydrophobicContact CZ3-CB 3.36Å; T1028-R1317 VanDerWaalsContact CG2-CD 3.49Å; T1028-R1317 HydrophobicContact CG2-CG 3.42Å; T1028-R1317 VanDerWaalsContact CG2-CG 3.42Å; I1029-R1317 CarbonylContact O-C 3.58Å; I1029-R1317 WeakPolarHBondContact O-CA 3.48Å; E1030-R1317 HydrophobicContact CG-CG 4.34Å; E1030-R1317 IonicContact OE1-CZ 2.87Å; E1030-R1317 IonicContact OE1-NE 2.68Å; E1030-R1317 PolarHBondContact OE1-NE 3Å; E1030-R1317 IonicContact OE1-NH2 3.18Å; E1030-R1317 PolarHBondContact OE1-NH2 2.88Å; I1058-R1317 WeakPolarHBondContact CA-O 3.19Å; H1059-R1317 PolarHBondContact N-O 2.94Å; H1059-R1317 PolarHBondContact O-N 3.08Å; R1317-I1319 HydrophobicContact CG-CG1 4.16Å
1318	I	91.1	Very high	83.6	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	120.6	174.5	-67.2	158.6	0	0	0	108.3	I1029 T1057 I1058 I1227 M1316 I1328	I1029-I1318 HydrophobicContact CB-CB 4.38Å; I1029-I1318 PolarHBondContact N-O 3.4Å; I1029-I1318 PolarHBondContact O-N 2.89Å; T1057-I1318 WeakPolarHBondContact O-CA 3.45Å; I1058-I1318 HydrophobicContact CB-CG1 4.38Å; I1058-I1318 HydrophobicContact CG1-CG1 4.14Å; I1058-I1318 HydrophobicContact CG2-CG1 3.87Å; I1227-I1318 HydrophobicContact CD1-CD1 3.59Å; M1316-I1318 HydrophobicContact CE-CD1 3.88Å; M1316-I1318 HydrophobicContact CG-CD1 4.45Å; M1316-I1318 HydrophobicContact CG-CG1 4.31Å; M1316-I1318 HydrophobicContact SD-CD1 4.14Å; M1316-I1318 HydrophobicContact SD-CG1 4.43Å; I1318-I1328 HydrophobicContact CD1-CD1 3.32Å
1319	I	90	Very high	83.6	Confident	15 Å²	15	41.2 Å²	41.2	8%	0.077	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	128.5	-178.9	-52.3	176.1	0	0	0	108.5	L910 R913 F1026 Y1027 I1056 T1057 R1317	L910-I1319 HydrophobicContact CD1-CD1 4.07Å; L910-I1319 HydrophobicContact CD1-CG2 4.37Å; R913-I1319 PolarHBondContact NH1-O 3.4Å; F1026-I1319 HydrophobicContact CB-CG2 3.37Å; F1026-I1319 HydrophobicContact CD1-CG2 4.38Å; F1026-I1319 HydrophobicContact CD2-CG2 4.36Å; F1026-I1319 HydrophobicContact CG-CG2 3.79Å; Y1027-I1319 WeakPolarHBondContact O-CA 3.45Å; I1056-I1319 WeakPolarHBondContact CA-O 3.33Å; T1057-I1319 PolarHBondContact N-O 3.06Å; T1057-I1319 VanDerWaalsContact N-O 3.08Å; T1057-I1319 PolarHBondContact O-N 2.83Å; R1317-I1319 HydrophobicContact CG-CG1 4.16Å
1320	C	88.4	Confident	83.4	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.007	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	167	-174.8	50.5	0	0	0	0	111.1	Y1027 I1056 I1326	Y1027-C1320 PolarHBondContact N-O 3.3Å; Y1027-C1320 PolarHBondContact O-N 2.91Å; I1056-C1320 HydrophobicContact CG2-CB 4.44Å; C1320-I1326 HydrophobicContact CB-CD1 3.59Å; C1320-I1326 HydrophobicContact CB-CG1 4.37Å
1321	N	80.2	Confident	82.7	Confident	66 Å²	66	35.8 Å²	35.8	35%	0.353	18%	0.183	S	C	.	.	S	Bend	trans	-75.4	-28.4	-172.8	-72.8	5.6	0	0	0	113.2	R913	R913-N1321 PolarHBondContact NH2-OD1 2.87Å
1322	N	77.6	Confident	81.8	Confident	78 Å²	78	39.5 Å²	39.5	42%	0.417	20%	0.203	S	C	.	.			trans	-149.8	156.5	-175.9	-162.6	2.8	0	0	0	111.4	N1324 D1325	N1322-N1324 VanDerWaalsContact C-N 3.34Å; N1322-N1324 PolarHBondContact O-N 3.31Å; N1322-D1325 WeakPolarHBondContact CB-OD2 3.26Å
1323	S	72.1	Confident	80.4	Confident	48 Å²	48	43.4 Å²	43.4	34%	0.336	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-23.2	-176.3	62.4	0	0	0	0	115	Y1027	Y1027-S1323 VanDerWaalsContact CD1-CA 3.43Å
1324	N	71.4	Confident	78.6	Confident	119 Å²	119	47.4 Å²	47.4	64%	0.636	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-17.4	-170.7	-64.3	-0.4	0	0	0	112.6	S1051 N1322 I1326	S1051-N1324 PolarHBondContact OG-O 3.3Å; N1322-N1324 VanDerWaalsContact C-N 3.34Å; N1322-N1324 PolarHBondContact O-N 3.31Å; N1324-I1326 VanDerWaalsContact C-N 3.34Å; N1324-I1326 PolarHBondContact O-N 3.49Å
1325	D	73.1	Confident	77	Confident	25 Å²	25	52.6 Å²	52.6	13%	0.134	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-33.6	-173.9	-64.6	-28.3	0	0	0	111.5	A1050 S1051 N1052 S1054 N1322	A1050-D1325 CarbonylContact C-O 3.49Å; A1050-D1325 WeakPolarHBondContact CA-O 3.27Å; S1051-D1325 WeakPolarHBondContact CB-O 3.41Å; S1051-D1325 PolarHBondContact N-O 2.76Å; S1051-D1325 PolarHBondContact OG-O 3.35Å; N1052-D1325 PolarHBondContact ND2-OD1 2.81Å; S1054-D1325 WeakPolarHBondContact OG-CB 3.34Å; N1322-D1325 WeakPolarHBondContact CB-OD2 3.26Å
1326	I	83.2	Confident	75.4	Confident	7 Å²	7	54.2 Å²	54.2	4%	0.036	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	130.7	-169.8	-52.4	-170.9	0	0	0	111.9	I1029 I1048 I1049 I1056 C1320 N1324 I1328	I1029-I1326 HydrophobicContact CD1-CB 4.48Å; I1029-I1326 HydrophobicContact CD1-CG2 4.49Å; I1048-I1326 HydrophobicContact CG2-CG2 3.83Å; I1049-I1326 WeakPolarHBondContact O-CA 3.49Å; I1056-I1326 HydrophobicContact CG2-CD1 3.2Å; C1320-I1326 HydrophobicContact CB-CD1 3.59Å; C1320-I1326 HydrophobicContact CB-CG1 4.37Å; N1324-I1326 VanDerWaalsContact C-N 3.34Å; N1324-I1326 PolarHBondContact O-N 3.49Å; I1326-I1328 HydrophobicContact CG2-CG1 4.45Å
1327	K	84.1	Confident	73.8	Confident	142 Å²	142	59.7 Å²	59.7	62%	0.617	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	148.3	165.2	-74.8	176.6	-178.4	167.8	0	110.5	I1049	I1049-K1327 HydrophobicContact CB-CB 4.33Å; I1049-K1327 PolarHBondContact N-O 3.37Å; I1049-K1327 PolarHBondContact O-N 3.37Å
1328	I	84.6	Confident	72.6	Confident	41 Å²	41	62.9 Å²	62.9	21%	0.21	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	132	176.6	-50.7	175.5	0	0	0	108.1	I1029 L1031 R1046 R1047 I1318 I1326	I1029-I1328 HydrophobicContact CD1-CD1 4.22Å; I1029-I1328 HydrophobicContact CG2-CD1 3.99Å; L1031-I1328 HydrophobicContact CD1-CB 4.42Å; L1031-I1328 HydrophobicContact CD1-CD1 3.76Å; L1031-I1328 HydrophobicContact CD1-CG2 3.96Å; R1046-I1328 HydrophobicContact CB-CG2 3.9Å; R1047-I1328 CarbonylContact O-C 3.6Å; R1047-I1328 WeakPolarHBondContact O-CA 3.4Å; I1318-I1328 HydrophobicContact CD1-CD1 3.32Å; I1326-I1328 HydrophobicContact CG2-CG1 4.45Å
1329	M	78.4	Confident	71.6	Confident	74 Å²	74	69 Å²	69	37%	0.365	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	133	177.6	-67.2	-175.1	65	0	0	111	R1047 I1049 M1331	R1047-M1329 HydrophobicContact CB-CB 4.46Å; R1047-M1329 PolarHBondContact N-O 3.48Å; R1047-M1329 PolarHBondContact O-N 3.15Å; I1049-M1329 HydrophobicContact CD1-CG 4.26Å; I1049-M1329 HydrophobicContact CD1-SD 3.65Å; M1329-M1331 HydrophobicContact CE-SD 4.5Å
1330	N	77.4	Confident	70.7	Confident	30 Å²	30	70.7 Å²	70.7	16%	0.16	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	120	162.4	-171.6	8.1	0	0	0	109	D1332 N1333	N1330-D1332 PolarHBondContact OD1-N 3.06Å; N1330-D1332 PolarHBondContact OD1-OD2 2.96Å; N1330-N1333 PolarHBondContact ND2-OD1 3.36Å
1331	M	63.8	Low	69.9	Low	39 Å²	39	74.7 Å²	74.7	19%	0.192	39%	0.388	C	S	.	.	S	Bend	trans	-90.7	-15.7	-176	-66.7	-72.6	-81.9	0	0	112.7	R1047 W1226 M1329 N1333 K1334 M1335	R1047-M1331 HydrophobicContact CB-CG 4.34Å; W1226-M1331 HydrophobicContact CH2-CB 4.42Å; W1226-M1331 HydrophobicContact CH2-CE 4.15Å; W1226-M1331 HydrophobicContact CH2-CG 3.85Å; W1226-M1331 HydrophobicContact CZ3-CB 4.28Å; W1226-M1331 HydrophobicContact CZ3-CG 3.73Å; M1329-M1331 HydrophobicContact CE-SD 4.5Å; M1331-N1333 PolarHBondContact O-N 3.27Å; M1331-K1334 HydrophobicContact CE-CD 3.87Å; M1331-K1334 WeakPolarHBondContact O-CA 3.45Å; M1331-K1334 WeakPolarHBondContact O-CB 3.5Å; M1331-K1334 PolarHBondContact O-N 3.04Å; M1331-K1334 HydrophobicContact SD-CB 4.27Å; M1331-K1334 HydrophobicContact SD-CD 3.76Å; M1331-M1335 PolarHBondContact O-N 3.37Å
1332	D	63.2	Low	69.7	Low	98 Å²	98	78.2 Å²	78.2	52%	0.524	40%	0.4	S	S	.	.	H	α-helix	trans	-62.2	-37.2	169.7	-58.3	-40.6	0	0	0	110.9	N1330 K1334 M1335 S1336	N1330-D1332 PolarHBondContact OD1-N 3.06Å; N1330-D1332 PolarHBondContact OD1-OD2 2.96Å; D1332-K1334 VanDerWaalsContact C-N 3.25Å; D1332-K1334 PolarHBondContact O-N 3.19Å; D1332-M1335 PolarHBondContact O-N 3.24Å; D1332-S1336 WeakPolarHBondContact O-CB 3.47Å; D1332-S1336 PolarHBondContact O-N 2.94Å; D1332-S1336 PolarHBondContact O-OG 3.3Å
1333	N	55.6	Low	69.3	Low	85 Å²	85	79.8 Å²	79.8	46%	0.455	40%	0.4	S	S	.	.	H	α-helix	trans	-61.6	-32.9	169.9	-70.2	6.5	0	0	0	112	N1330 M1331 S1336 E1337	N1330-N1333 PolarHBondContact ND2-OD1 3.36Å; M1331-N1333 PolarHBondContact O-N 3.27Å; N1333-S1336 PolarHBondContact O-N 3.05Å; N1333-E1337 VanDerWaalsContact O-CB 3.26Å; N1333-E1337 WeakPolarHBondContact O-CB 3.41Å; N1333-E1337 PolarHBondContact O-N 2.98Å
1334	K	52.6	Low	69.4	Low	89 Å²	89	79.4 Å²	79.4	39%	0.387	40%	0.4	S	S	.	.	H	α-helix	trans	-76.9	-36.4	-180	-157.6	-177.2	-176.9	-169.2	0	111.9	M1331 D1332 S1336 E1337 I1338	M1331-K1334 HydrophobicContact CE-CD 3.87Å; M1331-K1334 WeakPolarHBondContact O-CA 3.45Å; M1331-K1334 WeakPolarHBondContact O-CB 3.5Å; M1331-K1334 PolarHBondContact O-N 3.04Å; M1331-K1334 HydrophobicContact SD-CB 4.27Å; M1331-K1334 HydrophobicContact SD-CD 3.76Å; D1332-K1334 VanDerWaalsContact C-N 3.25Å; D1332-K1334 PolarHBondContact O-N 3.19Å; K1334-S1336 VanDerWaalsContact C-N 3.3Å; K1334-E1337 PolarHBondContact O-N 3.34Å; K1334-I1338 WeakPolarHBondContact O-CB 3.49Å; K1334-I1338 WeakPolarHBondContact O-CD1 3.35Å; K1334-I1338 VanDerWaalsContact O-CG1 3.24Å; K1334-I1338 WeakPolarHBondContact O-CG1 3.24Å; K1334-I1338 PolarHBondContact O-N 2.95Å
1335	M	57.3	Low	69.6	Low	111 Å²	111	80.1 Å²	80.1	55%	0.547	39%	0.394	S	S	.	.	H	α-helix	trans	-66.9	-34.5	169	-177.4	55.1	129.2	0	0	111.4	M1331 D1332 I1338 K1339	M1331-M1335 PolarHBondContact O-N 3.37Å; D1332-M1335 PolarHBondContact O-N 3.24Å; M1335-I1338 PolarHBondContact O-N 3.11Å; M1335-K1339 WeakPolarHBondContact O-CB 3.31Å; M1335-K1339 WeakPolarHBondContact O-CG 3.2Å; M1335-K1339 PolarHBondContact O-N 3.42Å
1336	S	56.2	Low	69.9	Low	60 Å²	60	81.3 Å²	81.3	42%	0.42	40%	0.398	S	S	.	.	H	α-helix	trans	-69.4	-40.7	173.6	-55	0	0	0	0	111.9	D1332 N1333 K1334 K1339 A1340	D1332-S1336 WeakPolarHBondContact O-CB 3.47Å; D1332-S1336 PolarHBondContact O-N 2.94Å; D1332-S1336 PolarHBondContact O-OG 3.3Å; N1333-S1336 PolarHBondContact O-N 3.05Å; K1334-S1336 VanDerWaalsContact C-N 3.3Å; S1336-K1339 PolarHBondContact O-N 3.46Å; S1336-A1340 WeakPolarHBondContact O-CB 3.48Å; S1336-A1340 PolarHBondContact O-N 2.94Å
1337	E	58.1	Low	69.3	Low	117 Å²	117	85.6 Å²	85.6	55%	0.547	42%	0.418	S	S	.	.	H	α-helix	trans	-60.8	-44.5	171.2	-179.1	178	-143.5	0	0	111.1	N1333 K1334 A1340 L1341	N1333-E1337 VanDerWaalsContact O-CB 3.26Å; N1333-E1337 WeakPolarHBondContact O-CB 3.41Å; N1333-E1337 PolarHBondContact O-N 2.98Å; K1334-E1337 PolarHBondContact O-N 3.34Å; E1337-A1340 CarbonylContact O-C 3.32Å; E1337-A1340 PolarHBondContact O-N 3.19Å; E1337-L1341 WeakPolarHBondContact O-CB 3.25Å; E1337-L1341 PolarHBondContact O-N 3.2Å
1338	I	66.6	Low	68.9	Low	75 Å²	75	86.4 Å²	86.4	39%	0.385	43%	0.426	S	S	.	.	H	α-helix	trans	-64.1	-40.8	174.8	-70.7	163	0	0	0	111.5	K1334 M1335 L1341 K1342	K1334-I1338 WeakPolarHBondContact O-CB 3.49Å; K1334-I1338 WeakPolarHBondContact O-CD1 3.35Å; K1334-I1338 VanDerWaalsContact O-CG1 3.24Å; K1334-I1338 WeakPolarHBondContact O-CG1 3.24Å; K1334-I1338 PolarHBondContact O-N 2.95Å; M1335-I1338 PolarHBondContact O-N 3.11Å; I1338-L1341 PolarHBondContact O-N 3.02Å; I1338-K1342 HydrophobicContact CG2-CD 4.25Å; I1338-K1342 WeakPolarHBondContact O-CB 3.33Å; I1338-K1342 WeakPolarHBondContact O-CG 3.45Å; I1338-K1342 PolarHBondContact O-N 3.04Å
1339	K	70.4	Confident	68.7	Low	130 Å²	130	88.1 Å²	88.1	57%	0.565	43%	0.433	S	S	*	.	H	α-helix	trans	-63.2	-42.5	173.2	-77.3	177.4	178.8	-178.8	0	111.4	M1335 S1336 R1343	M1335-K1339 WeakPolarHBondContact O-CB 3.31Å; M1335-K1339 WeakPolarHBondContact O-CG 3.2Å; M1335-K1339 PolarHBondContact O-N 3.42Å; S1336-K1339 PolarHBondContact O-N 3.46Å; K1339-R1343 VanDerWaalsContact O-CB 3.31Å; K1339-R1343 WeakPolarHBondContact O-CB 3.49Å; K1339-R1343 PolarHBondContact O-N 3.42Å
1340	A	70	Confident	68.6	Low	49 Å²	49	89.2 Å²	89.2	41%	0.405	45%	0.446	S	S	.	.	H	α-helix	trans	-66.1	-38.8	175.4	0	0	0	0	0	112.2	S1336 E1337 R1343 A1344	S1336-A1340 WeakPolarHBondContact O-CB 3.48Å; S1336-A1340 PolarHBondContact O-N 2.94Å; E1337-A1340 CarbonylContact O-C 3.32Å; E1337-A1340 PolarHBondContact O-N 3.19Å; A1340-R1343 PolarHBondContact O-N 3.35Å; A1340-A1344 VanDerWaalsContact O-CB 3.27Å; A1340-A1344 WeakPolarHBondContact O-CB 3.47Å; A1340-A1344 PolarHBondContact O-N 3Å
1341	L	72.9	Confident	68.8	Low	86 Å²	86	88.7 Å²	88.7	45%	0.45	45%	0.447	S	S	.	.	H	α-helix	trans	-65.6	-45.9	175.9	-129.9	98.7	0	0	0	111.3	E1337 I1338 R1343 A1344 W1345	E1337-L1341 WeakPolarHBondContact O-CB 3.25Å; E1337-L1341 PolarHBondContact O-N 3.2Å; I1338-L1341 PolarHBondContact O-N 3.02Å; L1341-R1343 VanDerWaalsContact C-N 3.32Å; L1341-R1343 PolarHBondContact O-N 3.41Å; L1341-A1344 PolarHBondContact O-N 3.41Å; L1341-W1345 HydrophobicContact CD2-CH2 4.38Å; L1341-W1345 HydrophobicContact CD2-CZ2 3.68Å; L1341-W1345 WeakPolarHBondContact O-CB 3.29Å; L1341-W1345 VanDerWaalsContact O-CG 3.25Å; L1341-W1345 PolarHBondContact O-N 3.01Å
1342	K	74.5	Confident	69.7	Low	140 Å²	140	91.8 Å²	91.8	61%	0.609	46%	0.457	S	S	*	.	H	α-helix	trans	-61.3	-40.4	175	-74.6	179.1	177.5	-174.2	0	111.5	I1338 W1345 E1346	I1338-K1342 HydrophobicContact CG2-CD 4.25Å; I1338-K1342 WeakPolarHBondContact O-CB 3.33Å; I1338-K1342 WeakPolarHBondContact O-CG 3.45Å; I1338-K1342 PolarHBondContact O-N 3.04Å; K1342-W1345 PolarHBondContact O-N 3.42Å; K1342-E1346 PolarHBondContact O-N 3.27Å
1343	R	71	Confident	70.3	Confident	110 Å²	110	89.7 Å²	89.7	42%	0.415	45%	0.453	S	S	.	.	H	α-helix	trans	-67.5	-43.2	175.6	-168.6	179.6	-66.4	155.5	-1.3	112	C1257 K1339 A1340 L1341 W1345 E1346 E1347	C1257-R1343 PolarHBondContact O-NH1 3.39Å; K1339-R1343 VanDerWaalsContact O-CB 3.31Å; K1339-R1343 WeakPolarHBondContact O-CB 3.49Å; K1339-R1343 PolarHBondContact O-N 3.42Å; A1340-R1343 PolarHBondContact O-N 3.35Å; L1341-R1343 VanDerWaalsContact C-N 3.32Å; L1341-R1343 PolarHBondContact O-N 3.41Å; R1343-W1345 VanDerWaalsContact C-N 3.32Å; R1343-W1345 PolarHBondContact O-N 2.99Å; R1343-E1346 CarbonylContact O-C 3.57Å; R1343-E1346 WeakPolarHBondContact O-CA 3.23Å; R1343-E1346 WeakPolarHBondContact O-CB 3.36Å; R1343-E1346 PolarHBondContact O-N 3.05Å; R1343-E1346 VanDerWaalsContact O-N 3.1Å; R1343-E1347 VanDerWaalsContact O-CG 3.31Å; R1343-E1347 WeakPolarHBondContact O-CG 3.42Å; R1343-E1347 PolarHBondContact O-N 2.97Å
1344	A	73.4	Confident	71.4	Confident	41 Å²	41	90.9 Å²	90.9	34%	0.339	46%	0.458	S	S	.	.	H	α-helix	trans	-65.8	-32.6	175.5	0	0	0	0	0	112.8	A1340 L1341 M1348	A1340-A1344 VanDerWaalsContact O-CB 3.27Å; A1340-A1344 WeakPolarHBondContact O-CB 3.47Å; A1340-A1344 PolarHBondContact O-N 3Å; L1341-A1344 PolarHBondContact O-N 3.41Å; A1344-M1348 WeakPolarHBondContact O-CB 3.22Å; A1344-M1348 WeakPolarHBondContact O-CG 3.44Å; A1344-M1348 PolarHBondContact O-N 3.5Å
1345	W	75.7	Confident	72.8	Confident	133 Å²	133	92 Å²	92	50%	0.504	46%	0.46	S	S	.	.	H	α-helix	trans	-67.7	-37.2	170.2	-71.1	-5.4	0	0	0	112.2	L1341 K1342 R1343 E1349	L1341-W1345 HydrophobicContact CD2-CH2 4.38Å; L1341-W1345 HydrophobicContact CD2-CZ2 3.68Å; L1341-W1345 WeakPolarHBondContact O-CB 3.29Å; L1341-W1345 VanDerWaalsContact O-CG 3.25Å; L1341-W1345 PolarHBondContact O-N 3.01Å; K1342-W1345 PolarHBondContact O-N 3.42Å; R1343-W1345 VanDerWaalsContact C-N 3.32Å; R1343-W1345 PolarHBondContact O-N 2.99Å; W1345-E1349 PolarHBondContact O-N 2.97Å
1346	E	79.1	Confident	73.9	Confident	50 Å²	50	89.2 Å²	89.2	23%	0.234	46%	0.455	C	S	.	.	H	α-helix	trans	-68.3	-41	173.4	-169.7	62	-167.6	0	0	111.9	K1342 R1343 M1348 E1349 P1350 G1351 R1352 A1353	K1342-E1346 PolarHBondContact O-N 3.27Å; R1343-E1346 CarbonylContact O-C 3.57Å; R1343-E1346 WeakPolarHBondContact O-CA 3.23Å; R1343-E1346 WeakPolarHBondContact O-CB 3.36Å; R1343-E1346 PolarHBondContact O-N 3.05Å; R1343-E1346 VanDerWaalsContact O-N 3.1Å; E1346-M1348 VanDerWaalsContact C-N 3.33Å; E1346-M1348 PolarHBondContact O-N 3.26Å; E1346-E1349 CarbonylContact O-C 3.34Å; E1346-E1349 PolarHBondContact O-N 3.35Å; E1346-P1350 WeakPolarHBondContact O-CA 3.45Å; E1346-P1350 WeakPolarHBondContact O-CD 3.34Å; E1346-G1351 WeakPolarHBondContact OE1-CA 3.49Å; E1346-G1351 PolarHBondContact OE1-N 2.9Å; E1346-R1352 PolarHBondContact OE1-N 2.82Å; E1346-R1352 WeakPolarHBondContact OE2-CA 3.4Å; E1346-R1352 WeakPolarHBondContact OE2-CB 3.4Å; E1346-R1352 PolarHBondContact OE2-N 2.82Å; E1346-A1353 WeakPolarHBondContact OE2-CB 3.43Å; E1346-A1353 PolarHBondContact OE2-N 2.77Å
1347	E	71.3	Confident	74.9	Confident	97 Å²	97	92.1 Å²	92.1	45%	0.453	46%	0.461	S	S	.	.	H	α-helix	trans	-67.2	-31.5	175.6	-71	163.7	171.5	0	0	112.6	N1261 R1343	N1261-E1347 PolarHBondContact ND2-OE1 2.85Å; R1343-E1347 VanDerWaalsContact O-CG 3.31Å; R1343-E1347 WeakPolarHBondContact O-CG 3.42Å; R1343-E1347 PolarHBondContact O-N 2.97Å
1348	M	75.6	Confident	75.9	Confident	160 Å²	160	91.7 Å²	91.7	79%	0.788	46%	0.462	S	S	*	.	H	α-helix	trans	-71.8	-29.2	171.5	-85.4	-169.2	63.3	0	0	113.7	A1344 E1346	A1344-M1348 WeakPolarHBondContact O-CB 3.22Å; A1344-M1348 WeakPolarHBondContact O-CG 3.44Å; A1344-M1348 PolarHBondContact O-N 3.5Å; E1346-M1348 VanDerWaalsContact C-N 3.33Å; E1346-M1348 PolarHBondContact O-N 3.26Å
1349	E	78.9	Confident	76.6	Confident	77 Å²	77	91.6 Å²	91.6	36%	0.36	47%	0.468	S	S	.	.	S	Bend	trans	-149.5	62.3	-169.6	-157.5	-155.3	134	0	0	112.9	W1345 E1346 R1352 R1355	W1345-E1349 PolarHBondContact O-N 2.97Å; E1346-E1349 CarbonylContact O-C 3.34Å; E1346-E1349 PolarHBondContact O-N 3.35Å; E1349-R1352 HydrophobicContact CB-CB 4.27Å; E1349-R1352 WeakPolarHBondContact O-CB 3.1Å; E1349-R1352 PolarHBondContact O-N 3.29Å; E1349-R1352 VanDerWaalsContact O-N 3.07Å; E1349-R1352 IonicContact OE2-CZ 3.42Å; E1349-R1352 IonicContact OE2-NE 2.84Å; E1349-R1352 PolarHBondContact OE2-NE 3.08Å; E1349-R1352 IonicContact OE2-NH2 3.37Å; E1349-R1352 PolarHBondContact OE2-NH2 3.13Å; E1349-R1355 PolarHBondContact O-NH2 3.18Å; E1349-R1355 IonicContact OE1-CZ 3.1Å; E1349-R1355 IonicContact OE1-NE 3.18Å; E1349-R1355 IonicContact OE1-NH2 2.68Å; E1349-R1355 PolarHBondContact OE1-NH2 2.95Å
1350	P	77.6	Confident	77.1	Confident	97 Å²	97	93 Å²	93	63%	0.63	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	143.8	-166	14.9	-29.9	0	0	0	115.2	E1346 R1352 R1355	E1346-P1350 WeakPolarHBondContact O-CA 3.45Å; E1346-P1350 WeakPolarHBondContact O-CD 3.34Å; P1350-R1352 VanDerWaalsContact C-N 3.29Å; P1350-R1355 PolarHBondContact O-NH1 2.97Å; P1350-R1355 PolarHBondContact O-NH2 2.96Å
1351	G	81.4	Confident	77.5	Confident	18 Å²	18	92.9 Å²	92.9	19%	0.186	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	8.7	-166	0	0	0	0	0	113.9	E1346 I1354 R1355	E1346-G1351 WeakPolarHBondContact OE1-CA 3.49Å; E1346-G1351 PolarHBondContact OE1-N 2.9Å; G1351-I1354 PolarHBondContact O-N 3.3Å; G1351-R1355 WeakPolarHBondContact O-CB 3.46Å; G1351-R1355 VanDerWaalsContact O-CG 3.31Å; G1351-R1355 WeakPolarHBondContact O-CG 3.4Å; G1351-R1355 PolarHBondContact O-N 3.24Å; G1351-R1355 PolarHBondContact O-NH1 2.91Å; G1351-R1355 VanDerWaalsContact O-NH1 3.14Å
1352	R	82.5	Confident	77.7	Confident	105 Å²	105	97.5 Å²	97.5	40%	0.396	48%	0.481	S	S	.	.	H	α-helix	trans	-65.1	-41.9	179.5	154.7	176.7	-83.9	-103.4	-1.8	111	E1346 E1349 P1350 R1355 A1356	E1346-R1352 PolarHBondContact OE1-N 2.82Å; E1346-R1352 WeakPolarHBondContact OE2-CA 3.4Å; E1346-R1352 WeakPolarHBondContact OE2-CB 3.4Å; E1346-R1352 PolarHBondContact OE2-N 2.82Å; E1349-R1352 HydrophobicContact CB-CB 4.27Å; E1349-R1352 WeakPolarHBondContact O-CB 3.1Å; E1349-R1352 PolarHBondContact O-N 3.29Å; E1349-R1352 VanDerWaalsContact O-N 3.07Å; E1349-R1352 IonicContact OE2-CZ 3.42Å; E1349-R1352 IonicContact OE2-NE 2.84Å; E1349-R1352 PolarHBondContact OE2-NE 3.08Å; E1349-R1352 IonicContact OE2-NH2 3.37Å; E1349-R1352 PolarHBondContact OE2-NH2 3.13Å; P1350-R1352 VanDerWaalsContact C-N 3.29Å; R1352-R1355 PolarHBondContact O-N 3.48Å; R1352-A1356 VanDerWaalsContact O-CB 3.31Å; R1352-A1356 WeakPolarHBondContact O-CB 3.28Å; R1352-A1356 PolarHBondContact O-N 3.48Å
1353	A	75.2	Confident	77.9	Confident	53 Å²	53	96.8 Å²	96.8	44%	0.438	48%	0.475	S	S	.	.	H	α-helix	trans	-61.9	-44.9	173.4	0	0	0	0	0	110.5	E1346 A1356 E1357	E1346-A1353 WeakPolarHBondContact OE2-CB 3.43Å; E1346-A1353 PolarHBondContact OE2-N 2.77Å; A1353-A1356 WeakPolarHBondContact O-CB 3.37Å; A1353-A1356 PolarHBondContact O-N 3.1Å; A1353-E1357 WeakPolarHBondContact O-CB 3.49Å; A1353-E1357 PolarHBondContact O-N 3.13Å
1354	I	79.3	Confident	78.1	Confident	110 Å²	110	93.3 Å²	93.3	56%	0.564	47%	0.465	S	S	*	.	H	α-helix	trans	-65.5	-40.3	177.1	-61.5	172.5	0	0	0	111.3	G1351 E1357 L1358	G1351-I1354 PolarHBondContact O-N 3.3Å; I1354-E1357 PolarHBondContact O-N 3.37Å; I1354-L1358 HydrophobicContact CG2-CD1 3.95Å; I1354-L1358 HydrophobicContact CG2-CG 4.46Å; I1354-L1358 WeakPolarHBondContact O-CB 3.47Å; I1354-L1358 WeakPolarHBondContact O-CG 3.43Å; I1354-L1358 PolarHBondContact O-N 2.73Å
1355	R	81.7	Confident	78.3	Confident	114 Å²	114	98 Å²	98	43%	0.43	48%	0.479	S	S	.	.	H	α-helix	trans	-64.6	-40.2	173.4	-74.1	-173.5	-63.1	-76.4	3.3	111.6	E1349 P1350 G1351 R1352 S1359	E1349-R1355 PolarHBondContact O-NH2 3.18Å; E1349-R1355 IonicContact OE1-CZ 3.1Å; E1349-R1355 IonicContact OE1-NE 3.18Å; E1349-R1355 IonicContact OE1-NH2 2.68Å; E1349-R1355 PolarHBondContact OE1-NH2 2.95Å; P1350-R1355 PolarHBondContact O-NH1 2.97Å; P1350-R1355 PolarHBondContact O-NH2 2.96Å; G1351-R1355 WeakPolarHBondContact O-CB 3.46Å; G1351-R1355 VanDerWaalsContact O-CG 3.31Å; G1351-R1355 WeakPolarHBondContact O-CG 3.4Å; G1351-R1355 PolarHBondContact O-N 3.24Å; G1351-R1355 PolarHBondContact O-NH1 2.91Å; G1351-R1355 VanDerWaalsContact O-NH1 3.14Å; R1352-R1355 PolarHBondContact O-N 3.48Å; R1355-S1359 VanDerWaalsContact O-CB 3.3Å; R1355-S1359 WeakPolarHBondContact O-CB 3.1Å; R1355-S1359 PolarHBondContact O-N 2.64Å; R1355-S1359 PolarHBondContact O-OG 3.11Å
1356	A	80.9	Confident	78.3	Confident	52 Å²	52	98.7 Å²	98.7	43%	0.43	49%	0.488	S	S	.	.	H	α-helix	trans	-64.6	-47.2	174.7	0	0	0	0	0	111.2	R1352 A1353 S1359 R1360	R1352-A1356 VanDerWaalsContact O-CB 3.31Å; R1352-A1356 WeakPolarHBondContact O-CB 3.28Å; R1352-A1356 PolarHBondContact O-N 3.48Å; A1353-A1356 WeakPolarHBondContact O-CB 3.37Å; A1353-A1356 PolarHBondContact O-N 3.1Å; A1356-S1359 WeakPolarHBondContact CA-OG 3.19Å; A1356-S1359 PolarHBondContact O-N 2.74Å; A1356-S1359 PolarHBondContact O-OG 3.35Å; A1356-R1360 VanDerWaalsContact O-CB 3.3Å; A1356-R1360 WeakPolarHBondContact O-CB 3.25Å; A1356-R1360 PolarHBondContact O-N 2.85Å
1357	E	76.1	Confident	78	Confident	120 Å²	120	102.4 Å²	102.4	56%	0.561	50%	0.501	S	S	*	.	H	α-helix	trans	-61.2	-46.1	177.6	-153.8	67	-115.9	0	0	111.3	A1353 I1354 S1359 R1360 A1361	A1353-E1357 WeakPolarHBondContact O-CB 3.49Å; A1353-E1357 PolarHBondContact O-N 3.13Å; I1354-E1357 PolarHBondContact O-N 3.37Å; E1357-S1359 PolarHBondContact O-N 3.4Å; E1357-R1360 PolarHBondContact O-N 2.95Å; E1357-A1361 VanDerWaalsContact O-CB 3.28Å; E1357-A1361 WeakPolarHBondContact O-CB 3.09Å; E1357-A1361 PolarHBondContact O-N 2.73Å
1358	L	80.9	Confident	77.7	Confident	108 Å²	108	101 Å²	101	57%	0.565	51%	0.513	S	S	*	.	H	α-helix	trans	-64.5	-37.4	174.6	-74.9	168.6	0	0	0	112.7	I1354 R1362	I1354-L1358 HydrophobicContact CG2-CD1 3.95Å; I1354-L1358 HydrophobicContact CG2-CG 4.46Å; I1354-L1358 WeakPolarHBondContact O-CB 3.47Å; I1354-L1358 WeakPolarHBondContact O-CG 3.43Å; I1354-L1358 PolarHBondContact O-N 2.73Å; L1358-R1362 WeakPolarHBondContact O-CB 3.23Å; L1358-R1362 WeakPolarHBondContact O-CG 3.34Å; L1358-R1362 PolarHBondContact O-N 3.26Å
1359	S	79.4	Confident	76.7	Confident	73 Å²	73	96.9 Å²	96.9	51%	0.51	49%	0.493	S	S	.	.	H	α-helix	trans	-69	-36.8	175	72.3	0	0	0	0	112.2	R1355 A1356 E1357 Y1363	R1355-S1359 VanDerWaalsContact O-CB 3.3Å; R1355-S1359 WeakPolarHBondContact O-CB 3.1Å; R1355-S1359 PolarHBondContact O-N 2.64Å; R1355-S1359 PolarHBondContact O-OG 3.11Å; A1356-S1359 WeakPolarHBondContact CA-OG 3.19Å; A1356-S1359 PolarHBondContact O-N 2.74Å; A1356-S1359 PolarHBondContact O-OG 3.35Å; E1357-S1359 PolarHBondContact O-N 3.4Å; S1359-Y1363 VanDerWaalsContact O-CB 3.27Å; S1359-Y1363 WeakPolarHBondContact O-CB 3.14Å; S1359-Y1363 PolarHBondContact O-N 3.45Å
1360	R	81.6	Confident	75.3	Confident	159 Å²	159	99.9 Å²	99.9	60%	0.6	51%	0.509	S	S	*	.	H	α-helix	trans	-69.7	-43	175	173.9	-177.8	166.1	121	0.4	111.1	A1356 E1357 Y1363 L1364	A1356-R1360 VanDerWaalsContact O-CB 3.3Å; A1356-R1360 WeakPolarHBondContact O-CB 3.25Å; A1356-R1360 PolarHBondContact O-N 2.85Å; E1357-R1360 PolarHBondContact O-N 2.95Å; R1360-Y1363 PolarHBondContact O-N 2.9Å; R1360-L1364 HydrophobicContact CG-CD1 3.86Å; R1360-L1364 HydrophobicContact CG-CG 4.37Å; R1360-L1364 WeakPolarHBondContact O-CB 3.46Å; R1360-L1364 VanDerWaalsContact O-CG 3.24Å; R1360-L1364 WeakPolarHBondContact O-CG 3.2Å; R1360-L1364 PolarHBondContact O-N 3.45Å
1361	A	77.8	Confident	73.7	Confident	47 Å²	47	102 Å²	102	39%	0.388	52%	0.515	S	S	.	.	H	α-helix	trans	-60.4	-50.9	175.9	0	0	0	0	0	110.4	E1357 Y1363 L1364 E1365	E1357-A1361 VanDerWaalsContact O-CB 3.28Å; E1357-A1361 WeakPolarHBondContact O-CB 3.09Å; E1357-A1361 PolarHBondContact O-N 2.73Å; A1361-Y1363 VanDerWaalsContact C-N 3.33Å; A1361-Y1363 PolarHBondContact O-N 3.11Å; A1361-L1364 PolarHBondContact O-N 3.4Å; A1361-E1365 VanDerWaalsContact O-CB 3.3Å; A1361-E1365 WeakPolarHBondContact O-CB 3.49Å; A1361-E1365 PolarHBondContact O-N 2.97Å
1362	R	77.1	Confident	71.5	Confident	184 Å²	184	109.8 Å²	109.8	69%	0.694	55%	0.547	S	S	*	.	H	α-helix	trans	-57.7	-42.1	172.7	-78.3	-174	-179.2	175.7	1.3	112.9	L1358 E1365 E1366	L1358-R1362 WeakPolarHBondContact O-CB 3.23Å; L1358-R1362 WeakPolarHBondContact O-CG 3.34Å; L1358-R1362 PolarHBondContact O-N 3.26Å; R1362-E1365 PolarHBondContact O-N 3.04Å; R1362-E1366 WeakPolarHBondContact O-CB 3.46Å; R1362-E1366 PolarHBondContact O-N 3.41Å
1363	Y	78.7	Confident	69.3	Low	125 Å²	125	110.6 Å²	110.6	49%	0.49	57%	0.566	S	S	.	*	H	α-helix	trans	-66.3	-39.2	178.2	-172.3	-86.5	0	0	0	112.1	S1359 R1360 A1361 E1365 Y1367	S1359-Y1363 VanDerWaalsContact O-CB 3.27Å; S1359-Y1363 WeakPolarHBondContact O-CB 3.14Å; S1359-Y1363 PolarHBondContact O-N 3.45Å; R1360-Y1363 PolarHBondContact O-N 2.9Å; A1361-Y1363 VanDerWaalsContact C-N 3.33Å; A1361-Y1363 PolarHBondContact O-N 3.11Å; Y1363-E1365 VanDerWaalsContact C-N 3.35Å; Y1363-Y1367 HydrophobicContact CD1-CD2 4.19Å; Y1363-Y1367 AromaticContact CD2-CD2 3.92Å; Y1363-Y1367 HydrophobicContact CD2-CD2 3.92Å; Y1363-Y1367 AromaticContact CD2-CE2 3.79Å; Y1363-Y1367 HydrophobicContact CD2-CE2 3.79Å; Y1363-Y1367 HydrophobicContact CE1-CD2 4.04Å; Y1363-Y1367 HydrophobicContact CE1-CE2 4.5Å; Y1363-Y1367 HydrophobicContact CE1-CG 4.39Å; Y1363-Y1367 AromaticContact CE2-CD2 3.78Å; Y1363-Y1367 HydrophobicContact CE2-CD2 3.78Å; Y1363-Y1367 AromaticContact CE2-CE2 3.45Å; Y1363-Y1367 HydrophobicContact CE2-CE2 3.45Å; Y1363-Y1367 VanDerWaalsContact CE2-CE2 3.45Å; Y1363-Y1367 HydrophobicContact CG-CD2 4.12Å; Y1363-Y1367 HydrophobicContact CG-CE2 4.46Å; Y1363-Y1367 AromaticContact CZ-CD2 3.83Å; Y1363-Y1367 AromaticContact CZ-CE2 3.84Å; Y1363-Y1367 WeakPolarHBondContact O-CB 3.34Å; Y1363-Y1367 WeakPolarHBondContact O-CD2 3.5Å; Y1363-Y1367 PolarHBondContact O-N 3.17Å
1364	L	76.7	Confident	67.2	Low	37 Å²	37	115.9 Å²	115.9	19%	0.194	59%	0.586	C	S	.	*	H	α-helix	trans	-71.2	-30.6	175.9	-67.3	170.9	0	0	0	112.1	R1360 A1361 G1368 L1369 M1370	R1360-L1364 HydrophobicContact CG-CD1 3.86Å; R1360-L1364 HydrophobicContact CG-CG 4.37Å; R1360-L1364 WeakPolarHBondContact O-CB 3.46Å; R1360-L1364 VanDerWaalsContact O-CG 3.24Å; R1360-L1364 WeakPolarHBondContact O-CG 3.2Å; R1360-L1364 PolarHBondContact O-N 3.45Å; A1361-L1364 PolarHBondContact O-N 3.4Å; L1364-G1368 CarbonylContact O-C 3.53Å; L1364-G1368 PolarHBondContact O-N 3.06Å; L1364-L1369 HydrophobicContact CD2-CB 3.65Å; L1364-L1369 PolarHBondContact O-N 3.43Å; L1364-M1370 HydrophobicContact CB-CG 4.24Å; L1364-M1370 PolarHBondContact O-N 3.07Å
1365	E	76	Confident	64.7	Low	139 Å²	139	119.1 Å²	119.1	65%	0.65	60%	0.599	S	S	*	*	H	α-helix	trans	-70.6	-51.6	171.8	-177.4	177.6	-147.6	0	0	111.3	A1361 R1362 Y1363 Y1367 G1368	A1361-E1365 VanDerWaalsContact O-CB 3.3Å; A1361-E1365 WeakPolarHBondContact O-CB 3.49Å; A1361-E1365 PolarHBondContact O-N 2.97Å; R1362-E1365 PolarHBondContact O-N 3.04Å; Y1363-E1365 VanDerWaalsContact C-N 3.35Å; E1365-Y1367 VanDerWaalsContact C-N 3.32Å; E1365-Y1367 PolarHBondContact O-N 3.35Å; E1365-G1368 PolarHBondContact O-N 2.87Å; E1365-G1368 VanDerWaalsContact O-N 3.15Å
1366	E	76.6	Confident	62.1	Low	147 Å²	147	122.7 Å²	122.7	69%	0.687	62%	0.618	S	S	*	*	H	α-helix	trans	-60.7	-35.2	-179.7	-177.8	175.2	-157.9	0	0	113	R1362	R1362-E1366 WeakPolarHBondContact O-CB 3.46Å; R1362-E1366 PolarHBondContact O-N 3.41Å
1367	Y	73.3	Confident	59.4	Low	129 Å²	129	126.3 Å²	126.3	51%	0.506	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.1	7.3	177.5	-71.6	-94.5	0	0	0	114.1	Y1363 E1365 L1369	Y1363-Y1367 HydrophobicContact CD1-CD2 4.19Å; Y1363-Y1367 AromaticContact CD2-CD2 3.92Å; Y1363-Y1367 HydrophobicContact CD2-CD2 3.92Å; Y1363-Y1367 AromaticContact CD2-CE2 3.79Å; Y1363-Y1367 HydrophobicContact CD2-CE2 3.79Å; Y1363-Y1367 HydrophobicContact CE1-CD2 4.04Å; Y1363-Y1367 HydrophobicContact CE1-CE2 4.5Å; Y1363-Y1367 HydrophobicContact CE1-CG 4.39Å; Y1363-Y1367 AromaticContact CE2-CD2 3.78Å; Y1363-Y1367 HydrophobicContact CE2-CD2 3.78Å; Y1363-Y1367 AromaticContact CE2-CE2 3.45Å; Y1363-Y1367 HydrophobicContact CE2-CE2 3.45Å; Y1363-Y1367 VanDerWaalsContact CE2-CE2 3.45Å; Y1363-Y1367 HydrophobicContact CG-CD2 4.12Å; Y1363-Y1367 HydrophobicContact CG-CE2 4.46Å; Y1363-Y1367 AromaticContact CZ-CD2 3.83Å; Y1363-Y1367 AromaticContact CZ-CE2 3.84Å; Y1363-Y1367 WeakPolarHBondContact O-CB 3.34Å; Y1363-Y1367 WeakPolarHBondContact O-CD2 3.5Å; Y1363-Y1367 PolarHBondContact O-N 3.17Å; E1365-Y1367 VanDerWaalsContact C-N 3.32Å; E1365-Y1367 PolarHBondContact O-N 3.35Å; Y1367-L1369 VanDerWaalsContact C-N 3.27Å; Y1367-L1369 PolarHBondContact O-N 3.4Å
1368	G	63.4	Low	57.2	Low	68 Å²	68	130.3 Å²	130.3	70%	0.701	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	64	27.1	176	0	0	0	0	0	114.9	L1364 E1365	L1364-G1368 CarbonylContact O-C 3.53Å; L1364-G1368 PolarHBondContact O-N 3.06Å; E1365-G1368 PolarHBondContact O-N 2.87Å; E1365-G1368 VanDerWaalsContact O-N 3.15Å
1369	L	55.6	Low	54.5	Low	72 Å²	72	131.3 Å²	131.3	38%	0.377	66%	0.656	S	S	.	*			trans	-101.8	18.4	-177.1	-73.9	167.9	0	0	0	113.2	L1364 Y1367 N1371	L1364-L1369 HydrophobicContact CD2-CB 3.65Å; L1364-L1369 PolarHBondContact O-N 3.43Å; Y1367-L1369 VanDerWaalsContact C-N 3.27Å; Y1367-L1369 PolarHBondContact O-N 3.4Å; L1369-N1371 PolarHBondContact O-N 3.27Å; L1369-N1371 VanDerWaalsContact O-N 3.12Å
1370	M	49.7	Very low	52.2	Low	141 Å²	141	135.2 Å²	135.2	70%	0.695	67%	0.671	S	S	*	*			trans	-73.1	92.7	161.6	-78.2	-159.1	67.7	0	0	110.1	L1364	L1364-M1370 HydrophobicContact CB-CG 4.24Å; L1364-M1370 PolarHBondContact O-N 3.07Å
1371	N	43.6	Very low	49.6	Very low	142 Å²	142	134.5 Å²	134.5	76%	0.759	68%	0.679	S	S	*	*			trans	-58.3	142.8	161.2	-65.9	-0.6	0	0	0	109.2	L1369	L1369-N1371 PolarHBondContact O-N 3.27Å; L1369-N1371 VanDerWaalsContact O-N 3.12Å
1372	E	34.7	Very low	47.4	Very low	180 Å²	180	137.7 Å²	137.7	84%	0.841	70%	0.699	S	S	*	*			trans	-57.1	148.8	171.7	-72.6	-172	113.4	0	0	111.2	D1374	E1372-D1374 PolarHBondContact O-N 3.35Å
1373	P	37.3	Very low	45	Very low	123 Å²	123	133 Å²	133	80%	0.799	71%	0.707	S	S	*	*			trans	-71.1	91	177.9	29.8	-34.6	0	0	0	110.6	H1375	P1373-H1375 PolarHBondContact O-N 3.45Å; P1373-H1375 VanDerWaalsContact O-N 3.11Å
1374	D	29.9	Very low	42.6	Very low	163 Å²	163	132.6 Å²	132.6	87%	0.872	72%	0.723	S	S	*	*			trans	-54.3	114.3	179	-127.5	-31.1	0	0	0	111.1	E1372 K1376	E1372-D1374 PolarHBondContact O-N 3.35Å; D1374-K1376 PolarHBondContact O-N 2.86Å
1375	H	27.8	Very low	40.2	Very low	178 Å²	178	139 Å²	139	82%	0.824	75%	0.751	S	S	*	*	S	Bend	trans	-66.8	86.3	-171.1	-102.9	-70.2	0	0	0	112.5	P1373	P1373-H1375 PolarHBondContact O-N 3.45Å; P1373-H1375 VanDerWaalsContact O-N 3.11Å
1376	K	26.2	Very low	37.8	Very low	190 Å²	190	138.4 Å²	138.4	83%	0.826	75%	0.752	S	S	*	*			trans	-165.8	92.4	156.6	-92.1	126.7	-166.3	168	0	112.8	D1374	D1374-K1376 PolarHBondContact O-N 2.86Å
1377	T	25.6	Very low	35.5	Very low	127 Å²	127	138.3 Å²	138.3	78%	0.779	76%	0.761	S	S	*	*	S	Bend		172.5	157.1	102.8	32.9	0	0	0	0	111.7
1378	Y	28.7	Very low	33.1	Very low	205 Å²	205	140.5 Å²	140.5	80%	0.804	78%	0.778	S	S	*	*			trans	50.2	91.1	172.9	-71.4	-75.5	0	0	0	117.9
1379	V	25.9	Very low	31.5	Very low	129 Å²	129	147.5 Å²	147.5	78%	0.782	79%	0.789	S	S	*	*			trans	-62.6	122.3	135.8	176.9	0	0	0	0	107.3	D1381	V1379-D1381 HydrophobicContact CG1-CB 3.81Å
1380	D	29.4	Very low	30.2	Very low	154 Å²	154	148.2 Å²	148.2	82%	0.824	80%	0.801	S	S	*	*			trans	-137	98.7	159.9	-149.6	1.2	0	0	0	105.5
1381	D	26.9	Very low	29.2	Very low	145 Å²	145	148.2 Å²	148.2	78%	0.775	80%	0.803	S	S	*	*			trans	-116.3	100.4	-157.2	-175	14	0	0	0	110.8	V1379	V1379-D1381 HydrophobicContact CG1-CB 3.81Å
1382	S	31.5	Very low	28.7	Very low	114 Å²	114	149.3 Å²	149.3	80%	0.797	81%	0.809	S	S	*	*			trans	-159.8	132.6	165.4	55.5	0	0	0	0	113.2
1383	G	28.5	Very low	28.4	Very low	84 Å²	84	148 Å²	148	87%	0.866	81%	0.808	S	S	*	*			trans	105.7	69.8	152.4	0	0	0	0	0	117.8
1384	S	27.8	Very low	28.5	Very low	117 Å²	117	147 Å²	147	82%	0.818	80%	0.801	S	S	*	*			trans	-109.1	121.6	153.7	63.5	0	0	0	0	111.5
1385	E	26.1	Very low	28.5	Very low	171 Å²	171	147.2 Å²	147.2	80%	0.799	80%	0.801	S	S	*	*			trans	-47.2	158.1	158.2	-70.2	-177.1	120.2	0	0	112.4
1386	I	24.6	Very low	28.6	Very low	127 Å²	127	142.9 Å²	142.9	65%	0.651	79%	0.791	S	S	*	*			cis	-158.1	149.2	-2.9	-112.8	161	0	0	0	106.6
1387	T	28.6	Very low	28.6	Very low	145 Å²	145	139.6 Å²	139.6	89%	0.89	79%	0.786	S	S	*	*			trans	-162.8	130.8	139.8	-0.2	0	0	0	0	112
1388	M	23.2	Very low	28.8	Very low	176 Å²	176	141.2 Å²	141.2	87%	0.867	79%	0.79	S	S	*	*			trans	-87.9	136.3	177.3	-68.5	-114.2	-64.7	0	0	112
1389	K	30.1	Very low	28.9	Very low	214 Å²	214	136.2 Å²	136.2	93%	0.93	78%	0.777	S	S	*	*			trans	-159.9	164	137	-109	160.9	-172.4	179.5	0	110.6
1390	S	28.5	Very low	28.9	Very low	88 Å²	88	136.9 Å²	136.9	62%	0.615	78%	0.784	S	S	*	*			trans	-111.7	166.1	-156.5	60.3	0	0	0	0	113.8
1391	D	28.5	Very low	28.6	Very low	141 Å²	141	133.2 Å²	133.2	75%	0.754	77%	0.77	S	S	*	*			trans	65.3	127	160.2	-38.6	-48.7	0	0	0	115.1
1392	D	32.8	Very low	28.7	Very low	165 Å²	165	135.5 Å²	135.5	88%	0.882	77%	0.773	S	S	*	*			cis	-143.2	175.3	36	-91.6	-48.8	0	0	0	114.5
1393	N	28.5	Very low	28.3	Very low	152 Å²	152	136.9 Å²	136.9	81%	0.813	77%	0.77	S	S	*	*			trans	-125.5	173.6	178.1	-119.2	-32.9	0	0	0	109.5
1394	P	39.1	Very low	28.3	Very low	101 Å²	101	143.9 Å²	143.9	66%	0.656	77%	0.772	S	S	*	*			cis	-129.5	-175.7	-26.3	40.7	-26.3	0	0	0	111.9
1395	I	29.9	Very low	28.1	Very low	169 Å²	169	143.1 Å²	143.1	87%	0.867	77%	0.766	S	S	*	*			trans	-166.1	149.8	134.2	-104.9	159.4	0	0	0	113.2
1396	S	30	Very low	27.9	Very low	87 Å²	87	143.6 Å²	143.6	61%	0.608	77%	0.773	S	S	*	*			trans	-66.7	143.7	-161.1	56.6	0	0	0	0	120.6
1397	T	27.6	Very low	28	Very low	120 Å²	120	143.4 Å²	143.4	74%	0.736	78%	0.778	S	S	*	*			trans	53.6	125.2	131.7	63.4	0	0	0	0	122.6
1398	L	29.6	Very low	27.6	Very low	162 Å²	162	143.6 Å²	143.6	85%	0.848	77%	0.772	S	S	*	*			trans	167.6	154.5	131.4	-108.4	90.1	0	0	0	106.5
1399	D	29	Very low	27.8	Very low	100 Å²	100	141.2 Å²	141.2	54%	0.535	77%	0.77	S	S	.	*			cis	-166.9	126.5	-23	-178.2	-32	0	0	0	105.9	S1401	D1399-S1401 PolarHBondContact O-N 3.14Å; D1399-S1401 WeakPolarHBondContact OD1-CB 3.45Å; D1399-S1401 PolarHBondContact OD1-N 3.44Å; D1399-S1401 PolarHBondContact OD1-OG 3Å; D1399-S1401 PolarHBondContact OD2-OG 3.49Å
1400	P	25.9	Very low	27.4	Very low	143 Å²	143	136.4 Å²	136.4	93%	0.929	76%	0.764	S	S	*	*	S	Bend	trans	-77.7	47.3	-176.6	34.7	-37.6	0	0	0	113.6
1401	S	24.3	Very low	27.3	Very low	77 Å²	77	141.4 Å²	141.4	54%	0.538	78%	0.777	S	S	.	*			trans	-143.7	47.7	-173.1	67.8	0	0	0	0	115.7	D1399	D1399-S1401 PolarHBondContact O-N 3.14Å; D1399-S1401 WeakPolarHBondContact OD1-CB 3.45Å; D1399-S1401 PolarHBondContact OD1-N 3.44Å; D1399-S1401 PolarHBondContact OD1-OG 3Å; D1399-S1401 PolarHBondContact OD2-OG 3.49Å
1402	K	28.3	Very low	27.1	Very low	192 Å²	192	142.1 Å²	142.1	84%	0.835	78%	0.78	S	S	*	*			trans	-139.2	97.3	167.9	-109.3	148.5	-165.8	164.3	0	116.1
1403	I	24.3	Very low	26.7	Very low	144 Å²	144	140.7 Å²	140.7	74%	0.738	77%	0.773	S	S	*	*			trans	-17.4	126.3	149.9	-59	158.7	0	0	0	114.1
1404	Y	27.5	Very low	26.6	Very low	230 Å²	230	143.2 Å²	143.2	90%	0.902	78%	0.779	S	S	*	*			trans	-117.3	128.7	144.2	-88.1	-84.9	0	0	0	108.9
1405	C	22.9	Very low	25.9	Very low	101 Å²	101	144 Å²	144	68%	0.682	78%	0.782	S	S	*	*			trans	-76.1	130.8	-176.8	-57.6	0	0	0	0	111.3
1406	L	23.1	Very low	25.6	Very low	181 Å²	181	143 Å²	143	95%	0.948	78%	0.777	S	S	*	*			trans	-91.9	103.9	154.1	-84.3	169.1	0	0	0	108.4
1407	T	25.5	Very low	25.3	Very low	124 Å²	124	148.2 Å²	148.2	76%	0.761	79%	0.789	S	S	*	*			trans	-68.9	139.3	-173.6	-43.3	0	0	0	0	111.8
1408	L	21.8	Very low	25.3	Very low	148 Å²	148	147.6 Å²	147.6	78%	0.775	79%	0.787	S	S	*	*			trans	-63.3	143.4	170.6	-64.9	103	0	0	0	111	S1410	L1408-S1410 PolarHBondContact O-N 3.5Å
1409	P	25.6	Very low	24.9	Very low	127 Å²	127	147.2 Å²	147.2	83%	0.825	78%	0.784	S	S	*	*			trans	-72.5	89.4	173.8	29.8	-34.2	0	0	0	110.9	Q1411	P1409-Q1411 VanDerWaalsContact C-N 3.27Å; P1409-Q1411 PolarHBondContact O-N 3.2Å
1410	S	23.6	Very low	24.7	Very low	113 Å²	113	152.5 Å²	152.5	79%	0.79	80%	0.802	S	S	*	*			trans	-75.8	69.9	178.1	61.2	0	0	0	0	112.2	L1408	L1408-S1410 PolarHBondContact O-N 3.5Å
1411	Q	26.5	Very low	24.5	Very low	193 Å²	193	153.2 Å²	153.2	90%	0.902	80%	0.798	S	S	*	*			trans	-130.6	67.8	174.8	-70.4	-164.7	-8.5	0	0	112.6	P1409	P1409-Q1411 VanDerWaalsContact C-N 3.27Å; P1409-Q1411 PolarHBondContact O-N 3.2Å
1412	L	22.8	Very low	24.6	Very low	155 Å²	155	157.8 Å²	157.8	81%	0.812	81%	0.812	S	S	*	*			trans	-132.8	140.6	161	-135.2	162.8	0	0	0	107.1
1413	N	25.7	Very low	24.5	Very low	136 Å²	136	151.5 Å²	151.5	73%	0.727	79%	0.793	S	S	*	*			trans	72.3	83.2	-174.3	-58.3	-30.9	0	0	0	117.5
1414	H	26	Very low	24.5	Very low	204 Å²	204	153.1 Å²	153.1	94%	0.944	80%	0.795	S	S	*	*			trans	-105.8	123.9	136.3	-101.6	-49.8	0	0	0	109.1
1415	T	24.7	Very low	24.6	Very low	119 Å²	119	148.2 Å²	148.2	73%	0.73	78%	0.784	S	S	*	*			trans	-98.8	115	-169.7	21.5	0	0	0	0	114
1416	I	22.7	Very low	24.9	Very low	148 Å²	148	150.8 Å²	150.8	76%	0.759	78%	0.784	S	S	*	*			trans	35.5	110.2	144.7	-36.9	175.9	0	0	0	118.9
1417	K	23.4	Very low	25.1	Very low	196 Å²	196	149.2 Å²	149.2	85%	0.852	77%	0.769	S	S	*	*				163	158.9	129.2	-92.1	168.8	-175.4	173.9	0	111.4
1418	P	27	Very low	25.4	Very low	106 Å²	106	150.4 Å²	150.4	69%	0.688	76%	0.761	S	S	*	*				-135.8	160.7	-50.6	36.4	-19.1	0	0	0	113.9
1419	I	22.2	Very low	25.9	Very low	155 Å²	155	149 Å²	149	80%	0.795	75%	0.753	S	S	*	*			trans	30	112	152.7	-52.4	171.5	0	0	0	118.1
1420	K	23.9	Very low	26.2	Very low	211 Å²	211	149.3 Å²	149.3	92%	0.917	74%	0.742	S	S	*	*			trans	-117.1	93.1	148.2	-156.8	168.2	-172.6	176.2	0	111.8	M1422	K1420-M1422 PolarHBondContact O-N 3.31Å
1421	L	23	Very low	26.6	Very low	158 Å²	158	149 Å²	149	83%	0.827	73%	0.726	S	S	*	*			trans	-36.5	109.8	174.2	-176	75.6	0	0	0	114.4
1422	M	25	Very low	26.9	Very low	173 Å²	173	143.1 Å²	143.1	85%	0.852	70%	0.702	S	S	*	*			trans	-133.2	57.5	174.1	-156.4	62.1	159.7	0	0	113.6	K1420	K1420-M1422 PolarHBondContact O-N 3.31Å
1423	S	26.7	Very low	27.6	Very low	60 Å²	60	140.4 Å²	140.4	42%	0.42	68%	0.684	S	S	.	*			trans	73.1	42.6	153.4	79.7	0	0	0	0	120.3	N1425 K1426	S1423-N1425 PolarHBondContact O-N 3.03Å; S1423-N1425 VanDerWaalsContact O-N 3.16Å; S1423-K1426 WeakPolarHBondContact O-CA 3.48Å; S1423-K1426 VanDerWaalsContact O-CB 3.29Å; S1423-K1426 WeakPolarHBondContact O-CB 3.47Å; S1423-K1426 PolarHBondContact O-N 3.29Å
1424	F	25.8	Very low	28	Very low	177 Å²	177	139.4 Å²	139.4	78%	0.776	68%	0.677	S	S	*	*	H	α-helix	trans	-53.1	-32.9	164	-110.6	-90	0	0	0	113	K1426 F1427 Y1428	F1424-K1426 PolarHBondContact O-N 3.23Å; F1424-F1427 WeakPolarHBondContact O-CB 3.5Å; F1424-F1427 PolarHBondContact O-N 3.29Å; F1424-F1427 VanDerWaalsContact O-N 3.1Å; F1424-Y1428 PolarHBondContact O-N 3.27Å
1425	N	27.6	Very low	28.2	Very low	127 Å²	127	134 Å²	134	68%	0.679	65%	0.651	S	S	*	*	H	α-helix	trans	-56.4	-28.6	170.7	-75.2	-1.2	0	0	0	113.6	S1423 L1429	S1423-N1425 PolarHBondContact O-N 3.03Å; S1423-N1425 VanDerWaalsContact O-N 3.16Å; N1425-L1429 VanDerWaalsContact O-CB 3.22Å; N1425-L1429 WeakPolarHBondContact O-CB 3.34Å; N1425-L1429 WeakPolarHBondContact O-CD1 3.46Å; N1425-L1429 WeakPolarHBondContact O-CG 3.39Å; N1425-L1429 PolarHBondContact O-N 3.42Å
1426	K	29.7	Very low	28.7	Very low	156 Å²	156	133.5 Å²	133.5	68%	0.678	64%	0.643	S	S	*	*	H	α-helix	trans	-78.1	-27	179.7	-157.6	173	-170.5	178	0	111.9	S1423 F1424 K1430	S1423-K1426 WeakPolarHBondContact O-CA 3.48Å; S1423-K1426 VanDerWaalsContact O-CB 3.29Å; S1423-K1426 WeakPolarHBondContact O-CB 3.47Å; S1423-K1426 PolarHBondContact O-N 3.29Å; F1424-K1426 PolarHBondContact O-N 3.23Å; K1426-K1430 VanDerWaalsContact O-CB 3.25Å; K1426-K1430 WeakPolarHBondContact O-CB 3.39Å; K1426-K1430 PolarHBondContact O-N 3.09Å
1427	F	28.5	Very low	29.2	Very low	148 Å²	148	132.1 Å²	132.1	65%	0.649	63%	0.632	S	S	*	*	H	α-helix	trans	-73.1	-46.7	167.3	-168.3	-97.9	0	0	0	110.7	F1424 K1430 F1431	F1424-F1427 WeakPolarHBondContact O-CB 3.5Å; F1424-F1427 PolarHBondContact O-N 3.29Å; F1424-F1427 VanDerWaalsContact O-N 3.1Å; F1427-K1430 PolarHBondContact O-N 2.73Å; F1427-F1431 WeakPolarHBondContact O-CB 3.45Å; F1427-F1431 PolarHBondContact O-N 2.97Å
1428	Y	30.6	Very low	29.7	Very low	148 Å²	148	127.9 Å²	127.9	58%	0.58	62%	0.615	S	S	*	*	H	α-helix	trans	-65.5	-41.2	-179.4	-140.2	-94.7	0	0	0	113	F1424 N1432	F1424-Y1428 PolarHBondContact O-N 3.27Å; Y1428-N1432 WeakPolarHBondContact O-CB 3.27Å; Y1428-N1432 PolarHBondContact O-N 3.11Å; Y1428-N1432 VanDerWaalsContact O-N 3.07Å; Y1428-N1432 PolarHBondContact O-ND2 3.41Å
1429	L	32.9	Very low	30.1	Very low	118 Å²	118	127.3 Å²	127.3	62%	0.618	61%	0.605	S	S	*	*	H	α-helix	trans	-62.2	-45.9	172.1	-81.8	163.5	0	0	0	111.5	N1425 F1431 N1432 E1433	N1425-L1429 VanDerWaalsContact O-CB 3.22Å; N1425-L1429 WeakPolarHBondContact O-CB 3.34Å; N1425-L1429 WeakPolarHBondContact O-CD1 3.46Å; N1425-L1429 WeakPolarHBondContact O-CG 3.39Å; N1425-L1429 PolarHBondContact O-N 3.42Å; L1429-F1431 PolarHBondContact O-N 3.49Å; L1429-N1432 CarbonylContact O-C 3.58Å; L1429-N1432 PolarHBondContact O-N 2.99Å; L1429-E1433 PolarHBondContact O-N 3.35Å
1430	K	31.2	Very low	30.6	Very low	134 Å²	134	125.7 Å²	125.7	58%	0.583	59%	0.594	S	S	*	*	H	α-helix	trans	-70.2	-32.7	-177.9	-164.6	165.5	-174.8	176.8	0	112.9	K1426 F1427 M1434	K1426-K1430 VanDerWaalsContact O-CB 3.25Å; K1426-K1430 WeakPolarHBondContact O-CB 3.39Å; K1426-K1430 PolarHBondContact O-N 3.09Å; F1427-K1430 PolarHBondContact O-N 2.73Å; K1430-M1434 WeakPolarHBondContact O-CB 3.35Å; K1430-M1434 VanDerWaalsContact O-CG 3.32Å; K1430-M1434 WeakPolarHBondContact O-CG 3.46Å; K1430-M1434 PolarHBondContact O-N 3.46Å
1431	F	32.7	Very low	31.1	Very low	106 Å²	106	121.4 Å²	121.4	47%	0.465	58%	0.577	S	S	.	*	H	α-helix	trans	-65.4	-41.3	171.2	-170.6	-101.7	0	0	0	111.6	F1427 L1429 M1434 K1435	F1427-F1431 WeakPolarHBondContact O-CB 3.45Å; F1427-F1431 PolarHBondContact O-N 2.97Å; L1429-F1431 PolarHBondContact O-N 3.49Å; F1431-M1434 PolarHBondContact O-N 3.44Å; F1431-K1435 HydrophobicContact CE1-CD 4.45Å; F1431-K1435 PolarHBondContact O-N 3.42Å
1432	N	33.5	Very low	31.5	Very low	71 Å²	71	118.8 Å²	118.8	38%	0.38	56%	0.563	S	S	.	*	H	α-helix	trans	-70.5	-37.6	174.7	-74.2	-24.3	0	0	0	112.8	Y1428 L1429 M1434 K1435 L1436	Y1428-N1432 WeakPolarHBondContact O-CB 3.27Å; Y1428-N1432 PolarHBondContact O-N 3.11Å; Y1428-N1432 VanDerWaalsContact O-N 3.07Å; Y1428-N1432 PolarHBondContact O-ND2 3.41Å; L1429-N1432 CarbonylContact O-C 3.58Å; L1429-N1432 PolarHBondContact O-N 2.99Å; N1432-M1434 VanDerWaalsContact C-N 3.34Å; N1432-M1434 PolarHBondContact O-N 3.39Å; N1432-K1435 PolarHBondContact O-N 2.93Å; N1432-L1436 WeakPolarHBondContact O-CB 3.19Å; N1432-L1436 WeakPolarHBondContact O-CG 3.43Å; N1432-L1436 PolarHBondContact O-N 3.45Å
1433	E	36.6	Very low	31.8	Very low	97 Å²	97	117.1 Å²	117.1	45%	0.453	55%	0.551	S	S	.	*	H	α-helix	trans	-59.5	-42.8	170	-80.1	-167.7	96.4	0	0	111.8	L1429 L1436 K1437	L1429-E1433 PolarHBondContact O-N 3.35Å; E1433-L1436 PolarHBondContact O-N 3.13Å; E1433-K1437 WeakPolarHBondContact O-CB 3.37Å; E1433-K1437 WeakPolarHBondContact O-CG 3.49Å; E1433-K1437 PolarHBondContact O-N 3.47Å; E1433-K1437 IonicContact OE1-NZ 2.73Å
1434	M	33.6	Very low	32	Very low	115 Å²	115	120.5 Å²	120.5	57%	0.567	56%	0.564	S	S	*	*	H	α-helix	trans	-64.7	-43.5	178	-76.6	178.7	65.7	0	0	111.8	K1430 F1431 N1432 Q1438	K1430-M1434 WeakPolarHBondContact O-CB 3.35Å; K1430-M1434 VanDerWaalsContact O-CG 3.32Å; K1430-M1434 WeakPolarHBondContact O-CG 3.46Å; K1430-M1434 PolarHBondContact O-N 3.46Å; F1431-M1434 PolarHBondContact O-N 3.44Å; N1432-M1434 VanDerWaalsContact C-N 3.34Å; N1432-M1434 PolarHBondContact O-N 3.39Å; M1434-Q1438 WeakPolarHBondContact O-CG 3.29Å; M1434-Q1438 PolarHBondContact O-N 3.4Å
1435	K	31.4	Very low	32.1	Very low	91 Å²	91	118.4 Å²	118.4	40%	0.396	56%	0.56	S	S	.	*	H	α-helix	trans	-67.2	-38.6	173.7	-84.8	-165.1	172.1	-174.2	0	113	F1431 N1432 Q1438 I1439	F1431-K1435 HydrophobicContact CE1-CD 4.45Å; F1431-K1435 PolarHBondContact O-N 3.42Å; N1432-K1435 PolarHBondContact O-N 2.93Å; K1435-Q1438 PolarHBondContact O-N 3.03Å; K1435-I1439 WeakPolarHBondContact O-CD1 3.26Å; K1435-I1439 VanDerWaalsContact O-CG1 3.25Å; K1435-I1439 WeakPolarHBondContact O-CG1 3.41Å; K1435-I1439 PolarHBondContact O-N 3.43Å
1436	L	34.8	Very low	32.1	Very low	109 Å²	109	120.4 Å²	120.4	57%	0.571	56%	0.563	S	S	*	*	H	α-helix	trans	-63.9	-44.6	175.9	-82.8	163.6	0	0	0	111.7	N1432 E1433 Q1438 I1439 E1440	N1432-L1436 WeakPolarHBondContact O-CB 3.19Å; N1432-L1436 WeakPolarHBondContact O-CG 3.43Å; N1432-L1436 PolarHBondContact O-N 3.45Å; E1433-L1436 PolarHBondContact O-N 3.13Å; L1436-Q1438 VanDerWaalsContact C-N 3.35Å; L1436-Q1438 PolarHBondContact O-N 2.93Å; L1436-I1439 CarbonylContact O-C 3.54Å; L1436-I1439 PolarHBondContact O-N 2.96Å; L1436-I1439 VanDerWaalsContact O-N 3.08Å; L1436-E1440 PolarHBondContact O-N 3.26Å
1437	K	34	Very low	32	Very low	119 Å²	119	122.7 Å²	122.7	52%	0.517	57%	0.569	S	S	.	*	H	α-helix	trans	-64.7	-35.8	175.5	-76.8	174.3	175.5	163.4	0	112.7	E1433 I1439 E1440 Q1441	E1433-K1437 WeakPolarHBondContact O-CB 3.37Å; E1433-K1437 WeakPolarHBondContact O-CG 3.49Å; E1433-K1437 PolarHBondContact O-N 3.47Å; E1433-K1437 IonicContact OE1-NZ 2.73Å; K1437-I1439 VanDerWaalsContact C-N 3.35Å; K1437-E1440 PolarHBondContact O-N 2.99Å; K1437-Q1441 WeakPolarHBondContact O-CB 3.49Å; K1437-Q1441 VanDerWaalsContact O-CG 3.26Å; K1437-Q1441 WeakPolarHBondContact O-CG 3.34Å; K1437-Q1441 PolarHBondContact O-N 3.39Å
1438	Q	33.6	Very low	31.8	Very low	106 Å²	106	120 Å²	120	50%	0.495	57%	0.566	S	S	.	*	H	α-helix	trans	-65.8	-35.8	170.5	-76	178.9	-18	0	0	112.4	M1434 K1435 L1436 Q1441 I1442	M1434-Q1438 WeakPolarHBondContact O-CG 3.29Å; M1434-Q1438 PolarHBondContact O-N 3.4Å; K1435-Q1438 PolarHBondContact O-N 3.03Å; L1436-Q1438 VanDerWaalsContact C-N 3.35Å; L1436-Q1438 PolarHBondContact O-N 2.93Å; Q1438-Q1441 PolarHBondContact O-N 3.45Å; Q1438-I1442 WeakPolarHBondContact O-CB 3.49Å; Q1438-I1442 WeakPolarHBondContact O-CD1 3.3Å; Q1438-I1442 VanDerWaalsContact O-CG1 3.25Å; Q1438-I1442 WeakPolarHBondContact O-CG1 3.5Å; Q1438-I1442 PolarHBondContact O-N 2.66Å
1439	I	34.1	Very low	31.5	Very low	95 Å²	95	122.3 Å²	122.3	49%	0.487	58%	0.575	S	S	.	*	H	α-helix	trans	-70.7	-36.9	175.9	-70.6	164.3	0	0	0	111.5	K1435 L1436 K1437 I1442 K1443	K1435-I1439 WeakPolarHBondContact O-CD1 3.26Å; K1435-I1439 VanDerWaalsContact O-CG1 3.25Å; K1435-I1439 WeakPolarHBondContact O-CG1 3.41Å; K1435-I1439 PolarHBondContact O-N 3.43Å; L1436-I1439 CarbonylContact O-C 3.54Å; L1436-I1439 PolarHBondContact O-N 2.96Å; L1436-I1439 VanDerWaalsContact O-N 3.08Å; K1437-I1439 VanDerWaalsContact C-N 3.35Å; I1439-I1442 PolarHBondContact O-N 2.79Å; I1439-K1443 PolarHBondContact O-N 2.97Å
1440	E	33.8	Very low	31.1	Very low	120 Å²	120	125 Å²	125	56%	0.561	59%	0.591	S	S	*	*	H	α-helix	trans	-67.4	-41.9	171.4	-71.7	-174.2	127.6	0	0	112.2	L1436 K1437 I1442 K1443 N1444	L1436-E1440 PolarHBondContact O-N 3.26Å; K1437-E1440 PolarHBondContact O-N 2.99Å; E1440-I1442 VanDerWaalsContact C-N 3.32Å; E1440-I1442 PolarHBondContact O-N 3.09Å; E1440-K1443 WeakPolarHBondContact O-CB 3.5Å; E1440-K1443 PolarHBondContact O-N 3.44Å; E1440-N1444 PolarHBondContact O-N 3.3Å
1441	Q	33.5	Very low	30.9	Very low	122 Å²	122	123.2 Å²	123.2	57%	0.57	59%	0.591	S	S	*	*	H	α-helix	trans	-59.2	-42.9	172.5	-76.4	172.8	-25	0	0	111.5	K1437 Q1438 N1444 L1445	K1437-Q1441 WeakPolarHBondContact O-CB 3.49Å; K1437-Q1441 VanDerWaalsContact O-CG 3.26Å; K1437-Q1441 WeakPolarHBondContact O-CG 3.34Å; K1437-Q1441 PolarHBondContact O-N 3.39Å; Q1438-Q1441 PolarHBondContact O-N 3.45Å; Q1441-N1444 PolarHBondContact O-N 2.9Å; Q1441-L1445 VanDerWaalsContact O-CD1 3.27Å; Q1441-L1445 WeakPolarHBondContact O-CD1 3.47Å; Q1441-L1445 PolarHBondContact O-N 3.24Å
1442	I	32.8	Very low	30.4	Very low	102 Å²	102	123.7 Å²	123.7	52%	0.523	60%	0.603	S	S	.	*	H	α-helix	trans	-68.6	-36.1	176.8	-69.9	165.8	0	0	0	111.9	Q1438 I1439 E1440 N1444 L1445	Q1438-I1442 WeakPolarHBondContact O-CB 3.49Å; Q1438-I1442 WeakPolarHBondContact O-CD1 3.3Å; Q1438-I1442 VanDerWaalsContact O-CG1 3.25Å; Q1438-I1442 WeakPolarHBondContact O-CG1 3.5Å; Q1438-I1442 PolarHBondContact O-N 2.66Å; I1439-I1442 PolarHBondContact O-N 2.79Å; E1440-I1442 VanDerWaalsContact C-N 3.32Å; E1440-I1442 PolarHBondContact O-N 3.09Å; I1442-N1444 VanDerWaalsContact C-N 3.32Å; I1442-N1444 PolarHBondContact O-N 3.48Å; I1442-L1445 PolarHBondContact O-N 3.07Å
1443	K	29.7	Very low	30.2	Very low	139 Å²	139	130.8 Å²	130.8	60%	0.604	63%	0.626	S	S	*	*	H	α-helix	trans	-59.4	-43	170	-88.1	-174	171.7	-177.5	0	111.7	I1439 E1440 L1445 F1446	I1439-K1443 PolarHBondContact O-N 2.97Å; E1440-K1443 WeakPolarHBondContact O-CB 3.5Å; E1440-K1443 PolarHBondContact O-N 3.44Å; K1443-L1445 VanDerWaalsContact C-N 3.31Å; K1443-L1445 PolarHBondContact O-N 2.93Å; K1443-F1446 PolarHBondContact O-N 2.75Å
1444	N	30.7	Very low	29.7	Very low	130 Å²	130	132.1 Å²	132.1	70%	0.695	64%	0.636	S	S	*	*	H	α-helix	trans	-74.1	-17.5	-179.9	-68.4	-11.3	0	0	0	113.6	E1440 Q1441 I1442	E1440-N1444 PolarHBondContact O-N 3.3Å; Q1441-N1444 PolarHBondContact O-N 2.9Å; I1442-N1444 VanDerWaalsContact C-N 3.32Å; I1442-N1444 PolarHBondContact O-N 3.48Å
1445	L	29.3	Very low	29.2	Very low	133 Å²	133	132.5 Å²	132.5	70%	0.696	65%	0.645	S	S	*	*	H	α-helix	trans	-79.2	-20.5	172.8	-102.7	78.3	0	0	0	114.1	Q1441 I1442 K1443	Q1441-L1445 VanDerWaalsContact O-CD1 3.27Å; Q1441-L1445 WeakPolarHBondContact O-CD1 3.47Å; Q1441-L1445 PolarHBondContact O-N 3.24Å; I1442-L1445 PolarHBondContact O-N 3.07Å; K1443-L1445 VanDerWaalsContact C-N 3.31Å; K1443-L1445 PolarHBondContact O-N 2.93Å
1446	F	27	Very low	29	Very low	169 Å²	169	133.6 Å²	133.6	74%	0.741	66%	0.659	S	S	*	*	S	Bend	trans	-99.7	5.6	-177.2	-87.4	-84.4	0	0	0	115	K1443	K1443-F1446 PolarHBondContact O-N 2.75Å
1447	Y	27.3	Very low	28.6	Very low	204 Å²	204	133.8 Å²	133.8	80%	0.8	67%	0.665	S	S	*	*			trans	-133.9	68.7	167.2	-82.7	-82.5	0	0	0	112.3
1448	P	24.5	Very low	28.3	Very low	91 Å²	91	134.4 Å²	134.4	59%	0.591	67%	0.674	S	S	*	*			trans	-76.7	141.2	166.9	33.1	-33.3	0	0	0	110.9
1449	Y	25.3	Very low	28	Very low	197 Å²	197	135.5 Å²	135.5	77%	0.773	68%	0.683	S	S	*	*			trans	65.7	91.7	177.4	-59.8	-80.2	0	0	0	117.6	T1451	Y1449-T1451 HydrophobicContact CD1-CG2 3.84Å; Y1449-T1451 HydrophobicContact CE1-CG2 4.08Å
1450	N	24	Very low	27.6	Very low	176 Å²	176	137.3 Å²	137.3	94%	0.941	69%	0.694	S	S	*	*				-130.4	115	108.1	-119.2	-14.9	0	0	0	108.6
1451	T	26.4	Very low	27.2	Very low	95 Å²	95	137.1 Å²	137.1	58%	0.583	70%	0.701	S	S	*	*			trans	-93.3	120.3	-173.5	38.8	0	0	0	0	112.4	Y1449	Y1449-T1451 HydrophobicContact CD1-CG2 3.84Å; Y1449-T1451 HydrophobicContact CE1-CG2 4.08Å
1452	T	22.9	Very low	26.9	Very low	116 Å²	116	136.7 Å²	136.7	71%	0.712	71%	0.707	S	S	*	*			trans	44.9	95.5	136.8	-29.5	0	0	0	0	118.5
1453	Y	29.1	Very low	26.6	Very low	221 Å²	221	138.5 Å²	138.5	87%	0.867	72%	0.718	S	S	*	*			trans	-141.7	106	145.9	-91.3	-70.4	0	0	0	112.4
1454	N	26.7	Very low	26.4	Very low	124 Å²	124	136.3 Å²	136.3	66%	0.663	72%	0.72	S	S	*	*			trans	26.4	110.2	143	-61.5	1.4	0	0	0	121.2
1455	T	22.6	Very low	26.2	Very low	123 Å²	123	137 Å²	137	76%	0.755	72%	0.724	S	S	*	*				57.3	159.7	124.3	60	0	0	0	0	123.3
1456	T	27.5	Very low	26.1	Very low	114 Å²	114	135.7 Å²	135.7	70%	0.699	72%	0.721	S	S	*	*			trans	78.6	91.9	154.9	25.7	0	0	0	0	120.3
1457	T	26	Very low	26.1	Very low	114 Å²	114	134 Å²	134	70%	0.699	72%	0.72	S	S	*	*				66.4	129.7	122.7	52.9	0	0	0	0	123.3
1458	N	28.1	Very low	26.1	Very low	132 Å²	132	130.6 Å²	130.6	71%	0.706	72%	0.716	S	S	*	*			trans	85.2	107.3	138.2	-65.3	0.3	0	0	0	121.8
1459	N	26.7	Very low	26.3	Very low	128 Å²	128	132.8 Å²	132.8	68%	0.684	72%	0.722	S	S	*	*				62.1	117.1	116.5	-59.2	-2.5	0	0	0	122.2
1460	N	26.1	Very low	26.4	Very low	134 Å²	134	129 Å²	129	72%	0.717	72%	0.72	S	S	*	*				85.7	123.5	123.7	-65.5	0.2	0	0	0	122.7
1461	T	26	Very low	26.6	Very low	116 Å²	116	125.7 Å²	125.7	71%	0.712	71%	0.706	S	S	*	*			trans	78.6	117.8	131.2	53.4	0	0	0	0	123.4
1462	T	26.9	Very low	26.6	Very low	112 Å²	112	126.6 Å²	126.6	69%	0.687	71%	0.708	S	S	*	*				76.2	120.6	129.2	56.9	0	0	0	0	123.7
1463	N	26.2	Very low	26.9	Very low	141 Å²	141	130.2 Å²	130.2	75%	0.754	71%	0.709	S	S	*	*				81.2	107.1	124.7	-64.2	6.6	0	0	0	122.9
1464	S	25.7	Very low	27	Very low	93 Å²	93	124.1 Å²	124.1	65%	0.65	70%	0.696	S	S	*	*				70	127.5	118.4	74.6	0	0	0	0	123.1
1465	N	25.7	Very low	27.3	Very low	144 Å²	144	122.2 Å²	122.2	77%	0.77	69%	0.689	S	S	*	*				65.7	146.5	126.1	-64	8.7	0	0	0	119.8
1466	T	27.6	Very low	27.7	Very low	105 Å²	105	125.7 Å²	125.7	64%	0.644	69%	0.689	S	S	*	*			cis	-165.5	149	1.1	12	0	0	0	0	112.8
1467	N	26.9	Very low	27.7	Very low	135 Å²	135	125.6 Å²	125.6	72%	0.722	69%	0.685	S	S	*	*			trans	69.2	143.8	137.8	-68	0.4	0	0	0	125.9
1468	N	28.3	Very low	27.9	Very low	131 Å²	131	124.6 Å²	124.6	70%	0.701	68%	0.678	S	S	*	*			trans	94.9	111	144.5	-69.4	-8.3	0	0	0	122.2
1469	N	27.4	Very low	28.1	Very low	137 Å²	137	123.9 Å²	123.9	73%	0.733	68%	0.679	S	S	*	*				49.2	136.8	118.7	-57.4	-0.8	0	0	0	121.1
1470	T	27.2	Very low	28.1	Very low	117 Å²	117	124.1 Å²	124.1	72%	0.718	68%	0.68	S	S	*	*			cis	-151.7	-132	-6.8	20.5	0	0	0	0	108.1
1471	T	27.8	Very low	28.4	Very low	107 Å²	107	124.7 Å²	124.7	66%	0.656	68%	0.682	S	S	*	*			cis	-168.8	157.9	0.7	-18.3	0	0	0	0	110.1
1472	N	27.9	Very low	28.5	Very low	114 Å²	114	124.4 Å²	124.4	61%	0.61	68%	0.68	S	S	*	*			trans	69.5	154.2	159.9	-67.2	-6.7	0	0	0	117.8
1473	Y	29.7	Very low	28.8	Very low	192 Å²	192	124.8 Å²	124.8	75%	0.753	68%	0.682	S	S	*	*			cis	-168.9	173.8	-2.6	-108.8	-3	0	0	0	108.2
1474	T	30.9	Very low	28.9	Very low	94 Å²	94	123.5 Å²	123.5	58%	0.577	68%	0.675	S	S	*	*			cis	-162.2	129	0.1	8.5	0	0	0	0	111.3
1475	T	32.1	Very low	29	Very low	84 Å²	84	125.2 Å²	125.2	52%	0.515	68%	0.677	S	S	.	*			trans	51.6	-171.1	144.3	49	0	0	0	0	118
1476	Y	31.4	Very low	29.3	Very low	195 Å²	195	123.7 Å²	123.7	77%	0.765	67%	0.673	S	S	*	*			cis	-120	135.8	-11.1	-83.9	-85.1	0	0	0	108.8
1477	N	28	Very low	29.4	Very low	113 Å²	113	124.1 Å²	124.1	60%	0.604	68%	0.676	S	S	*	*				75.2	155.1	55.2	-67.8	-5	0	0	0	112.2
1478	T	28.7	Very low	29.5	Very low	93 Å²	93	123.8 Å²	123.8	57%	0.571	67%	0.674	S	S	*	*			cis	-160.8	-178.5	-0.5	13.7	0	0	0	0	107.4
1479	T	32	Very low	29.5	Very low	117 Å²	117	123.4 Å²	123.4	72%	0.718	67%	0.672	S	S	*	*			cis	-156	152.4	38.2	36.4	0	0	0	0	108.8
1480	N	27.5	Very low	29.7	Very low	132 Å²	132	122.9 Å²	122.9	71%	0.706	67%	0.674	S	S	*	*			cis	96.6	161.5	28	-72.1	9.4	0	0	0	115.2
1481	I	31.5	Very low	29.9	Very low	147 Å²	147	122.4 Å²	122.4	75%	0.754	67%	0.671	S	S	*	*			trans	104	85.9	172.9	-60.6	169.9	0	0	0	112.3
1482	T	28.9	Very low	30.1	Very low	110 Å²	110	123.8 Å²	123.8	68%	0.675	68%	0.675	S	S	*	*				77.1	148.8	75.1	62.1	0	0	0	0	113.4
1483	T	32.6	Very low	30.3	Very low	119 Å²	119	124.8 Å²	124.8	73%	0.73	68%	0.68	S	S	*	*			cis	-140.3	153.9	34.8	42.1	0	0	0	0	112.2
1484	N	28.7	Very low	30.4	Very low	114 Å²	114	120.8 Å²	120.8	61%	0.61	68%	0.676	S	S	*	*				60.7	142.7	65.8	-63.1	68.8	0	0	0	113.5
1485	D	29.3	Very low	30.4	Very low	129 Å²	129	121.6 Å²	121.6	69%	0.69	68%	0.68	S	S	*	*			cis	-169.6	167.6	-7.3	-90.9	-18.1	0	0	0	107.7
1486	T	30.2	Very low	30.3	Very low	113 Å²	113	123.8 Å²	123.8	69%	0.693	69%	0.689	S	S	*	*			cis	-158.4	-149.4	-15.5	37.2	0	0	0	0	107
1487	T	29.6	Very low	30.3	Very low	114 Å²	114	120.7 Å²	120.7	70%	0.699	69%	0.686	S	S	*	*			cis	-167.7	164.4	5	-9.6	0	0	0	0	111.6
1488	N	29.7	Very low	30.4	Very low	127 Å²	127	120.9 Å²	120.9	68%	0.679	69%	0.691	S	S	*	*			trans	66.9	126.8	150.1	-77.6	42.8	0	0	0	127.2
1489	D	28.8	Very low	30.2	Very low	123 Å²	123	121.2 Å²	121.2	66%	0.658	69%	0.693	S	S	*	*				86.4	120.8	126.7	-64.7	-18.7	0	0	0	127.2
1490	T	30.9	Very low	30.1	Very low	127 Å²	127	124.9 Å²	124.9	78%	0.779	70%	0.695	S	S	*	*			trans	68.6	148.2	145.6	61.2	0	0	0	0	120
1491	T	32.1	Very low	30	Very low	107 Å²	107	124.2 Å²	124.2	66%	0.656	69%	0.692	S	S	*	*			cis	-163.1	151.1	-6.3	12.2	0	0	0	0	111
1492	N	32.3	Very low	29.7	Very low	136 Å²	136	122.4 Å²	122.4	73%	0.727	69%	0.687	S	S	*	*			trans	61.5	158.8	154.4	-57.8	-15.9	0	0	0	117.3
1493	N	31.2	Very low	29.5	Very low	134 Å²	134	122.5 Å²	122.5	72%	0.717	69%	0.688	S	S	*	*			cis	-159.6	162.9	-17.8	-104.2	-15.5	0	0	0	105.3
1494	T	31.9	Very low	29.2	Very low	109 Å²	109	123.9 Å²	123.9	67%	0.669	69%	0.686	S	S	*	*			cis	-158.8	148.1	20.8	-14.2	0	0	0	0	111.3
1495	T	31.5	Very low	29.1	Very low	110 Å²	110	124.1 Å²	124.1	68%	0.675	69%	0.687	S	S	*	*			trans	56.7	111.5	150.7	47.7	0	0	0	0	122.7
1496	N	30.6	Very low	28.9	Very low	130 Å²	130	124 Å²	124	70%	0.695	69%	0.686	S	S	*	*				102.4	77.4	120.5	-62.3	0.5	0	0	0	121.6
1497	N	29.9	Very low	28.8	Very low	131 Å²	131	123.7 Å²	123.7	70%	0.701	69%	0.685	S	S	*	*				87.3	103.9	114.8	-65.4	-0.9	0	0	0	121.4
1498	T	29.6	Very low	28.7	Very low	117 Å²	117	123.7 Å²	123.7	72%	0.718	69%	0.685	S	S	*	*				55.1	111.6	128.1	58.1	0	0	0	0	118
1499	T	26.3	Very low	28.5	Very low	99 Å²	99	124.6 Å²	124.6	61%	0.607	69%	0.69	S	S	*	*			cis	58.1	136.8	21.4	9.7	0	0	0	0	113.2
1500	Y	28.6	Very low	28.4	Very low	195 Å²	195	126.6 Å²	126.6	77%	0.765	70%	0.7	S	S	*	*			cis	-144.3	150.2	26.7	-95.9	-77.1	0	0	0	114.5
1501	N	26.5	Very low	28.3	Very low	118 Å²	118	126.5 Å²	126.5	63%	0.631	70%	0.7	S	S	*	*			trans	30.9	135.7	130.1	-64.3	19.3	0	0	0	120.6
1502	T	23.8	Very low	28	Very low	108 Å²	108	127.2 Å²	127.2	66%	0.663	70%	0.704	S	S	*	*			cis	73.3	130.5	48.8	72.4	0	0	0	0	116.7
1503	T	24.8	Very low	27.7	Very low	113 Å²	113	130.5 Å²	130.5	69%	0.693	71%	0.708	S	S	*	*			trans	67.4	156.1	153.9	44.1	0	0	0	0	118.3
1504	H	26.6	Very low	27.5	Very low	148 Å²	148	130.6 Å²	130.6	69%	0.685	71%	0.708	S	S	*	*			cis	-156.2	156.4	7.6	-119	-52.3	0	0	0	111
1505	N	25.8	Very low	27.4	Very low	118 Å²	118	132.2 Å²	132.2	63%	0.631	71%	0.711	S	S	*	*			trans	65.5	160.5	142.1	-72.2	20.2	0	0	0	121.6
1506	D	26.1	Very low	27.2	Very low	126 Å²	126	131.5 Å²	131.5	67%	0.674	71%	0.707	S	S	*	*			cis	-147.1	174.7	-3	-126.4	-32	0	0	0	116.8
1507	T	28.2	Very low	27.1	Very low	108 Å²	108	130.1 Å²	130.1	66%	0.663	70%	0.7	S	S	*	*			trans	-19.2	144.1	175.2	43.5	0	0	0	0	125.4
1508	T	27.2	Very low	27.1	Very low	113 Å²	113	128.3 Å²	128.3	69%	0.693	70%	0.697	S	S	*	*			trans	61.8	101.6	140.2	55.6	0	0	0	0	121.8
1509	N	25.1	Very low	27.1	Very low	147 Å²	147	127.3 Å²	127.3	79%	0.786	69%	0.687	S	S	*	*				173.4	117.8	93.6	-91.6	-29	0	0	0	113.3
1510	N	28	Very low	27.1	Very low	165 Å²	165	129 Å²	129	88%	0.882	69%	0.689	S	S	*	*				-175.8	150.6	125.9	-101.7	-32.3	0	0	0	112.7
1511	T	27.2	Very low	27.5	Very low	124 Å²	124	125 Å²	125	76%	0.761	68%	0.68	S	S	*	*			trans	-91.8	168.7	175.1	42.9	0	0	0	0	111.8
1512	T	25.9	Very low	27.9	Very low	123 Å²	123	125 Å²	125	76%	0.755	68%	0.68	S	S	*	*	S	Bend	trans	79.3	154.3	-177.5	-29.6	0	0	0	0	113.3
1513	Y	26.2	Very low	28.2	Very low	205 Å²	205	126.4 Å²	126.4	80%	0.804	68%	0.68	S	S	*	*	S	Bend	trans	57.8	74.5	-173.9	-66.1	-86.6	0	0	0	116.7
1514	N	28	Very low	29.1	Very low	135 Å²	135	125.9 Å²	125.9	72%	0.722	67%	0.673	S	S	*	*	S	Bend	trans	-163.2	-4.5	150.1	-110.8	-50.1	0	0	0	116.5
1515	I	28.7	Very low	29.9	Very low	143 Å²	143	123.4 Å²	123.4	73%	0.733	66%	0.662	S	S	*	*	H	α-helix	trans	-77.8	-29.7	-176.7	-66.2	175.6	0	0	0	112.8	I1519	I1515-I1519 HydrophobicContact CG2-CD1 4.12Å
1516	T	27.4	Very low	30.6	Very low	96 Å²	96	126.3 Å²	126.3	59%	0.589	66%	0.664	S	S	*	*	H	α-helix	trans	-67.6	-48.5	-174.9	39.5	0	0	0	0	113.7	S1518 I1519 M1520	T1516-S1518 VanDerWaalsContact C-N 3.33Å; T1516-S1518 PolarHBondContact O-N 3.29Å; T1516-I1519 PolarHBondContact O-N 3.23Å; T1516-M1520 PolarHBondContact O-N 3.18Å
1517	N	29	Very low	31.4	Very low	101 Å²	101	125.1 Å²	125.1	54%	0.54	66%	0.657	S	S	.	*	H	α-helix	trans	-64	-32.8	-173.2	-75.2	-3.9	0	0	0	113.8	I1519	N1517-I1519 VanDerWaalsContact C-N 3.32Å; N1517-I1519 PolarHBondContact O-N 3.06Å
1518	S	30.2	Very low	32.2	Very low	92 Å²	92	122.2 Å²	122.2	64%	0.643	64%	0.638	S	S	*	*	H	α-helix	trans	-74.9	-21.2	179.7	-159.7	0	0	0	0	113.4	T1516	T1516-S1518 VanDerWaalsContact C-N 3.33Å; T1516-S1518 PolarHBondContact O-N 3.29Å
1519	I	30	Very low	33	Very low	97 Å²	97	120.7 Å²	120.7	50%	0.497	62%	0.624	S	S	.	*	H	α-helix	trans	-81.8	-41	175.6	-63.7	172.5	0	0	0	109.8	I1515 T1516 N1517 I1521 N1522 M1523	I1515-I1519 HydrophobicContact CG2-CD1 4.12Å; T1516-I1519 PolarHBondContact O-N 3.23Å; N1517-I1519 VanDerWaalsContact C-N 3.32Å; N1517-I1519 PolarHBondContact O-N 3.06Å; I1519-I1521 VanDerWaalsContact C-N 3.35Å; I1519-I1521 PolarHBondContact O-N 3.17Å; I1519-N1522 PolarHBondContact O-N 3.46Å; I1519-M1523 PolarHBondContact O-N 3.47Å
1520	M	26.7	Very low	34.1	Very low	133 Å²	133	116.4 Å²	116.4	66%	0.655	60%	0.601	S	S	*	*	H	α-helix	trans	-60.7	-39.5	-176.2	-135.4	176.7	80.7	0	0	113.2	T1516 N1522	T1516-M1520 PolarHBondContact O-N 3.18Å; M1520-N1522 VanDerWaalsContact C-N 3.33Å; M1520-N1522 PolarHBondContact O-N 3.36Å
1521	I	36.5	Very low	34.8	Very low	111 Å²	111	113.5 Å²	113.5	57%	0.569	58%	0.583	S	S	*	*	H	α-helix	trans	-66	-36.2	178.9	-64.8	168.7	0	0	0	111.5	I1519	I1519-I1521 VanDerWaalsContact C-N 3.35Å; I1519-I1521 PolarHBondContact O-N 3.17Å
1522	N	34.5	Very low	35.7	Very low	119 Å²	119	109.9 Å²	109.9	64%	0.636	56%	0.555	S	S	*	*	H	α-helix	trans	-78.8	-31.3	-173.8	-140.2	3.3	0	0	0	112.4	I1519 M1520 N1524	I1519-N1522 PolarHBondContact O-N 3.46Å; M1520-N1522 VanDerWaalsContact C-N 3.33Å; M1520-N1522 PolarHBondContact O-N 3.36Å; N1522-N1524 VanDerWaalsContact C-N 3.34Å
1523	M	30.8	Very low	36.5	Very low	137 Å²	137	108 Å²	108	68%	0.675	54%	0.54	S	S	*	.	H	α-helix	trans	-65.4	-35.7	173.6	-83.1	-169.1	161.6	0	0	113	I1519 Q1525 W1526 L1527	I1519-M1523 PolarHBondContact O-N 3.47Å; M1523-Q1525 PolarHBondContact O-N 3.08Å; M1523-W1526 PolarHBondContact O-N 3.16Å; M1523-L1527 PolarHBondContact O-N 3.39Å
1524	N	43.2	Very low	37.5	Very low	102 Å²	102	104.3 Å²	104.3	55%	0.545	53%	0.528	S	S	.	.	H	α-helix	trans	-65	-40.9	-169.8	-142.6	1.1	0	0	0	112.2	N1522 W1526 L1527 I1528	N1522-N1524 VanDerWaalsContact C-N 3.34Å; N1524-W1526 PolarHBondContact O-N 3.32Å; N1524-L1527 PolarHBondContact O-N 3.01Å; N1524-I1528 WeakPolarHBondContact O-CG1 3.45Å; N1524-I1528 PolarHBondContact O-N 3.38Å; N1524-I1528 VanDerWaalsContact O-N 3.12Å
1525	Q	44.1	Very low	38.3	Very low	97 Å²	97	102.2 Å²	102.2	45%	0.453	51%	0.514	S	S	.	.	H	α-helix	trans	-63.1	-39.5	175.4	-65.3	-175	-9.4	0	0	112.5	M1523 I1529	M1523-Q1525 PolarHBondContact O-N 3.08Å; Q1525-I1529 WeakPolarHBondContact O-CD1 3.48Å; Q1525-I1529 WeakPolarHBondContact O-CG1 3.37Å; Q1525-I1529 PolarHBondContact O-N 3.46Å
1526	W	40.7	Very low	39	Very low	178 Å²	178	98.4 Å²	98.4	67%	0.674	49%	0.494	S	S	*	.	H	α-helix	trans	-71	-35.3	179	-150.5	83.5	0	0	0	112.1	M1523 N1524 I1529 N1530	M1523-W1526 PolarHBondContact O-N 3.16Å; N1524-W1526 PolarHBondContact O-N 3.32Å; W1526-I1529 PolarHBondContact O-N 2.86Å; W1526-N1530 WeakPolarHBondContact CZ3-ND2 3.19Å; W1526-N1530 WeakPolarHBondContact O-CB 3.38Å; W1526-N1530 PolarHBondContact O-N 2.94Å
1527	L	41.1	Very low	39.8	Very low	101 Å²	101	101.8 Å²	101.8	53%	0.529	50%	0.503	S	S	.	.	H	α-helix	trans	-65.3	-42.5	176.5	-152.5	79.6	0	0	0	111.8	M1523 N1524 N1530 Q1531	M1523-L1527 PolarHBondContact O-N 3.39Å; N1524-L1527 PolarHBondContact O-N 3.01Å; L1527-N1530 PolarHBondContact O-N 3.08Å; L1527-Q1531 WeakPolarHBondContact O-CG 3.29Å; L1527-Q1531 PolarHBondContact O-N 3.12Å
1528	I	45.4	Very low	40.6	Very low	48 Å²	48	102.6 Å²	102.6	25%	0.246	51%	0.507	C	S	.	.	H	α-helix	trans	-59.4	-53	175	-68.7	164.1	0	0	0	110.3	N1524 N1530 Q1531 Y1532 L1554	N1524-I1528 WeakPolarHBondContact O-CG1 3.45Å; N1524-I1528 PolarHBondContact O-N 3.38Å; N1524-I1528 VanDerWaalsContact O-N 3.12Å; I1528-N1530 VanDerWaalsContact C-N 3.28Å; I1528-N1530 PolarHBondContact O-N 3.14Å; I1528-Q1531 PolarHBondContact O-N 3.44Å; I1528-Q1531 VanDerWaalsContact O-N 3.15Å; I1528-Y1532 HydrophobicContact CG2-CD2 3.83Å; I1528-Y1532 HydrophobicContact CG2-CE2 3.93Å; I1528-Y1532 WeakPolarHBondContact O-CD2 3.49Å; I1528-Y1532 PolarHBondContact O-N 2.99Å; I1528-L1554 HydrophobicContact CG2-CD1 4.48Å
1529	I	44.6	Very low	41	Very low	80 Å²	80	101.5 Å²	101.5	41%	0.41	49%	0.494	S	S	.	.	H	α-helix	trans	-56.3	-42.4	179.6	-69	165.8	0	0	0	111.5	Q1525 W1526 Y1532 L1533	Q1525-I1529 WeakPolarHBondContact O-CD1 3.48Å; Q1525-I1529 WeakPolarHBondContact O-CG1 3.37Å; Q1525-I1529 PolarHBondContact O-N 3.46Å; W1526-I1529 PolarHBondContact O-N 2.86Å; I1529-Y1532 PolarHBondContact O-N 2.89Å; I1529-L1533 HydrophobicContact CG2-CD1 4.02Å; I1529-L1533 WeakPolarHBondContact O-CG 3.23Å; I1529-L1533 PolarHBondContact O-N 3.44Å
1530	N	47.2	Very low	41.4	Very low	58 Å²	58	101.4 Å²	101.4	31%	0.31	50%	0.502	S	S	.	.	H	α-helix	trans	-74	-27	-177.7	-156.1	-14.3	0	0	0	112.9	W1526 L1527 I1528 K1534	W1526-N1530 WeakPolarHBondContact CZ3-ND2 3.19Å; W1526-N1530 WeakPolarHBondContact O-CB 3.38Å; W1526-N1530 PolarHBondContact O-N 2.94Å; L1527-N1530 PolarHBondContact O-N 3.08Å; I1528-N1530 VanDerWaalsContact C-N 3.28Å; I1528-N1530 PolarHBondContact O-N 3.14Å; N1530-K1534 PolarHBondContact O-N 2.98Å
1531	Q	44.2	Very low	42	Very low	104 Å²	104	101.6 Å²	101.6	49%	0.486	51%	0.506	S	S	.	.	H	α-helix	trans	-70.9	-42.7	168.9	-72.9	-176.7	15.2	0	0	111.8	L1527 I1528 K1534 Q1535	L1527-Q1531 WeakPolarHBondContact O-CG 3.29Å; L1527-Q1531 PolarHBondContact O-N 3.12Å; I1528-Q1531 PolarHBondContact O-N 3.44Å; I1528-Q1531 VanDerWaalsContact O-N 3.15Å; Q1531-K1534 PolarHBondContact O-N 3.25Å; Q1531-Q1535 WeakPolarHBondContact O-CG 3.47Å; Q1531-Q1535 PolarHBondContact O-N 3.36Å
1532	Y	44.4	Very low	42	Very low	48 Å²	48	105.1 Å²	105.1	19%	0.188	52%	0.52	C	S	.	.	H	α-helix	trans	-67.8	-37	178	-84.3	-73.3	0	0	0	113.4	I1528 I1529 K1534 Q1535 I1536 I1550 L1554	I1528-Y1532 HydrophobicContact CG2-CD2 3.83Å; I1528-Y1532 HydrophobicContact CG2-CE2 3.93Å; I1528-Y1532 WeakPolarHBondContact O-CD2 3.49Å; I1528-Y1532 PolarHBondContact O-N 2.99Å; I1529-Y1532 PolarHBondContact O-N 2.89Å; Y1532-K1534 VanDerWaalsContact C-N 3.33Å; Y1532-K1534 PolarHBondContact O-N 3.28Å; Y1532-Q1535 PolarHBondContact O-N 3.39Å; Y1532-Q1535 VanDerWaalsContact O-N 3.11Å; Y1532-I1536 WeakPolarHBondContact O-CG1 3.33Å; Y1532-I1536 PolarHBondContact O-N 3.3Å; Y1532-I1550 HydrophobicContact CD1-CG2 3.98Å; Y1532-I1550 HydrophobicContact CE1-CG2 3.95Å; Y1532-L1554 HydrophobicContact CD2-CD1 3.57Å; Y1532-L1554 HydrophobicContact CE2-CD1 3.63Å; Y1532-L1554 HydrophobicContact CG-CD1 4.06Å
1533	L	44.5	Very low	42.6	Very low	82 Å²	82	103.8 Å²	103.8	43%	0.429	51%	0.512	S	S	.	.	H	α-helix	trans	-57.6	-45	173	-79.2	166.5	0	0	0	111.8	I1529 Q1535 I1536 E1537	I1529-L1533 HydrophobicContact CG2-CD1 4.02Å; I1529-L1533 WeakPolarHBondContact O-CG 3.23Å; I1529-L1533 PolarHBondContact O-N 3.44Å; L1533-Q1535 VanDerWaalsContact C-N 3.28Å; L1533-Q1535 PolarHBondContact O-N 3.21Å; L1533-I1536 PolarHBondContact O-N 2.93Å; L1533-E1537 WeakPolarHBondContact O-CB 3.43Å; L1533-E1537 PolarHBondContact O-N 3.42Å
1534	K	47.1	Very low	43.2	Very low	128 Å²	128	101.8 Å²	101.8	56%	0.557	50%	0.502	S	S	*	.	H	α-helix	trans	-66.6	-24.6	175.9	-72.3	-178.3	176.8	-177.3	0	114	N1530 Q1531 Y1532 L1538	N1530-K1534 PolarHBondContact O-N 2.98Å; Q1531-K1534 PolarHBondContact O-N 3.25Å; Y1532-K1534 VanDerWaalsContact C-N 3.33Å; Y1532-K1534 PolarHBondContact O-N 3.28Å; K1534-L1538 WeakPolarHBondContact O-CD1 3.2Å; K1534-L1538 WeakPolarHBondContact O-CG 3.3Å
1535	Q	43.3	Very low	43.5	Very low	92 Å²	92	103.1 Å²	103.1	43%	0.43	51%	0.51	S	S	.	.	H	α-helix	trans	-77.6	-37.6	172.3	-69.3	178.2	13.3	0	0	111.9	Q1531 Y1532 L1533 E1537 L1538	Q1531-Q1535 WeakPolarHBondContact O-CG 3.47Å; Q1531-Q1535 PolarHBondContact O-N 3.36Å; Y1532-Q1535 PolarHBondContact O-N 3.39Å; Y1532-Q1535 VanDerWaalsContact O-N 3.11Å; L1533-Q1535 VanDerWaalsContact C-N 3.28Å; L1533-Q1535 PolarHBondContact O-N 3.21Å; Q1535-E1537 VanDerWaalsContact C-N 3.33Å; Q1535-L1538 PolarHBondContact O-N 3.05Å
1536	I	44.5	Very low	43.8	Very low	62 Å²	62	103.4 Å²	103.4	32%	0.318	51%	0.511	S	S	.	.	H	α-helix	trans	-64.1	-39.9	173.7	-67.9	165	0	0	0	110.6	Y1532 L1533 L1538 L1539	Y1532-I1536 WeakPolarHBondContact O-CG1 3.33Å; Y1532-I1536 PolarHBondContact O-N 3.3Å; L1533-I1536 PolarHBondContact O-N 2.93Å; I1536-L1538 PolarHBondContact O-N 3.1Å; I1536-L1539 PolarHBondContact O-N 2.88Å
1537	E	44.3	Very low	44.2	Very low	167 Å²	167	97.2 Å²	97.2	78%	0.78	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.5	177.1	-163	169.6	-126.7	0	0	113.7	L1533 Q1535	L1533-E1537 WeakPolarHBondContact O-CB 3.43Å; L1533-E1537 PolarHBondContact O-N 3.42Å; Q1535-E1537 VanDerWaalsContact C-N 3.33Å
1538	L	46.1	Very low	44.6	Very low	118 Å²	118	97.2 Å²	97.2	62%	0.618	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-4.3	175.9	-78.1	166.6	0	0	0	114.3	K1534 Q1535 I1536 S1540	K1534-L1538 WeakPolarHBondContact O-CD1 3.2Å; K1534-L1538 WeakPolarHBondContact O-CG 3.3Å; Q1535-L1538 PolarHBondContact O-N 3.05Å; I1536-L1538 PolarHBondContact O-N 3.1Å; L1538-S1540 PolarHBondContact O-N 3.29Å
1539	L	38.6	Very low	45.1	Very low	70 Å²	70	101 Å²	101	37%	0.366	50%	0.504	S	S	.	.			trans	-91.4	92.9	-176.1	-78.9	168.3	0	0	0	112.4	I1536 N1541 I1550	I1536-L1539 PolarHBondContact O-N 2.88Å; L1539-N1541 PolarHBondContact O-N 2.92Å; L1539-I1550 HydrophobicContact CD1-CD1 4.04Å
1540	S	37.6	Very low	45.6	Very low	94 Å²	94	98.9 Å²	98.9	66%	0.657	49%	0.493	S	S	*	.			trans	-69.1	93.9	179.2	59.3	0	0	0	0	113.7	L1538 Q1542	L1538-S1540 PolarHBondContact O-N 3.29Å; S1540-Q1542 VanDerWaalsContact C-N 3.26Å; S1540-Q1542 PolarHBondContact O-N 3.05Å
1541	N	38.7	Very low	45.5	Very low	138 Å²	138	99 Å²	99	74%	0.738	49%	0.491	S	S	*	.	S	Bend	trans	47.8	-1.9	153.6	-72.5	1.4	0	0	0	122	L1539	L1539-N1541 PolarHBondContact O-N 2.92Å
1542	Q	37.4	Very low	45.9	Very low	185 Å²	185	101.5 Å²	101.5	86%	0.864	50%	0.497	S	S	*	.	S	Bend	trans	-126.3	6.1	-165.4	-71.1	-164.1	-20.9	0	0	117.3	S1540	S1540-Q1542 VanDerWaalsContact C-N 3.26Å; S1540-Q1542 PolarHBondContact O-N 3.05Å
1543	N	47.5	Very low	46.5	Very low	90 Å²	90	103.3 Å²	103.3	48%	0.481	51%	0.507	S	S	.	.			trans	-146.5	76.5	-179.7	-133.8	-36.8	0	0	0	116.2	N1545 Q1546 L1547	N1543-N1545 PolarHBondContact O-N 3.29Å; N1543-N1545 VanDerWaalsContact O-N 3.13Å; N1543-Q1546 HydrophobicContact CB-CG 4.41Å; N1543-Q1546 PolarHBondContact O-N 2.93Å; N1543-Q1546 VanDerWaalsContact O-N 3.08Å; N1543-L1547 PolarHBondContact O-N 3.49Å
1544	M	43.6	Very low	46.8	Very low	95 Å²	95	101 Å²	101	47%	0.468	50%	0.495	S	S	.	.	H	α-helix	trans	-54.2	-29.6	176	-74.1	-71.4	-76.9	0	0	114	Q1546 L1547 M1548 Y1598	M1544-Q1546 PolarHBondContact O-N 3.02Å; M1544-L1547 PolarHBondContact O-N 3.23Å; M1544-L1547 HydrophobicContact SD-CD2 4.25Å; M1544-M1548 PolarHBondContact O-N 3.3Å; M1544-Y1598 HydrophobicContact CE-CD2 4Å
1545	N	48.4	Very low	46.9	Very low	131 Å²	131	100.1 Å²	100.1	70%	0.701	49%	0.492	S	S	*	.	H	α-helix	trans	-67.7	-33.2	178.7	-74	-23.4	0	0	0	112.7	N1543 K1549	N1543-N1545 PolarHBondContact O-N 3.29Å; N1543-N1545 VanDerWaalsContact O-N 3.13Å; N1545-K1549 PolarHBondContact O-N 2.96Å; N1545-K1549 VanDerWaalsContact O-N 3.07Å
1546	Q	50.6	Low	47.5	Very low	103 Å²	103	99.9 Å²	99.9	48%	0.481	49%	0.493	S	S	.	.	H	α-helix	trans	-70.7	-40.3	173.4	-70.9	179.7	-48.3	0	0	111	N1543 M1544 M1548 K1549 I1550	N1543-Q1546 HydrophobicContact CB-CG 4.41Å; N1543-Q1546 PolarHBondContact O-N 2.93Å; N1543-Q1546 VanDerWaalsContact O-N 3.08Å; M1544-Q1546 PolarHBondContact O-N 3.02Å; Q1546-M1548 VanDerWaalsContact C-N 3.35Å; Q1546-M1548 PolarHBondContact O-N 3.47Å; Q1546-K1549 PolarHBondContact O-N 3.34Å; Q1546-I1550 WeakPolarHBondContact O-CB 3.3Å; Q1546-I1550 VanDerWaalsContact O-CG1 3.3Å; Q1546-I1550 WeakPolarHBondContact O-CG1 3.49Å; Q1546-I1550 PolarHBondContact O-N 3.03Å
1547	L	49.6	Very low	48	Very low	48 Å²	48	101.3 Å²	101.3	25%	0.251	50%	0.498	S	S	.	.	H	α-helix	trans	-61.2	-41.4	175.4	-173.8	65.6	0	0	0	112.1	N1543 M1544 I1550 K1551	N1543-L1547 PolarHBondContact O-N 3.49Å; M1544-L1547 PolarHBondContact O-N 3.23Å; M1544-L1547 HydrophobicContact SD-CD2 4.25Å; L1547-I1550 PolarHBondContact O-N 2.67Å; L1547-K1551 PolarHBondContact O-N 2.72Å
1548	M	48.8	Very low	48.2	Very low	100 Å²	100	96.8 Å²	96.8	49%	0.493	48%	0.479	S	S	.	.	H	α-helix	trans	-68	-36.7	175.4	-75.1	-65.5	-73.8	0	0	113	M1544 Q1546 K1551 Y1552	M1544-M1548 PolarHBondContact O-N 3.3Å; Q1546-M1548 VanDerWaalsContact C-N 3.35Å; Q1546-M1548 PolarHBondContact O-N 3.47Å; M1548-K1551 PolarHBondContact O-N 3.34Å; M1548-Y1552 PolarHBondContact O-N 3.16Å; M1548-Y1552 VanDerWaalsContact O-N 3.09Å
1549	K	55.6	Low	48.4	Very low	127 Å²	127	94.5 Å²	94.5	55%	0.552	47%	0.466	S	S	*	.	H	α-helix	trans	-64.9	-45.2	174.1	-170.4	171.8	-173.3	-84	0	111.5	N1545 Q1546 K1551 Y1552 E1553	N1545-K1549 PolarHBondContact O-N 2.96Å; N1545-K1549 VanDerWaalsContact O-N 3.07Å; Q1546-K1549 PolarHBondContact O-N 3.34Å; K1549-K1551 VanDerWaalsContact C-N 3.35Å; K1549-K1551 PolarHBondContact O-N 2.99Å; K1549-Y1552 PolarHBondContact O-N 2.9Å; K1549-Y1552 VanDerWaalsContact O-N 3.1Å; K1549-E1553 WeakPolarHBondContact CE-OE1 3.32Å; K1549-E1553 IonicContact NZ-OE1 2.61Å; K1549-E1553 PolarHBondContact NZ-OE1 2.86Å; K1549-E1553 IonicContact NZ-OE2 3.91Å; K1549-E1553 PolarHBondContact O-N 3.25Å
1550	I	55.1	Low	49.2	Very low	37 Å²	37	96.1 Å²	96.1	19%	0.19	47%	0.472	C	S	.	.	H	α-helix	trans	-61.5	-41.1	175.9	-68.8	164.5	0	0	0	111	Y1532 L1539 Q1546 L1547 Y1552 E1553 L1554	Y1532-I1550 HydrophobicContact CD1-CG2 3.98Å; Y1532-I1550 HydrophobicContact CE1-CG2 3.95Å; L1539-I1550 HydrophobicContact CD1-CD1 4.04Å; Q1546-I1550 WeakPolarHBondContact O-CB 3.3Å; Q1546-I1550 VanDerWaalsContact O-CG1 3.3Å; Q1546-I1550 WeakPolarHBondContact O-CG1 3.49Å; Q1546-I1550 PolarHBondContact O-N 3.03Å; L1547-I1550 PolarHBondContact O-N 2.67Å; I1550-Y1552 VanDerWaalsContact C-N 3.33Å; I1550-Y1552 PolarHBondContact O-N 3.36Å; I1550-E1553 PolarHBondContact O-N 2.98Å; I1550-L1554 VanDerWaalsContact O-CB 3.25Å; I1550-L1554 WeakPolarHBondContact O-CB 3.49Å; I1550-L1554 PolarHBondContact O-N 3.48Å
1551	K	46.4	Very low	49.9	Very low	60 Å²	60	95.3 Å²	95.3	26%	0.261	46%	0.46	S	S	.	.	H	α-helix	trans	-59	-40.4	172.3	-84.9	-165.4	169.7	-169.9	0	112.7	L1547 M1548 K1549 F1555 L1590 N1591	L1547-K1551 PolarHBondContact O-N 2.72Å; M1548-K1551 PolarHBondContact O-N 3.34Å; K1549-K1551 VanDerWaalsContact C-N 3.35Å; K1549-K1551 PolarHBondContact O-N 2.99Å; K1551-F1555 VanDerWaalsContact O-CB 3.29Å; K1551-F1555 WeakPolarHBondContact O-CB 3.49Å; K1551-F1555 PolarHBondContact O-N 3.48Å; K1551-L1590 PolarHBondContact NZ-O 3.29Å; K1551-N1591 PolarHBondContact NZ-OD1 3.45Å
1552	Y	51.1	Low	50	Low	156 Å²	156	91.4 Å²	91.4	61%	0.612	44%	0.437	S	S	*	.	H	α-helix	trans	-70.7	-41.2	178.5	-106.6	-78.5	0	0	0	113.2	M1548 K1549 I1550 F1555 N1556	M1548-Y1552 PolarHBondContact O-N 3.16Å; M1548-Y1552 VanDerWaalsContact O-N 3.09Å; K1549-Y1552 PolarHBondContact O-N 2.9Å; K1549-Y1552 VanDerWaalsContact O-N 3.1Å; I1550-Y1552 VanDerWaalsContact C-N 3.33Å; I1550-Y1552 PolarHBondContact O-N 3.36Å; Y1552-F1555 PolarHBondContact O-N 3.49Å; Y1552-N1556 PolarHBondContact O-N 3Å; Y1552-N1556 PolarHBondContact O-ND2 3.41Å
1553	E	57.1	Low	50.6	Low	87 Å²	87	87.7 Å²	87.7	41%	0.407	42%	0.418	S	S	.	.	H	α-helix	trans	-65	-46.6	177.3	-72.5	168.5	167.3	0	0	110.7	K1549 I1550 F1555 N1556 E1557	K1549-E1553 WeakPolarHBondContact CE-OE1 3.32Å; K1549-E1553 IonicContact NZ-OE1 2.61Å; K1549-E1553 PolarHBondContact NZ-OE1 2.86Å; K1549-E1553 IonicContact NZ-OE2 3.91Å; K1549-E1553 PolarHBondContact O-N 3.25Å; I1550-E1553 PolarHBondContact O-N 2.98Å; E1553-F1555 PolarHBondContact O-N 3.43Å; E1553-N1556 PolarHBondContact O-N 2.9Å; E1553-E1557 WeakPolarHBondContact O-CB 3.43Å; E1553-E1557 PolarHBondContact O-N 2.97Å
1554	L	51.2	Low	50.5	Low	34 Å²	34	89.9 Å²	89.9	18%	0.178	42%	0.423	C	S	.	.	H	α-helix	trans	-59.4	-41.3	174.2	-175	72.7	0	0	0	112.7	I1528 Y1532 I1550 L1558	I1528-L1554 HydrophobicContact CG2-CD1 4.48Å; Y1532-L1554 HydrophobicContact CD2-CD1 3.57Å; Y1532-L1554 HydrophobicContact CE2-CD1 3.63Å; Y1532-L1554 HydrophobicContact CG-CD1 4.06Å; I1550-L1554 VanDerWaalsContact O-CB 3.25Å; I1550-L1554 WeakPolarHBondContact O-CB 3.49Å; I1550-L1554 PolarHBondContact O-N 3.48Å; L1554-L1558 HydrophobicContact CD1-CD1 4.47Å; L1554-L1558 HydrophobicContact CG-CD1 4.16Å; L1554-L1558 WeakPolarHBondContact O-CB 3.38Å; L1554-L1558 WeakPolarHBondContact O-CG 3.25Å; L1554-L1558 PolarHBondContact O-N 3.5Å
1555	F	49	Very low	50.5	Low	109 Å²	109	88.8 Å²	88.8	48%	0.478	42%	0.42	S	S	.	.	H	α-helix	trans	-63.6	-44.5	177.7	175.9	-96.9	0	0	0	111.9	K1551 Y1552 E1553 M1559	K1551-F1555 VanDerWaalsContact O-CB 3.29Å; K1551-F1555 WeakPolarHBondContact O-CB 3.49Å; K1551-F1555 PolarHBondContact O-N 3.48Å; Y1552-F1555 PolarHBondContact O-N 3.49Å; E1553-F1555 PolarHBondContact O-N 3.43Å; F1555-M1559 HydrophobicContact CE1-CG 4.2Å; F1555-M1559 HydrophobicContact CE2-CG 4.27Å; F1555-M1559 HydrophobicContact CZ-CG 4.02Å; F1555-M1559 WeakPolarHBondContact O-CB 3.14Å; F1555-M1559 WeakPolarHBondContact O-CG 3.29Å; F1555-M1559 PolarHBondContact O-N 2.93Å
1556	N	55.5	Low	50.2	Low	87 Å²	87	87.6 Å²	87.6	47%	0.465	41%	0.413	S	S	.	.	H	α-helix	trans	-66.6	-44.2	178.5	-71.2	-22	0	0	0	111.7	Y1552 E1553 L1558 M1559 E1560	Y1552-N1556 PolarHBondContact O-N 3Å; Y1552-N1556 PolarHBondContact O-ND2 3.41Å; E1553-N1556 PolarHBondContact O-N 2.9Å; N1556-L1558 PolarHBondContact O-N 3.43Å; N1556-M1559 PolarHBondContact O-N 3.42Å; N1556-M1559 VanDerWaalsContact O-N 3.15Å; N1556-E1560 PolarHBondContact O-N 3.04Å
1557	E	55.6	Low	49.7	Very low	91 Å²	91	90.5 Å²	90.5	43%	0.425	43%	0.428	S	S	.	.	H	α-helix	trans	-65.9	-38.4	179.9	-170.6	172.9	-145.5	0	0	112.4	E1553 N1561	E1553-E1557 WeakPolarHBondContact O-CB 3.43Å; E1553-E1557 PolarHBondContact O-N 2.97Å; E1557-N1561 WeakPolarHBondContact O-CB 3.43Å; E1557-N1561 PolarHBondContact O-N 3.5Å; E1557-N1561 PolarHBondContact O-ND2 2.93Å
1558	L	48.2	Very low	49.4	Very low	73 Å²	73	93.9 Å²	93.9	38%	0.382	45%	0.446	S	S	.	.	H	α-helix	trans	-65.3	-39.2	170.3	-79	168.6	0	0	0	112.2	L1554 N1556 F1562	L1554-L1558 HydrophobicContact CD1-CD1 4.47Å; L1554-L1558 HydrophobicContact CG-CD1 4.16Å; L1554-L1558 WeakPolarHBondContact O-CB 3.38Å; L1554-L1558 WeakPolarHBondContact O-CG 3.25Å; L1554-L1558 PolarHBondContact O-N 3.5Å; N1556-L1558 PolarHBondContact O-N 3.43Å; L1558-F1562 WeakPolarHBondContact O-CB 3.27Å; L1558-F1562 PolarHBondContact O-N 2.61Å
1559	M	51.2	Low	48.9	Very low	69 Å²	69	91.4 Å²	91.4	34%	0.34	44%	0.439	S	S	.	.	H	α-helix	trans	-72.6	-35	-179.6	-84.7	-56.2	-47.6	0	0	114.1	F1555 N1556 F1562 K1563	F1555-M1559 HydrophobicContact CE1-CG 4.2Å; F1555-M1559 HydrophobicContact CE2-CG 4.27Å; F1555-M1559 HydrophobicContact CZ-CG 4.02Å; F1555-M1559 WeakPolarHBondContact O-CB 3.14Å; F1555-M1559 WeakPolarHBondContact O-CG 3.29Å; F1555-M1559 PolarHBondContact O-N 2.93Å; N1556-M1559 PolarHBondContact O-N 3.42Å; N1556-M1559 VanDerWaalsContact O-N 3.15Å; M1559-F1562 HydrophobicContact CE-CB 4.43Å; M1559-F1562 HydrophobicContact CE-CD1 4.15Å; M1559-F1562 WeakPolarHBondContact O-CB 3.26Å; M1559-F1562 PolarHBondContact O-N 3.04Å; M1559-F1562 HydrophobicContact SD-CB 4.38Å; M1559-K1563 WeakPolarHBondContact O-CG 3.39Å; M1559-K1563 PolarHBondContact O-N 3.45Å
1560	E	55.6	Low	47.9	Very low	105 Å²	105	95.1 Å²	95.1	49%	0.491	46%	0.455	S	S	.	.	H	α-helix	trans	-69	-40.7	172.4	-68.3	-51	133.8	0	0	111.4	N1556 F1562 K1563 F1564	N1556-E1560 PolarHBondContact O-N 3.04Å; E1560-F1562 VanDerWaalsContact C-N 3.26Å; E1560-F1562 PolarHBondContact O-N 3.42Å; E1560-K1563 PolarHBondContact O-N 3.1Å; E1560-K1563 WeakPolarHBondContact OE1-CE 3.44Å; E1560-K1563 IonicContact OE1-NZ 2.65Å; E1560-K1563 PolarHBondContact OE1-NZ 3.09Å; E1560-K1563 WeakPolarHBondContact OE2-CD 3.48Å; E1560-K1563 IonicContact OE2-NZ 3.64Å; E1560-F1564 WeakPolarHBondContact O-CB 3.39Å; E1560-F1564 PolarHBondContact O-N 3.03Å
1561	N	50.6	Low	47	Very low	77 Å²	77	100.5 Å²	100.5	41%	0.412	48%	0.484	S	S	.	.	H	α-helix	trans	-59.6	-37.1	169.4	-83.6	-75	0	0	0	112	E1557 N1565	E1557-N1561 WeakPolarHBondContact O-CB 3.43Å; E1557-N1561 PolarHBondContact O-N 3.5Å; E1557-N1561 PolarHBondContact O-ND2 2.93Å; N1561-N1565 PolarHBondContact O-N 3.39Å; N1561-N1565 PolarHBondContact O-ND2 3.46Å
1562	F	42.7	Very low	46.8	Very low	56 Å²	56	103.7 Å²	103.7	25%	0.246	50%	0.498	C	S	.	.	H	α-helix	trans	-67.6	-44.6	175.7	-167.6	-93	0	0	0	112.2	L1558 M1559 E1560 F1564 N1565 L1566 Y1580 I1583	L1558-F1562 WeakPolarHBondContact O-CB 3.27Å; L1558-F1562 PolarHBondContact O-N 2.61Å; M1559-F1562 HydrophobicContact CE-CB 4.43Å; M1559-F1562 HydrophobicContact CE-CD1 4.15Å; M1559-F1562 WeakPolarHBondContact O-CB 3.26Å; M1559-F1562 PolarHBondContact O-N 3.04Å; M1559-F1562 HydrophobicContact SD-CB 4.38Å; E1560-F1562 VanDerWaalsContact C-N 3.26Å; E1560-F1562 PolarHBondContact O-N 3.42Å; F1562-F1564 PolarHBondContact O-N 2.87Å; F1562-N1565 PolarHBondContact O-N 2.95Å; F1562-L1566 WeakPolarHBondContact O-CB 3.44Å; F1562-L1566 PolarHBondContact O-N 3Å; F1562-Y1580 HydrophobicContact CZ-CD2 4.12Å; F1562-I1583 HydrophobicContact CD2-CD1 3.97Å; F1562-I1583 HydrophobicContact CE2-CD1 4.11Å
1563	K	48.6	Very low	46.2	Very low	106 Å²	106	104.1 Å²	104.1	46%	0.461	50%	0.504	S	S	.	.	H	α-helix	trans	-59.2	-44.1	173.7	-76.3	172.3	178.6	174.3	0	112.4	M1559 E1560 N1565 L1566 M1567	M1559-K1563 WeakPolarHBondContact O-CG 3.39Å; M1559-K1563 PolarHBondContact O-N 3.45Å; E1560-K1563 PolarHBondContact O-N 3.1Å; E1560-K1563 WeakPolarHBondContact OE1-CE 3.44Å; E1560-K1563 IonicContact OE1-NZ 2.65Å; E1560-K1563 PolarHBondContact OE1-NZ 3.09Å; E1560-K1563 WeakPolarHBondContact OE2-CD 3.48Å; E1560-K1563 IonicContact OE2-NZ 3.64Å; K1563-N1565 VanDerWaalsContact C-N 3.31Å; K1563-N1565 PolarHBondContact O-N 3.5Å; K1563-L1566 WeakPolarHBondContact O-CB 3.29Å; K1563-L1566 PolarHBondContact O-N 3.26Å; K1563-L1566 VanDerWaalsContact O-N 3.1Å; K1563-M1567 PolarHBondContact O-N 2.96Å
1564	F	46.7	Very low	45.6	Very low	137 Å²	137	106.3 Å²	106.3	60%	0.601	52%	0.518	S	S	*	.	H	α-helix	trans	-62.1	-39.2	179.1	-170.8	-97.9	0	0	0	111.9	E1560 F1562 N1568	E1560-F1564 WeakPolarHBondContact O-CB 3.39Å; E1560-F1564 PolarHBondContact O-N 3.03Å; F1562-F1564 PolarHBondContact O-N 2.87Å; F1564-N1568 PolarHBondContact O-ND2 3.43Å
1565	N	42.9	Very low	45.4	Very low	72 Å²	72	110.2 Å²	110.2	39%	0.385	54%	0.535	S	S	.	.	H	α-helix	trans	-72.2	-28.6	173.4	-78.1	-78.4	0	0	0	113.3	N1561 F1562 K1563	N1561-N1565 PolarHBondContact O-N 3.39Å; N1561-N1565 PolarHBondContact O-ND2 3.46Å; F1562-N1565 PolarHBondContact O-N 2.95Å; K1563-N1565 VanDerWaalsContact C-N 3.31Å; K1563-N1565 PolarHBondContact O-N 3.5Å
1566	L	41.1	Very low	45	Very low	106 Å²	106	107.8 Å²	107.8	56%	0.555	53%	0.525	S	S	*	.	H	α-helix	trans	-69.3	-36.8	176.1	-166.2	72.5	0	0	0	112.4	F1562 K1563 N1568	F1562-L1566 WeakPolarHBondContact O-CB 3.44Å; F1562-L1566 PolarHBondContact O-N 3Å; K1563-L1566 WeakPolarHBondContact O-CB 3.29Å; K1563-L1566 PolarHBondContact O-N 3.26Å; K1563-L1566 VanDerWaalsContact O-N 3.1Å; L1566-N1568 PolarHBondContact O-N 3.43Å
1567	M	41.5	Very low	44.5	Very low	163 Å²	163	109.7 Å²	109.7	80%	0.803	53%	0.529	S	S	*	.	H	α-helix	trans	-61.2	-40	176	-81.4	-71.4	-152.6	0	0	113	K1563	K1563-M1567 PolarHBondContact O-N 2.96Å
1568	N	43.7	Very low	44.2	Very low	119 Å²	119	110.8 Å²	110.8	64%	0.636	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	4.6	-163.6	-75	-30.7	0	0	0	115.8	F1564 L1566	F1564-N1568 PolarHBondContact O-ND2 3.43Å; L1566-N1568 PolarHBondContact O-N 3.43Å
1569	S	38.1	Very low	44.1	Very low	49 Å²	49	111.3 Å²	111.3	34%	0.343	54%	0.537	S	S	.	.			trans	-155	93.6	-175.4	174.9	0	0	0	0	114.3	N1571 F1576	S1569-N1571 PolarHBondContact O-N 3.01Å; S1569-F1576 WeakPolarHBondContact O-CE2 3.43Å
1570	K	34.5	Very low	43.9	Very low	204 Å²	204	114 Å²	114	89%	0.887	54%	0.544	S	S	*	.	S	Bend	trans	-76.9	-11.3	177.6	-79.4	-176.1	173.2	177.8	0	115.5
1571	N	35.6	Very low	43.7	Very low	151 Å²	151	111.6 Å²	111.6	81%	0.807	53%	0.534	S	S	*	.	S	Bend	trans	-114	14.7	-159.5	-75.7	1.7	0	0	0	117.4	S1569	S1569-N1571 PolarHBondContact O-N 3.01Å
1572	K	42	Very low	43.7	Very low	126 Å²	126	112.4 Å²	112.4	55%	0.548	54%	0.536	S	S	.	.			trans	-136.3	48.9	-178.5	-72.8	-165.1	175.5	-178.2	0	116.5	N1574 Q1575 F1576	K1572-N1574 VanDerWaalsContact C-N 3.3Å; K1572-N1574 PolarHBondContact O-N 3.08Å; K1572-N1574 VanDerWaalsContact O-N 3.08Å; K1572-Q1575 HydrophobicContact CB-CB 4.36Å; K1572-Q1575 PolarHBondContact O-N 3Å; K1572-F1576 VanDerWaalsContact O-CD2 3.26Å; K1572-F1576 WeakPolarHBondContact O-CD2 3.43Å; K1572-F1576 PolarHBondContact O-N 3.19Å
1573	F	38.8	Very low	43.9	Very low	166 Å²	166	112.7 Å²	112.7	73%	0.728	54%	0.539	S	S	*	.	H	α-helix	trans	-42.2	-46	-179.1	-168.8	-102.7	0	0	0	115.6	Q1575 F1576 K1577	F1573-Q1575 VanDerWaalsContact C-N 3.33Å; F1573-Q1575 PolarHBondContact O-N 2.73Å; F1573-F1576 PolarHBondContact O-N 3.33Å; F1573-K1577 PolarHBondContact O-N 3.46Å
1574	N	43.7	Very low	44	Very low	132 Å²	132	111.6 Å²	111.6	71%	0.706	54%	0.538	S	S	*	.	H	α-helix	trans	-68.7	-25.5	-178.2	-77.3	-25.2	0	0	0	114.4	K1572	K1572-N1574 VanDerWaalsContact C-N 3.3Å; K1572-N1574 PolarHBondContact O-N 3.08Å; K1572-N1574 VanDerWaalsContact O-N 3.08Å
1575	Q	48.2	Very low	43.9	Very low	116 Å²	116	111.2 Å²	111.2	54%	0.542	54%	0.536	S	S	.	.	H	α-helix	trans	-80.7	-38.3	178.3	-159.4	162.8	3.1	0	0	110.4	K1572 F1573 K1577 Q1578 N1579	K1572-Q1575 HydrophobicContact CB-CB 4.36Å; K1572-Q1575 PolarHBondContact O-N 3Å; F1573-Q1575 VanDerWaalsContact C-N 3.33Å; F1573-Q1575 PolarHBondContact O-N 2.73Å; Q1575-K1577 VanDerWaalsContact C-N 3.32Å; Q1575-K1577 PolarHBondContact O-N 2.96Å; Q1575-Q1578 PolarHBondContact O-N 3.21Å; Q1575-N1579 PolarHBondContact O-N 3.45Å; Q1575-N1579 PolarHBondContact O-OD1 3.14Å
1576	F	39.4	Very low	44.1	Very low	59 Å²	59	111 Å²	111	26%	0.259	54%	0.537	S	S	.	.	H	α-helix	trans	-58.5	-40.4	171	-69.5	-68	0	0	0	113.1	S1569 K1572 F1573 Q1578 N1579 Y1580	S1569-F1576 WeakPolarHBondContact O-CE2 3.43Å; K1572-F1576 VanDerWaalsContact O-CD2 3.26Å; K1572-F1576 WeakPolarHBondContact O-CD2 3.43Å; K1572-F1576 PolarHBondContact O-N 3.19Å; F1573-F1576 PolarHBondContact O-N 3.33Å; F1576-Q1578 VanDerWaalsContact C-N 3.29Å; F1576-Q1578 PolarHBondContact O-N 3.46Å; F1576-N1579 PolarHBondContact O-N 3.04Å; F1576-Y1580 WeakPolarHBondContact O-CB 3.36Å; F1576-Y1580 PolarHBondContact O-N 2.73Å
1577	K	46.4	Very low	44.4	Very low	127 Å²	127	109 Å²	109	55%	0.552	53%	0.527	S	S	*	.	H	α-helix	trans	-60.7	-34.9	179.9	-171.6	169.7	-178.3	174	0	113	F1573 Q1575 I1581	F1573-K1577 PolarHBondContact O-N 3.46Å; Q1575-K1577 VanDerWaalsContact C-N 3.32Å; Q1575-K1577 PolarHBondContact O-N 2.96Å; K1577-I1581 HydrophobicContact CG-CD1 4.16Å; K1577-I1581 WeakPolarHBondContact O-CD1 3.26Å; K1577-I1581 WeakPolarHBondContact O-CG1 3.33Å; K1577-I1581 PolarHBondContact O-N 3.36Å
1578	Q	49.6	Very low	44.7	Very low	114 Å²	114	106.3 Å²	106.3	53%	0.533	51%	0.512	S	S	.	.	H	α-helix	trans	-74.2	-47.2	176.6	-68.9	-64.6	-7.5	0	0	111.9	Q1575 F1576 Y1580 I1581 E1582	Q1575-Q1578 PolarHBondContact O-N 3.21Å; F1576-Q1578 VanDerWaalsContact C-N 3.29Å; F1576-Q1578 PolarHBondContact O-N 3.46Å; Q1578-Y1580 VanDerWaalsContact C-N 3.27Å; Q1578-Y1580 PolarHBondContact O-N 2.84Å; Q1578-I1581 WeakPolarHBondContact O-CA 3.35Å; Q1578-I1581 WeakPolarHBondContact O-CB 3.4Å; Q1578-I1581 PolarHBondContact O-N 3.37Å; Q1578-E1582 PolarHBondContact O-N 3.32Å
1579	N	46.1	Very low	45	Very low	84 Å²	84	106.9 Å²	106.9	45%	0.449	51%	0.509	S	S	.	.	H	α-helix	trans	-58.7	-40.3	177.9	-66.1	24.1	0	0	0	111.5	Q1575 F1576 I1581 E1582 I1583	Q1575-N1579 PolarHBondContact O-N 3.45Å; Q1575-N1579 PolarHBondContact O-OD1 3.14Å; F1576-N1579 PolarHBondContact O-N 3.04Å; N1579-I1581 PolarHBondContact O-N 3.42Å; N1579-E1582 PolarHBondContact O-N 3.3Å; N1579-I1583 VanDerWaalsContact O-CG1 3.32Å; N1579-I1583 WeakPolarHBondContact O-CG1 3.44Å; N1579-I1583 PolarHBondContact O-N 3.23Å
1580	Y	46.1	Very low	45.3	Very low	125 Å²	125	107.3 Å²	107.3	49%	0.49	51%	0.507	S	S	.	.	H	α-helix	trans	-62.4	-40	174.2	-175.6	-107.6	0	0	0	112.7	F1562 F1576 Q1578 I1583 L1584	F1562-Y1580 HydrophobicContact CZ-CD2 4.12Å; F1576-Y1580 WeakPolarHBondContact O-CB 3.36Å; F1576-Y1580 PolarHBondContact O-N 2.73Å; Q1578-Y1580 VanDerWaalsContact C-N 3.27Å; Q1578-Y1580 PolarHBondContact O-N 2.84Å; Y1580-I1583 PolarHBondContact O-N 3.35Å; Y1580-L1584 HydrophobicContact CD1-CD1 3.92Å; Y1580-L1584 HydrophobicContact CE1-CD1 3.52Å; Y1580-L1584 HydrophobicContact CE1-CG 4.32Å; Y1580-L1584 WeakPolarHBondContact O-CG 3.17Å; Y1580-L1584 PolarHBondContact O-N 2.95Å
1581	I	52.1	Low	46	Very low	54 Å²	54	100.5 Å²	100.5	28%	0.277	48%	0.481	S	S	.	.	H	α-helix	trans	-67.6	-35.9	175.4	-73.1	167.2	0	0	0	111.8	K1577 Q1578 N1579 K1585	K1577-I1581 HydrophobicContact CG-CD1 4.16Å; K1577-I1581 WeakPolarHBondContact O-CD1 3.26Å; K1577-I1581 WeakPolarHBondContact O-CG1 3.33Å; K1577-I1581 PolarHBondContact O-N 3.36Å; Q1578-I1581 WeakPolarHBondContact O-CA 3.35Å; Q1578-I1581 WeakPolarHBondContact O-CB 3.4Å; Q1578-I1581 PolarHBondContact O-N 3.37Å; N1579-I1581 PolarHBondContact O-N 3.42Å; I1581-K1585 HydrophobicContact CG2-CD 4.11Å; I1581-K1585 WeakPolarHBondContact O-CB 3.48Å; I1581-K1585 VanDerWaalsContact O-CG 3.26Å; I1581-K1585 WeakPolarHBondContact O-CG 3.42Å; I1581-K1585 PolarHBondContact O-N 2.89Å
1582	E	50.2	Low	46.6	Very low	95 Å²	95	97.5 Å²	97.5	44%	0.444	46%	0.464	S	S	.	.	H	α-helix	trans	-72.2	-36.6	175.5	-66	-157.4	131.7	0	0	112.7	Q1578 N1579 K1585 T1586	Q1578-E1582 PolarHBondContact O-N 3.32Å; N1579-E1582 PolarHBondContact O-N 3.3Å; E1582-K1585 PolarHBondContact O-N 3.39Å; E1582-T1586 WeakPolarHBondContact O-CB 3.36Å; E1582-T1586 PolarHBondContact O-N 2.8Å; E1582-T1586 PolarHBondContact O-OG1 3.04Å
1583	I	47	Very low	47.3	Very low	62 Å²	62	94.8 Å²	94.8	32%	0.318	45%	0.454	S	S	.	.	H	α-helix	trans	-59.8	-50.2	170.5	-70.2	164.9	0	0	0	110.2	F1562 N1579 Y1580 K1585 T1586 I1587	F1562-I1583 HydrophobicContact CD2-CD1 3.97Å; F1562-I1583 HydrophobicContact CE2-CD1 4.11Å; N1579-I1583 VanDerWaalsContact O-CG1 3.32Å; N1579-I1583 WeakPolarHBondContact O-CG1 3.44Å; N1579-I1583 PolarHBondContact O-N 3.23Å; Y1580-I1583 PolarHBondContact O-N 3.35Å; I1583-K1585 PolarHBondContact O-N 2.85Å; I1583-T1586 PolarHBondContact O-N 2.77Å; I1583-T1586 VanDerWaalsContact O-N 3.13Å; I1583-I1587 HydrophobicContact CG2-CD1 3.78Å; I1583-I1587 HydrophobicContact CG2-CG1 4.5Å; I1583-I1587 WeakPolarHBondContact O-CG1 3.42Å; I1583-I1587 PolarHBondContact O-N 3.44Å
1584	L	50	Low	47.5	Very low	83 Å²	83	88.3 Å²	88.3	44%	0.435	43%	0.431	S	S	.	.	H	α-helix	trans	-59.4	-42.6	177.7	-74.5	174.9	0	0	0	112.8	Y1580 T1586 I1587 Q1588	Y1580-L1584 HydrophobicContact CD1-CD1 3.92Å; Y1580-L1584 HydrophobicContact CE1-CD1 3.52Å; Y1580-L1584 HydrophobicContact CE1-CG 4.32Å; Y1580-L1584 WeakPolarHBondContact O-CG 3.17Å; Y1580-L1584 PolarHBondContact O-N 2.95Å; L1584-T1586 VanDerWaalsContact C-N 3.32Å; L1584-T1586 PolarHBondContact O-N 3.24Å; L1584-I1587 PolarHBondContact O-N 2.72Å; L1584-Q1588 WeakPolarHBondContact O-CB 3.32Å; L1584-Q1588 PolarHBondContact O-N 3.27Å
1585	K	44.9	Very low	47.7	Very low	129 Å²	129	88.7 Å²	88.7	56%	0.561	43%	0.428	S	S	*	.	H	α-helix	trans	-62.9	-37.2	175.2	-74.9	167.3	-179.3	171.1	0	112.6	I1581 E1582 I1583 Q1588 F1589	I1581-K1585 HydrophobicContact CG2-CD 4.11Å; I1581-K1585 WeakPolarHBondContact O-CB 3.48Å; I1581-K1585 VanDerWaalsContact O-CG 3.26Å; I1581-K1585 WeakPolarHBondContact O-CG 3.42Å; I1581-K1585 PolarHBondContact O-N 2.89Å; E1582-K1585 PolarHBondContact O-N 3.39Å; I1583-K1585 PolarHBondContact O-N 2.85Å; K1585-Q1588 PolarHBondContact O-N 2.97Å; K1585-F1589 PolarHBondContact O-N 2.95Å
1586	T	47.4	Very low	47.9	Very low	67 Å²	67	90.3 Å²	90.3	41%	0.411	43%	0.43	S	S	.	.	H	α-helix	trans	-71.4	-40.5	179.5	-52.8	0	0	0	0	110.9	E1582 I1583 L1584 F1589 L1590	E1582-T1586 WeakPolarHBondContact O-CB 3.36Å; E1582-T1586 PolarHBondContact O-N 2.8Å; E1582-T1586 PolarHBondContact O-OG1 3.04Å; I1583-T1586 PolarHBondContact O-N 2.77Å; I1583-T1586 VanDerWaalsContact O-N 3.13Å; L1584-T1586 VanDerWaalsContact C-N 3.32Å; L1584-T1586 PolarHBondContact O-N 3.24Å; T1586-F1589 PolarHBondContact O-N 2.98Å; T1586-L1590 HydrophobicContact CG2-CD1 4.23Å; T1586-L1590 WeakPolarHBondContact O-CB 3.49Å; T1586-L1590 WeakPolarHBondContact O-CG 3.15Å; T1586-L1590 PolarHBondContact O-N 3.5Å
1587	I	47.2	Very low	48.4	Very low	64 Å²	64	92.3 Å²	92.3	33%	0.328	44%	0.439	S	S	.	.	H	α-helix	trans	-63	-42	172.8	-67.5	168.3	0	0	0	111	I1583 L1584 L1590 N1591	I1583-I1587 HydrophobicContact CG2-CD1 3.78Å; I1583-I1587 HydrophobicContact CG2-CG1 4.5Å; I1583-I1587 WeakPolarHBondContact O-CG1 3.42Å; I1583-I1587 PolarHBondContact O-N 3.44Å; L1584-I1587 PolarHBondContact O-N 2.72Å; I1587-L1590 PolarHBondContact O-N 2.97Å; I1587-N1591 PolarHBondContact O-N 3.41Å; I1587-N1591 VanDerWaalsContact O-N 3.09Å
1588	Q	48.9	Very low	48.4	Very low	107 Å²	107	92.6 Å²	92.6	50%	0.5	44%	0.437	S	S	.	.	H	α-helix	trans	-60.1	-50.1	175.5	-173.2	63.4	47.2	0	0	111.2	L1584 K1585 L1590 N1591 D1592	L1584-Q1588 WeakPolarHBondContact O-CB 3.32Å; L1584-Q1588 PolarHBondContact O-N 3.27Å; K1585-Q1588 PolarHBondContact O-N 2.97Å; Q1588-L1590 VanDerWaalsContact C-N 3.34Å; Q1588-L1590 PolarHBondContact O-N 2.9Å; Q1588-N1591 CarbonylContact O-C 3.55Å; Q1588-N1591 WeakPolarHBondContact O-CA 3.49Å; Q1588-N1591 WeakPolarHBondContact O-CB 3.42Å; Q1588-N1591 PolarHBondContact O-N 3.32Å; Q1588-D1592 PolarHBondContact NE2-OD1 3.43Å; Q1588-D1592 VanDerWaalsContact O-CG 3.28Å; Q1588-D1592 PolarHBondContact O-N 3.19Å
1589	F	48.3	Very low	48.6	Very low	131 Å²	131	94.8 Å²	94.8	58%	0.575	44%	0.442	S	S	*	.	H	α-helix	trans	-57.9	-43.2	178.4	-174	-90.1	0	0	0	112.6	K1585 T1586 N1591 D1592 E1593	K1585-F1589 PolarHBondContact O-N 2.95Å; T1586-F1589 PolarHBondContact O-N 2.98Å; F1589-N1591 PolarHBondContact O-N 3.15Å; F1589-D1592 PolarHBondContact O-N 3.01Å; F1589-E1593 PolarHBondContact O-N 2.7Å
1590	L	45.3	Very low	49.2	Very low	57 Å²	57	95.1 Å²	95.1	30%	0.298	44%	0.441	S	S	.	.	H	α-helix	trans	-70.8	-11.6	176.2	-69.3	170.8	0	0	0	114.1	K1551 T1586 I1587 Q1588 A1594	K1551-L1590 PolarHBondContact NZ-O 3.29Å; T1586-L1590 HydrophobicContact CG2-CD1 4.23Å; T1586-L1590 WeakPolarHBondContact O-CB 3.49Å; T1586-L1590 WeakPolarHBondContact O-CG 3.15Å; T1586-L1590 PolarHBondContact O-N 3.5Å; I1587-L1590 PolarHBondContact O-N 2.97Å; Q1588-L1590 VanDerWaalsContact C-N 3.34Å; Q1588-L1590 PolarHBondContact O-N 2.9Å; L1590-A1594 WeakPolarHBondContact O-CB 3.23Å
1591	N	49	Very low	49.6	Very low	62 Å²	62	92.9 Å²	92.9	33%	0.332	44%	0.437	S	S	.	.	H	α-helix	trans	-93.4	-40.7	169	-75.1	-18.6	0	0	0	111.3	K1551 I1587 Q1588 F1589 A1594 H1595	K1551-N1591 PolarHBondContact NZ-OD1 3.45Å; I1587-N1591 PolarHBondContact O-N 3.41Å; I1587-N1591 VanDerWaalsContact O-N 3.09Å; Q1588-N1591 CarbonylContact O-C 3.55Å; Q1588-N1591 WeakPolarHBondContact O-CA 3.49Å; Q1588-N1591 WeakPolarHBondContact O-CB 3.42Å; Q1588-N1591 PolarHBondContact O-N 3.32Å; F1589-N1591 PolarHBondContact O-N 3.15Å; N1591-A1594 PolarHBondContact O-N 3.37Å; N1591-H1595 WeakPolarHBondContact O-CB 3.37Å; N1591-H1595 PolarHBondContact O-CD2 3.46Å; N1591-H1595 VanDerWaalsContact O-CD2 3.24Å; N1591-H1595 PolarHBondContact O-N 2.96Å
1592	D	48.9	Very low	49.5	Very low	87 Å²	87	92.7 Å²	92.7	47%	0.465	44%	0.44	S	S	.	.	H	α-helix	trans	-61.6	-45.2	176.6	-62.8	-21.6	0	0	0	111.4	Q1588 F1589 A1594 H1595 Y1596	Q1588-D1592 PolarHBondContact NE2-OD1 3.43Å; Q1588-D1592 VanDerWaalsContact O-CG 3.28Å; Q1588-D1592 PolarHBondContact O-N 3.19Å; F1589-D1592 PolarHBondContact O-N 3.01Å; D1592-A1594 PolarHBondContact O-N 3.35Å; D1592-H1595 PolarHBondContact O-N 3.13Å; D1592-Y1596 PolarHBondContact O-N 3.02Å
1593	E	55.1	Low	49.9	Very low	69 Å²	69	91.1 Å²	91.1	32%	0.322	43%	0.434	S	S	.	.	H	α-helix	trans	-66.8	-36.4	176.2	-165.4	-170.7	147.3	0	0	112.1	F1589 Y1596 K1597	F1589-E1593 PolarHBondContact O-N 2.7Å; E1593-Y1596 PolarHBondContact O-N 3.02Å; E1593-K1597 PolarHBondContact O-N 3.06Å; E1593-K1597 VanDerWaalsContact OE1-CE 3.29Å; E1593-K1597 WeakPolarHBondContact OE1-CE 3.2Å; E1593-K1597 IonicContact OE1-NZ 2.88Å; E1593-K1597 PolarHBondContact OE1-NZ 3.28Å
1594	A	44.3	Very low	50.7	Low	30 Å²	30	92 Å²	92	25%	0.248	44%	0.44	C	S	.	.	H	α-helix	trans	-68.8	-38.2	175.7	0	0	0	0	0	111.9	L1590 N1591 D1592 Y1598	L1590-A1594 WeakPolarHBondContact O-CB 3.23Å; N1591-A1594 PolarHBondContact O-N 3.37Å; D1592-A1594 PolarHBondContact O-N 3.35Å; A1594-Y1598 VanDerWaalsContact O-CB 3.25Å; A1594-Y1598 WeakPolarHBondContact O-CB 3.22Å; A1594-Y1598 PolarHBondContact O-N 3.43Å
1595	H	47.3	Very low	51.2	Low	140 Å²	140	95.7 Å²	95.7	65%	0.648	45%	0.449	S	S	*	.	H	α-helix	trans	-65.2	-39.2	172	-87.4	-124.3	0	0	0	111.6	N1591 D1592 Y1598 Y1599	N1591-H1595 WeakPolarHBondContact O-CB 3.37Å; N1591-H1595 PolarHBondContact O-CD2 3.46Å; N1591-H1595 VanDerWaalsContact O-CD2 3.24Å; N1591-H1595 PolarHBondContact O-N 2.96Å; D1592-H1595 PolarHBondContact O-N 3.13Å; H1595-Y1598 PolarHBondContact O-N 3.39Å; H1595-Y1599 VanDerWaalsContact O-CB 3.31Å; H1595-Y1599 WeakPolarHBondContact O-CB 3.16Å; H1595-Y1599 PolarHBondContact O-N 3.09Å
1596	Y	52.1	Low	52	Low	151 Å²	151	95.2 Å²	95.2	59%	0.592	45%	0.447	S	S	*	.	H	α-helix	trans	-61.4	-52.4	174.7	-178.6	-90.1	0	0	0	111.7	D1592 E1593 Y1598 Y1599 E1600	D1592-Y1596 PolarHBondContact O-N 3.02Å; E1593-Y1596 PolarHBondContact O-N 3.02Å; Y1596-Y1598 VanDerWaalsContact C-N 3.31Å; Y1596-Y1598 PolarHBondContact O-N 3.26Å; Y1596-Y1599 WeakPolarHBondContact O-CB 3.19Å; Y1596-Y1599 PolarHBondContact O-N 3.36Å; Y1596-Y1599 VanDerWaalsContact O-N 3.16Å; Y1596-E1600 WeakPolarHBondContact O-CB 3.35Å; Y1596-E1600 PolarHBondContact O-N 3.2Å
1597	K	50.1	Low	52.9	Low	100 Å²	100	95.1 Å²	95.1	44%	0.435	44%	0.444	S	S	.	.	H	α-helix	trans	-65.8	-32.4	179.1	-69.7	-179.9	-177.3	169.4	0	112.6	E1593 L1601	E1593-K1597 PolarHBondContact O-N 3.06Å; E1593-K1597 VanDerWaalsContact OE1-CE 3.29Å; E1593-K1597 WeakPolarHBondContact OE1-CE 3.2Å; E1593-K1597 IonicContact OE1-NZ 2.88Å; E1593-K1597 PolarHBondContact OE1-NZ 3.28Å; K1597-L1601 WeakPolarHBondContact O-CB 3.34Å; K1597-L1601 PolarHBondContact O-N 3.11Å
1598	Y	47	Very low	54	Low	133 Å²	133	97 Å²	97	52%	0.522	46%	0.455	S	S	.	.	H	α-helix	trans	-66.7	-44	171.1	179.9	-104.2	0	0	0	112.1	M1544 A1594 H1595 Y1596 E1600 L1601 C1602	M1544-Y1598 HydrophobicContact CE-CD2 4Å; A1594-Y1598 VanDerWaalsContact O-CB 3.25Å; A1594-Y1598 WeakPolarHBondContact O-CB 3.22Å; A1594-Y1598 PolarHBondContact O-N 3.43Å; H1595-Y1598 PolarHBondContact O-N 3.39Å; Y1596-Y1598 VanDerWaalsContact C-N 3.31Å; Y1596-Y1598 PolarHBondContact O-N 3.26Å; Y1598-E1600 VanDerWaalsContact C-N 3.35Å; Y1598-E1600 PolarHBondContact O-N 2.85Å; Y1598-L1601 PolarHBondContact O-N 3.21Å; Y1598-C1602 WeakPolarHBondContact O-CB 3.5Å; Y1598-C1602 PolarHBondContact O-N 3.03Å; Y1598-C1602 PolarHBondContact O-SG 2.95Å; Y1598-C1602 VanDerWaalsContact O-SG 3.39Å
1599	Y	52.8	Low	54.9	Low	160 Å²	160	95.8 Å²	95.8	63%	0.627	45%	0.451	S	S	*	.	H	α-helix	trans	-61.5	-42.4	175.5	-180	-94.9	0	0	0	111.8	H1595 Y1596 C1602 N1603	H1595-Y1599 VanDerWaalsContact O-CB 3.31Å; H1595-Y1599 WeakPolarHBondContact O-CB 3.16Å; H1595-Y1599 PolarHBondContact O-N 3.09Å; Y1596-Y1599 WeakPolarHBondContact O-CB 3.19Å; Y1596-Y1599 PolarHBondContact O-N 3.36Å; Y1596-Y1599 VanDerWaalsContact O-N 3.16Å; Y1599-C1602 PolarHBondContact O-N 3.24Å; Y1599-N1603 WeakPolarHBondContact O-CB 3.36Å; Y1599-N1603 PolarHBondContact O-N 3.22Å
1600	E	59.5	Low	55.9	Low	92 Å²	92	92.2 Å²	92.2	43%	0.43	44%	0.437	S	S	.	.	H	α-helix	trans	-60.9	-45.6	173.8	-176	173.6	-156.3	0	0	111.9	Y1596 Y1598 N1603 N1604	Y1596-E1600 WeakPolarHBondContact O-CB 3.35Å; Y1596-E1600 PolarHBondContact O-N 3.2Å; Y1598-E1600 VanDerWaalsContact C-N 3.35Å; Y1598-E1600 PolarHBondContact O-N 2.85Å; E1600-N1603 PolarHBondContact O-N 2.93Å; E1600-N1604 WeakPolarHBondContact O-CB 3.37Å; E1600-N1604 PolarHBondContact O-N 3.14Å; E1600-N1604 PolarHBondContact O-ND2 3.28Å
1601	L	54.3	Low	57.2	Low	77 Å²	77	95.8 Å²	95.8	40%	0.403	45%	0.45	S	S	.	.	H	α-helix	trans	-60.4	-45.3	173.4	-111.5	167.4	0	0	0	112.3	K1597 Y1598 N1604 Y1605	K1597-L1601 WeakPolarHBondContact O-CB 3.34Å; K1597-L1601 PolarHBondContact O-N 3.11Å; Y1598-L1601 PolarHBondContact O-N 3.21Å; L1601-N1604 PolarHBondContact O-N 3.22Å; L1601-Y1605 VanDerWaalsContact O-CB 3.28Å; L1601-Y1605 WeakPolarHBondContact O-CB 3.35Å; L1601-Y1605 PolarHBondContact O-N 3.12Å
1602	C	50.4	Low	58.2	Low	51 Å²	51	98.5 Å²	98.5	35%	0.345	46%	0.461	S	S	.	.	H	α-helix	trans	-64.2	-38.5	176.7	-74.8	0	0	0	0	112.4	Y1598 Y1599 Y1605 K1606	Y1598-C1602 WeakPolarHBondContact O-CB 3.5Å; Y1598-C1602 PolarHBondContact O-N 3.03Å; Y1598-C1602 PolarHBondContact O-SG 2.95Å; Y1598-C1602 VanDerWaalsContact O-SG 3.39Å; Y1599-C1602 PolarHBondContact O-N 3.24Å; C1602-Y1605 PolarHBondContact O-N 2.95Å; C1602-K1606 VanDerWaalsContact O-CB 3.22Å; C1602-K1606 WeakPolarHBondContact O-CB 3.5Å; C1602-K1606 PolarHBondContact O-N 2.76Å
1603	N	57.9	Low	59.2	Low	61 Å²	61	99.1 Å²	99.1	33%	0.326	46%	0.457	S	S	.	.	H	α-helix	trans	-72.2	-38.4	179	-155.4	42.3	0	0	0	111.1	Y1599 E1600 K1606 N1607	Y1599-N1603 WeakPolarHBondContact O-CB 3.36Å; Y1599-N1603 PolarHBondContact O-N 3.22Å; E1600-N1603 PolarHBondContact O-N 2.93Å; N1603-K1606 PolarHBondContact O-N 3.49Å; N1603-N1607 WeakPolarHBondContact O-CB 3.29Å; N1603-N1607 PolarHBondContact O-N 2.9Å; N1603-N1607 PolarHBondContact O-ND2 3.1Å; N1603-N1607 PolarHBondContact O-OD1 3.4Å
1604	N	65	Low	60	Low	82 Å²	82	98.2 Å²	98.2	44%	0.439	45%	0.453	S	S	.	.	H	α-helix	trans	-66.2	-40.5	171.9	-74.6	-33.5	0	0	0	112.4	E1600 L1601 N1607 N1608	E1600-N1604 WeakPolarHBondContact O-CB 3.37Å; E1600-N1604 PolarHBondContact O-N 3.14Å; E1600-N1604 PolarHBondContact O-ND2 3.28Å; L1601-N1604 PolarHBondContact O-N 3.22Å; N1604-N1607 PolarHBondContact O-N 3.33Å; N1604-N1608 WeakPolarHBondContact O-CB 3.41Å; N1604-N1608 PolarHBondContact O-N 3.4Å
1605	Y	58.9	Low	61.3	Low	159 Å²	159	101.7 Å²	101.7	62%	0.624	47%	0.468	S	S	*	.	H	α-helix	trans	-65.3	-42.2	174.6	-173.7	-108	0	0	0	111.9	L1601 C1602 N1608 I1609	L1601-Y1605 VanDerWaalsContact O-CB 3.28Å; L1601-Y1605 WeakPolarHBondContact O-CB 3.35Å; L1601-Y1605 PolarHBondContact O-N 3.12Å; C1602-Y1605 PolarHBondContact O-N 2.95Å; Y1605-N1608 PolarHBondContact O-N 3.31Å; Y1605-I1609 HydrophobicContact CD1-CD1 3.89Å; Y1605-I1609 HydrophobicContact CE1-CD1 3.36Å; Y1605-I1609 HydrophobicContact CE1-CG1 4.32Å; Y1605-I1609 PolarHBondContact O-N 3.42Å
1606	K	62.9	Low	62.4	Low	120 Å²	120	98.9 Å²	98.9	52%	0.522	46%	0.457	S	S	.	.	H	α-helix	trans	-57.7	-48	170.8	176.9	-170.7	171.5	-171.1	0	111.2	C1602 N1603 N1608 I1609 I1610	C1602-K1606 VanDerWaalsContact O-CB 3.22Å; C1602-K1606 WeakPolarHBondContact O-CB 3.5Å; C1602-K1606 PolarHBondContact O-N 2.76Å; N1603-K1606 PolarHBondContact O-N 3.49Å; K1606-N1608 VanDerWaalsContact C-N 3.3Å; K1606-N1608 PolarHBondContact O-N 3.48Å; K1606-I1609 PolarHBondContact O-N 3.02Å; K1606-I1610 HydrophobicContact CD-CD1 4.44Å; K1606-I1610 HydrophobicContact CG-CD1 3.86Å; K1606-I1610 HydrophobicContact CG-CG1 4.5Å; K1606-I1610 WeakPolarHBondContact O-CB 3.47Å; K1606-I1610 VanDerWaalsContact O-CG1 3.28Å; K1606-I1610 WeakPolarHBondContact O-CG1 3.36Å; K1606-I1610 PolarHBondContact O-N 2.65Å
1607	N	65.9	Low	63.2	Low	65 Å²	65	94.3 Å²	94.3	35%	0.348	44%	0.441	S	S	.	.	H	α-helix	trans	-64.2	-34.9	179.1	-68.5	-15.5	0	0	0	112.2	N1603 N1604 I1610 K1611	N1603-N1607 WeakPolarHBondContact O-CB 3.29Å; N1603-N1607 PolarHBondContact O-N 2.9Å; N1603-N1607 PolarHBondContact O-ND2 3.1Å; N1603-N1607 PolarHBondContact O-OD1 3.4Å; N1604-N1607 PolarHBondContact O-N 3.33Å; N1607-I1610 PolarHBondContact O-N 3.08Å; N1607-K1611 WeakPolarHBondContact O-CG 3.35Å; N1607-K1611 PolarHBondContact O-N 2.94Å
1608	N	70.9	Confident	63.9	Low	102 Å²	102	92.8 Å²	92.8	55%	0.545	44%	0.435	S	S	.	.	H	α-helix	trans	-70.2	-39.6	173.7	-73.2	-13.7	0	0	0	112.4	N1604 Y1605 K1606 I1610 K1611 Q1612	N1604-N1608 WeakPolarHBondContact O-CB 3.41Å; N1604-N1608 PolarHBondContact O-N 3.4Å; Y1605-N1608 PolarHBondContact O-N 3.31Å; K1606-N1608 VanDerWaalsContact C-N 3.3Å; K1606-N1608 PolarHBondContact O-N 3.48Å; N1608-I1610 VanDerWaalsContact C-N 3.35Å; N1608-K1611 PolarHBondContact O-N 2.92Å; N1608-Q1612 VanDerWaalsContact O-CB 3.29Å; N1608-Q1612 WeakPolarHBondContact O-CB 3.35Å; N1608-Q1612 PolarHBondContact O-N 3.18Å
1609	I	66.6	Low	64.8	Low	82 Å²	82	92.7 Å²	92.7	42%	0.421	44%	0.438	S	S	.	.	H	α-helix	trans	-64.3	-40	171.8	-74.4	177	0	0	0	111.1	Y1605 K1606 Q1612 Y1613	Y1605-I1609 HydrophobicContact CD1-CD1 3.89Å; Y1605-I1609 HydrophobicContact CE1-CD1 3.36Å; Y1605-I1609 HydrophobicContact CE1-CG1 4.32Å; Y1605-I1609 PolarHBondContact O-N 3.42Å; K1606-I1609 PolarHBondContact O-N 3.02Å; I1609-Q1612 PolarHBondContact O-N 3.21Å; I1609-Y1613 VanDerWaalsContact O-CB 3.3Å; I1609-Y1613 WeakPolarHBondContact O-CB 3.19Å; I1609-Y1613 PolarHBondContact O-N 3.1Å
1610	I	70.7	Confident	64.9	Low	57 Å²	57	89.1 Å²	89.1	29%	0.292	43%	0.429	S	S	.	.	H	α-helix	trans	-59.4	-49.3	175.6	-77.5	172	0	0	0	110.2	K1606 N1607 N1608 Y1613 E1614	K1606-I1610 HydrophobicContact CD-CD1 4.44Å; K1606-I1610 HydrophobicContact CG-CD1 3.86Å; K1606-I1610 HydrophobicContact CG-CG1 4.5Å; K1606-I1610 WeakPolarHBondContact O-CB 3.47Å; K1606-I1610 VanDerWaalsContact O-CG1 3.28Å; K1606-I1610 WeakPolarHBondContact O-CG1 3.36Å; K1606-I1610 PolarHBondContact O-N 2.65Å; N1607-I1610 PolarHBondContact O-N 3.08Å; N1608-I1610 VanDerWaalsContact C-N 3.35Å; I1610-Y1613 PolarHBondContact O-N 3.48Å; I1610-E1614 WeakPolarHBondContact O-CG 3.18Å; I1610-E1614 PolarHBondContact O-N 3.35Å
1611	K	71.8	Confident	64.7	Low	131 Å²	131	87.7 Å²	87.7	57%	0.57	42%	0.423	S	S	*	.	H	α-helix	trans	-63.7	-39.2	174.7	-76.4	-172.5	172.6	-167.7	0	113.3	N1607 N1608 E1614 N1615	N1607-K1611 WeakPolarHBondContact O-CG 3.35Å; N1607-K1611 PolarHBondContact O-N 2.94Å; N1608-K1611 PolarHBondContact O-N 2.92Å; K1611-E1614 PolarHBondContact O-N 3.33Å; K1611-N1615 WeakPolarHBondContact O-CB 3.5Å; K1611-N1615 PolarHBondContact O-N 2.81Å; K1611-N1615 PolarHBondContact O-OD1 3.28Å
1612	Q	70	Confident	64.6	Low	119 Å²	119	88.4 Å²	88.4	56%	0.556	43%	0.426	S	S	*	.	H	α-helix	trans	-68	-38.9	178.8	-171.1	167.3	-1.2	0	0	110.9	N1608 I1609 N1615 D1616	N1608-Q1612 VanDerWaalsContact O-CB 3.29Å; N1608-Q1612 WeakPolarHBondContact O-CB 3.35Å; N1608-Q1612 PolarHBondContact O-N 3.18Å; I1609-Q1612 PolarHBondContact O-N 3.21Å; Q1612-N1615 PolarHBondContact O-N 2.87Å; Q1612-D1616 VanDerWaalsContact O-CB 3.26Å; Q1612-D1616 WeakPolarHBondContact O-CB 3.33Å; Q1612-D1616 PolarHBondContact O-N 3.26Å
1613	Y	68.9	Low	64.6	Low	100 Å²	100	90.3 Å²	90.3	39%	0.392	43%	0.432	S	S	.	.	H	α-helix	trans	-69.3	-33.1	172.7	-171.4	-94.7	0	0	0	112.5	I1609 I1610 K1617	I1609-Y1613 VanDerWaalsContact O-CB 3.3Å; I1609-Y1613 WeakPolarHBondContact O-CB 3.19Å; I1609-Y1613 PolarHBondContact O-N 3.1Å; I1610-Y1613 PolarHBondContact O-N 3.48Å; Y1613-K1617 HydrophobicContact CE1-CD 3.87Å; Y1613-K1617 WeakPolarHBondContact O-CB 3.46Å; Y1613-K1617 PolarHBondContact O-N 3.06Å
1614	E	72.5	Confident	64.1	Low	50 Å²	50	92.7 Å²	92.7	23%	0.234	45%	0.445	C	S	.	.	H	α-helix	trans	-63.8	-51.4	170.3	-77.2	167.5	158.1	0	0	111	Q425 I1610 K1611 D1616 K1617 E1618	Q425-E1614 HydrophobicContact CG-CG 3.95Å; Q425-E1614 PolarHBondContact NE2-OE1 2.83Å; I1610-E1614 WeakPolarHBondContact O-CG 3.18Å; I1610-E1614 PolarHBondContact O-N 3.35Å; K1611-E1614 PolarHBondContact O-N 3.33Å; E1614-D1616 PolarHBondContact O-N 3.35Å; E1614-K1617 CarbonylContact O-C 3.58Å; E1614-K1617 PolarHBondContact O-N 3.48Å; E1614-K1617 VanDerWaalsContact O-N 3.09Å; E1614-E1618 WeakPolarHBondContact O-CB 3.49Å; E1614-E1618 PolarHBondContact O-N 2.77Å
1615	N	71.1	Confident	63.1	Low	103 Å²	103	92.8 Å²	92.8	55%	0.551	45%	0.446	S	S	*	.	H	α-helix	trans	-59.3	-45.7	176	-66	1.4	0	0	0	111.9	K1611 Q1612 K1617 E1618 F1619	K1611-N1615 WeakPolarHBondContact O-CB 3.5Å; K1611-N1615 PolarHBondContact O-N 2.81Å; K1611-N1615 PolarHBondContact O-OD1 3.28Å; Q1612-N1615 PolarHBondContact O-N 2.87Å; N1615-K1617 VanDerWaalsContact C-N 3.25Å; N1615-K1617 PolarHBondContact O-N 2.65Å; N1615-E1618 PolarHBondContact O-N 3.42Å; N1615-F1619 VanDerWaalsContact O-CB 3.24Å; N1615-F1619 WeakPolarHBondContact O-CB 3.26Å; N1615-F1619 PolarHBondContact O-N 2.91Å
1616	D	71.6	Confident	62.1	Low	81 Å²	81	93.6 Å²	93.6	43%	0.433	46%	0.455	S	S	.	.	H	α-helix	trans	-64.6	-31.4	177.2	-72.3	-21.7	0	0	0	110.9	Q1612 E1614 N1620	Q1612-D1616 VanDerWaalsContact O-CB 3.26Å; Q1612-D1616 WeakPolarHBondContact O-CB 3.33Å; Q1612-D1616 PolarHBondContact O-N 3.26Å; E1614-D1616 PolarHBondContact O-N 3.35Å; D1616-N1620 VanDerWaalsContact O-CB 3.3Å; D1616-N1620 WeakPolarHBondContact O-CB 3.4Å; D1616-N1620 PolarHBondContact O-N 3.22Å; D1616-N1620 PolarHBondContact O-ND2 3.06Å
1617	K	67.9	Low	60.5	Low	56 Å²	56	92.6 Å²	92.6	24%	0.243	46%	0.463	C	S	.	.	H	α-helix	trans	-83.3	-30	179.7	-169.9	162.6	179.3	-176	0	113.3	S424 Q425 N426 Y1613 E1614 N1615 Q1621	S424-K1617 PolarHBondContact O-NZ 3.19Å; Q425-K1617 HydrophobicContact CB-CD 4.45Å; Q425-K1617 WeakPolarHBondContact O-CE 3.41Å; Q425-K1617 PolarHBondContact O-NZ 3.35Å; N426-K1617 WeakPolarHBondContact O-CD 3.43Å; N426-K1617 WeakPolarHBondContact O-CE 3.42Å; N426-K1617 VanDerWaalsContact O-CG 3.29Å; N426-K1617 WeakPolarHBondContact O-CG 3.45Å; Y1613-K1617 HydrophobicContact CE1-CD 3.87Å; Y1613-K1617 WeakPolarHBondContact O-CB 3.46Å; Y1613-K1617 PolarHBondContact O-N 3.06Å; E1614-K1617 CarbonylContact O-C 3.58Å; E1614-K1617 PolarHBondContact O-N 3.48Å; E1614-K1617 VanDerWaalsContact O-N 3.09Å; N1615-K1617 VanDerWaalsContact C-N 3.25Å; N1615-K1617 PolarHBondContact O-N 2.65Å; K1617-Q1621 WeakPolarHBondContact O-CB 3.45Å; K1617-Q1621 PolarHBondContact O-N 2.97Å; K1617-Q1621 PolarHBondContact O-NE2 3.09Å
1618	E	66.3	Low	59	Low	68 Å²	68	95.5 Å²	95.5	32%	0.318	48%	0.483	S	S	.	.	H	α-helix	trans	-68.2	-41.2	166.9	-75.8	-177.6	171.5	0	0	111.1	N427 S428 E1614 N1615 Q1621 L1622	N427-E1618 HydrophobicContact CB-CG 3.52Å; N427-E1618 WeakPolarHBondContact CB-OE1 3.38Å; N427-E1618 PolarHBondContact ND2-OE1 3.48Å; N427-E1618 VanDerWaalsContact O-CA 3.31Å; N427-E1618 WeakPolarHBondContact O-CA 3.33Å; N427-E1618 WeakPolarHBondContact O-CG 3.49Å; S428-E1618 WeakPolarHBondContact CB-O 3.4Å; S428-E1618 VanDerWaalsContact OG-CA 3.28Å; S428-E1618 WeakPolarHBondContact OG-CA 3.34Å; S428-E1618 WeakPolarHBondContact OG-CB 3.47Å; S428-E1618 PolarHBondContact OG-O 2.99Å; E1614-E1618 WeakPolarHBondContact O-CB 3.49Å; E1614-E1618 PolarHBondContact O-N 2.77Å; N1615-E1618 PolarHBondContact O-N 3.42Å; E1618-Q1621 PolarHBondContact O-N 2.65Å; E1618-L1622 WeakPolarHBondContact O-CG 3.36Å; E1618-L1622 PolarHBondContact O-N 3.49Å
1619	F	64.3	Low	57.3	Low	130 Å²	130	97.1 Å²	97.1	57%	0.57	50%	0.497	S	S	*	.	H	α-helix	trans	-65.6	-42.1	172.9	-173.8	-106	0	0	0	112.4	N1615 L1622 I1623	N1615-F1619 VanDerWaalsContact O-CB 3.24Å; N1615-F1619 WeakPolarHBondContact O-CB 3.26Å; N1615-F1619 PolarHBondContact O-N 2.91Å; F1619-L1622 PolarHBondContact O-N 3.44Å; F1619-I1623 HydrophobicContact CD1-CD1 3.85Å; F1619-I1623 HydrophobicContact CE1-CD1 3.43Å; F1619-I1623 VanDerWaalsContact CE1-CD1 3.43Å; F1619-I1623 HydrophobicContact CE2-CD1 4.44Å; F1619-I1623 HydrophobicContact CZ-CD1 3.77Å; F1619-I1623 WeakPolarHBondContact O-CG1 3.41Å; F1619-I1623 PolarHBondContact O-N 2.96Å; F1619-I1623 VanDerWaalsContact O-N 3.08Å
1620	N	54.8	Low	55.6	Low	85 Å²	85	100.7 Å²	100.7	46%	0.455	51%	0.513	S	S	.	.	H	α-helix	trans	-70.7	-30.7	175.5	-83.7	-75.8	0	0	0	112.9	D1616 I1623 N1624	D1616-N1620 VanDerWaalsContact O-CB 3.3Å; D1616-N1620 WeakPolarHBondContact O-CB 3.4Å; D1616-N1620 PolarHBondContact O-N 3.22Å; D1616-N1620 PolarHBondContact O-ND2 3.06Å; N1620-I1623 PolarHBondContact O-N 3.38Å; N1620-N1624 PolarHBondContact O-N 3.29Å; N1620-N1624 PolarHBondContact O-ND2 3.31Å
1621	Q	55.7	Low	54.1	Low	63 Å²	63	102.5 Å²	102.5	29%	0.294	53%	0.529	S	S	.	.	H	α-helix	trans	-74.1	-36.1	173.6	-96.6	161.3	101.4	0	0	112.1	N427 S428 K1617 E1618 I1623 N1624 N1625	N427-Q1621 VanDerWaalsContact C-CD 3.44Å; N427-Q1621 PolarHBondContact O-NE2 3.47Å; S428-Q1621 VanDerWaalsContact CB-CB 3.49Å; K1617-Q1621 WeakPolarHBondContact O-CB 3.45Å; K1617-Q1621 PolarHBondContact O-N 2.97Å; K1617-Q1621 PolarHBondContact O-NE2 3.09Å; E1618-Q1621 PolarHBondContact O-N 2.65Å; Q1621-I1623 VanDerWaalsContact C-N 3.31Å; Q1621-I1623 PolarHBondContact O-N 3.35Å; Q1621-N1624 PolarHBondContact O-N 3.21Å; Q1621-N1624 VanDerWaalsContact O-N 3.15Å; Q1621-N1625 VanDerWaalsContact O-CG 3.26Å; Q1621-N1625 PolarHBondContact O-N 3.06Å; Q1621-N1625 PolarHBondContact O-OD1 3.44Å
1622	L	52.2	Low	52.1	Low	91 Å²	91	101.6 Å²	101.6	48%	0.476	53%	0.534	S	S	.	.	H	α-helix	trans	-55.8	-45.3	167.2	-77.4	163.1	0	0	0	111.7	E1618 F1619 N1624 N1625	E1618-L1622 WeakPolarHBondContact O-CG 3.36Å; E1618-L1622 PolarHBondContact O-N 3.49Å; F1619-L1622 PolarHBondContact O-N 3.44Å; L1622-N1624 VanDerWaalsContact C-N 3.32Å; L1622-N1624 PolarHBondContact O-N 3.48Å; L1622-N1625 PolarHBondContact O-N 2.7Å
1623	I	51	Low	50.2	Low	92 Å²	92	103.3 Å²	103.3	47%	0.472	54%	0.544	S	S	.	.	H	α-helix	trans	-68.1	-26	177.7	-72	172.6	0	0	0	113.4	F1619 N1620 Q1621	F1619-I1623 HydrophobicContact CD1-CD1 3.85Å; F1619-I1623 HydrophobicContact CE1-CD1 3.43Å; F1619-I1623 VanDerWaalsContact CE1-CD1 3.43Å; F1619-I1623 HydrophobicContact CE2-CD1 4.44Å; F1619-I1623 HydrophobicContact CZ-CD1 3.77Å; F1619-I1623 WeakPolarHBondContact O-CG1 3.41Å; F1619-I1623 PolarHBondContact O-N 2.96Å; F1619-I1623 VanDerWaalsContact O-N 3.08Å; N1620-I1623 PolarHBondContact O-N 3.38Å; Q1621-I1623 VanDerWaalsContact C-N 3.31Å; Q1621-I1623 PolarHBondContact O-N 3.35Å
1624	N	47.4	Very low	48.4	Very low	111 Å²	111	105.4 Å²	105.4	59%	0.594	56%	0.562	S	S	*	*	H	α-helix	trans	-91.6	-12.2	178.7	-77.4	-77	0	0	0	114.1	N1620 Q1621 L1622	N1620-N1624 PolarHBondContact O-N 3.29Å; N1620-N1624 PolarHBondContact O-ND2 3.31Å; Q1621-N1624 PolarHBondContact O-N 3.21Å; Q1621-N1624 VanDerWaalsContact O-N 3.15Å; L1622-N1624 VanDerWaalsContact C-N 3.32Å; L1622-N1624 PolarHBondContact O-N 3.48Å
1625	N	44.5	Very low	46.5	Very low	84 Å²	84	108.2 Å²	108.2	45%	0.449	59%	0.587	S	S	.	*	H	α-helix	trans	-79.8	-30.7	175	-72.2	-5.7	0	0	0	111.9	P429 Q1621 L1622 S1627	P429-N1625 PolarHBondContact O-ND2 3.35Å; Q1621-N1625 VanDerWaalsContact O-CG 3.26Å; Q1621-N1625 PolarHBondContact O-N 3.06Å; Q1621-N1625 PolarHBondContact O-OD1 3.44Å; L1622-N1625 PolarHBondContact O-N 2.7Å; N1625-S1627 PolarHBondContact O-N 3.4Å
1626	E	37.4	Very low	45.1	Very low	176 Å²	176	109 Å²	109	82%	0.822	60%	0.598	S	S	*	*	S	Bend	trans	-87.3	58.9	176.2	-68.8	-162.9	128.8	0	0	114.4
1627	S	28.9	Very low	43.2	Very low	99 Å²	99	113.5 Å²	113.5	69%	0.692	62%	0.62	S	S	*	*			trans	177.6	87.9	152.6	38.5	0	0	0	0	117.1	N1625	N1625-S1627 PolarHBondContact O-N 3.4Å
1628	V	34	Very low	41.5	Very low	125 Å²	125	119 Å²	119	76%	0.758	65%	0.647	S	S	*	*			trans	-141.7	96.2	162.9	-172.7	0	0	0	0	114
1629	T	34.8	Very low	40	Very low	137 Å²	137	121.1 Å²	121.1	84%	0.84	66%	0.664	S	S	*	*			trans	-175.2	96.4	143.6	28.7	0	0	0	0	107.4
1630	M	31.9	Very low	38.4	Very low	156 Å²	156	121.9 Å²	121.9	77%	0.768	67%	0.673	S	S	*	*				75.3	149.8	73.5	-72.1	-67.8	-79	0	0	114.5
1631	P	38.9	Very low	37.5	Very low	95 Å²	95	124 Å²	124	62%	0.617	68%	0.681	S	S	*	*			cis	-138.8	165.4	6.2	40.5	-22.8	0	0	0	118.6
1632	T	29.9	Very low	36.5	Very low	112 Å²	112	129 Å²	129	69%	0.687	70%	0.701	S	S	*	*			trans	63.9	150.7	150.4	49.5	0	0	0	0	120.6
1633	M	30.3	Very low	35.6	Very low	155 Å²	155	135.2 Å²	135.2	76%	0.764	72%	0.718	S	S	*	*			cis	-146.7	154.6	22.1	-91.9	-53	-179.6	0	0	115.3
1634	L	31.6	Very low	34.7	Very low	145 Å²	145	136.2 Å²	136.2	76%	0.759	72%	0.721	S	S	*	*			trans	67.9	101	140.8	-69.6	167.3	0	0	0	126.4
1635	S	32	Very low	34.1	Very low	109 Å²	109	140.8 Å²	140.8	76%	0.762	73%	0.73	S	S	*	*				74.1	154.9	124.3	59.2	0	0	0	0	125.7
1636	P	41.7	Very low	33.5	Very low	120 Å²	120	142.5 Å²	142.5	78%	0.779	74%	0.744	S	S	*	*			trans	-134.7	-172.1	-159.1	45	-26.7	0	0	0	117.7
1637	I	31.9	Very low	33.4	Very low	174 Å²	174	143.8 Å²	143.8	89%	0.892	75%	0.747	S	S	*	*			trans	-166.9	159.1	156.4	-105.6	156.1	0	0	0	112.9
1638	E	33.2	Very low	33.6	Very low	173 Å²	173	144.4 Å²	144.4	81%	0.808	75%	0.751	S	S	*	*			trans	-110.4	172.3	-175.4	-57.2	176.4	113.7	0	0	112.9
1639	T	34.7	Very low	33.7	Very low	112 Å²	112	144.5 Å²	144.5	69%	0.687	76%	0.757	S	S	*	*				177.1	146.3	61	41.3	0	0	0	0	115.1
1640	L	30.8	Very low	33.7	Very low	146 Å²	146	147.4 Å²	147.4	76%	0.764	76%	0.758	S	S	*	*			trans	64.7	169.8	144.1	-58.8	165.2	0	0	0	119.9
1641	Q	35.2	Very low	33.7	Very low	130 Å²	130	145.1 Å²	145.1	61%	0.607	76%	0.758	S	S	*	*			cis	-162.2	155.7	-9.1	-124.9	177.6	116.2	0	0	116.1
1642	K	35	Very low	33.5	Very low	167 Å²	167	146.7 Å²	146.7	73%	0.726	77%	0.771	S	S	*	*			trans	49.9	124.2	146.7	-79.2	171.9	-175.7	151.6	0	127.1
1643	R	32.1	Very low	33.7	Very low	222 Å²	222	150.5 Å²	150.5	84%	0.838	78%	0.778	S	S	*	*				48.4	154	126.1	-80.5	-178.9	164.7	172.5	0.3	122.3
1644	E	33.3	Very low	33.9	Very low	113 Å²	113	149 Å²	149	53%	0.528	78%	0.782	S	S	.	*			cis	-161.9	168.4	7.7	-136.7	173.5	-110.3	0	0	114.4
1645	R	33.3	Very low	33.9	Very low	206 Å²	206	145.7 Å²	145.7	78%	0.777	78%	0.784	S	S	*	*			trans	74	116.4	154.3	-69.2	178.7	-159.7	-161.1	2.4	125.3
1646	T	32.8	Very low	33.9	Very low	121 Å²	121	146.6 Å²	146.6	74%	0.742	79%	0.79	S	S	*	*				21.8	146.7	128.8	63.3	0	0	0	0	121.7
1647	K	34.6	Very low	33.5	Very low	202 Å²	202	148.2 Å²	148.2	88%	0.878	79%	0.792	S	S	*	*			cis	-164.9	171.4	40.8	-141.1	167.6	-170.6	178.6	0	113.2
1648	S	33.1	Very low	33.6	Very low	112 Å²	112	149.1 Å²	149.1	78%	0.783	79%	0.789	S	S	*	*			trans	-70.9	148.3	-165.3	55.3	0	0	0	0	120.8
1649	S	36.4	Very low	33.7	Very low	127 Å²	127	149.7 Å²	149.7	89%	0.888	79%	0.789	S	S	*	*			trans	-149.9	177.5	136.9	76.4	0	0	0	0	110.7
1650	K	34.9	Very low	33.5	Very low	199 Å²	199	150.6 Å²	150.6	87%	0.865	79%	0.788	S	S	*	*			trans	-106.6	134.4	-157.9	-74.7	-176.5	176.9	176.8	0	117.1
1651	S	32.6	Very low	33.6	Very low	108 Å²	108	153 Å²	153	76%	0.755	79%	0.793	S	S	*	*			trans	53.3	118.6	140.4	64.9	0	0	0	0	122
1652	S	34.6	Very low	33.3	Very low	127 Å²	127	158.3 Å²	158.3	89%	0.888	82%	0.823	S	S	*	*				-161.5	-167.7	113.4	57.5	0	0	0	0	110.9
1653	K	34.4	Very low	33.2	Very low	193 Å²	193	157.9 Å²	157.9	84%	0.839	83%	0.828	S	S	*	*			trans	-86	157.5	-155.6	-69.9	176.6	177.6	174.4	0	115.8
1654	S	33.6	Very low	33.3	Very low	122 Å²	122	154.5 Å²	154.5	85%	0.853	83%	0.827	S	S	*	*			trans	63.5	122	147.1	55.7	0	0	0	0	121.2
1655	G	31.2	Very low	33.3	Very low	77 Å²	77	156.8 Å²	156.8	79%	0.794	84%	0.844	S	S	*	*				120.5	82.7	128.4	0	0	0	0	0	118.9
1656	S	33.3	Very low	33.3	Very low	127 Å²	127	153.9 Å²	153.9	89%	0.888	85%	0.848	S	S	*	*			trans	-170.9	154	142.2	29.3	0	0	0	0	112.2
1657	N	33	Very low	33.3	Very low	155 Å²	155	156 Å²	156	83%	0.829	85%	0.854	S	S	*	*			trans	-112.1	143.7	-175.9	-71.6	-66.2	0	0	0	112.1
1658	K	34.7	Very low	33.2	Very low	192 Å²	192	152.9 Å²	152.9	84%	0.835	85%	0.853	S	S	*	*			trans	163.6	128.5	132.4	-87.9	156.1	-173.7	-179.9	0	108.9
1659	K	34	Very low	33.2	Very low	186 Å²	186	155.9 Å²	155.9	81%	0.809	86%	0.858	S	S	*	*				58.7	131.4	80.8	-69.7	-168.6	164.1	-168.4	0	112.4
1660	I	31	Very low	33	Very low	130 Å²	130	158.1 Å²	158.1	67%	0.667	86%	0.855	S	S	*	*			cis	-162.2	156.6	3.6	-114.5	164.4	0	0	0	109.2
1661	K	31.8	Very low	32.8	Very low	197 Å²	197	154.7 Å²	154.7	86%	0.857	86%	0.855	S	S	*	*			trans	62.6	142.1	-179.3	-72.7	171.5	178.5	-175.7	0	114.3
1662	I	30.1	Very low	32.9	Very low	242 Å²	242	158.9 Å²	158.9	100%	1.241	86%	0.864	S	S	*	*			cis	-74.7	0	4.1	-60.9	172	0	0	0	111.2

Retrieved 1,662 of 1,662 residues in 1552.3 ms (Link to these results)

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