A0A5K4EMM3_SCHMA Loading...

Putative nephrin

AlphaFold DB , UniProt , Accession A0A5K4EMM3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,818 aa.

						>A0A5K4EMM3_SCHMA|A0A5K4EMM3
MLTIKFLKQQFIIIFLCNHQSWKRILFIHGNKLHIFIITLLIGWFIDFALAEKHECNQNTCYSVLSDTAARVIQSNRCTTEERQKRIQCFEVLPSEQYAIPLGHTVNMQCVVLNQHGKVQWRAKKILLGYDRSIPGYSRFRIIGDVGRGEHTLQITDVQRDDAGEYECQVTPVPVNNHPLLRRKTYLEVLIKPNEPQILYQNVQLPERKLIISQPDPILRISLVCSAVGGRPAPTFKWLINRHEIPNLEVKTKTPMSPNDVAKMNNLLKVWGKLHPIINNEENEEQSNLSILKAGLEDGDEIVCSVSNSATQINHDPMKRNLSITITVDVHTPPGPPKIVSPESNHVYLDGEQLRAVCVSSPPGKPLGGLFWRWLIRPSQVDDNDIQKISGIGGRGGARLSDYTSVEAYLRSLDSSNGGGSPSQKILTPELSQLQQGDFISEDVQPLHYTLTKEKDQLVNTLIIQRVTRKYHAAKLICETGHPVGSAHQTSITIFVKHAPANVTISVETGSIDDDHTGGRHEKVAYARAGEMKTFICKTAPYYGQATIKWLFQAAGTSITTSPKQLVDKSVTYKTPDGESFYQESRIQITVRPEDDRSYIDCLVWSVGDARIDSRVRLDIIHPPDIPKITGYKSGQPVNMAHLLELTCTTTGGNPLPELQWFKDKNPITNNVEPIIIGKQTTIKLKLVPQKEDNGAQYHCSARNTATNNEWIDSEAITLNVLFPPQRVSLNFGGKSVVQSGEQLEINCQADSSNPVAVITWRHYQCGPAHAFYRRHLLQQQKKLPKSSSSTNEGEKCKLLELKGSDETPVPGASGGLLARSHLWLRPTWRYHMDFIECQAENPVYGPPIWHDRLQLNITFAPQFYGLQVDDHRVIREGETTHLDFGLYANPPVTSVSWFRNDQLLPFEPKETDTWQGVFAAGSVGELLSLHKINRENMGNYTVIVSNSQHESRNTFFLNVTYPASIVGKLEENITQTNKDYAALDCKADANPAIPDRTFTWYRYFPPKGWTEEVDEGALQLSEPIYCNQSQIDKPKMLAQCFQQDKFQISSTFYIYQLTEDDVGKYVCEVSNGIGEPVKKTFNLLYHFPPKIIQLPRYTKAAGEQSSKVWLTCYIRTEPTPQIVWLKDNKLIPMDTLIQSKNSDSKNGIKKYENYLIHIRPGLYKAQLAVNDIRKYDFGSYSCQAANLQGEAQLEIHLSGTSTPDVPINFRLLNATSSTLHVAWTQGFDGGLAQTFQVRWREVGSISLYKYADVASNDNRNGVEYIITGLKPGSEYIVSVNSMNSKHGASAYTDPIHLRTLSLDLYNGREPMPPLSTSGYSDDNALLIIVSACVFGFVILLINIIVIIFLIKRRRHRNMMRRRQYKSDQGVTMTNGVALTHHNQTSTDMKSHLQSSFIDQNDNFMDTDISTTCICCHPNKQKLASSGYVKADSYGNFSRTHGYAPHDICPSQCPQYIPTDVDQQGHLMNHNITSSNPDFNHLTSNQMTTSYPVRHLTSPNPYYNNTLNYPMTRHGSTELGIVYSSANPVNQLRHEHGSIKHSTRYGQHTPRQPNQSRYYGTKPNFASTRYFCSSREVIQSNTSRKNIPHYENRQSVNNLTHAISSELFTHQNQCNCEQQYSMHKPNQIQCHKRLPYSCSTCLKSRSSLHNSKQSFHTLNTQNSVIDNFSEEDKDSDRSRYADQLRRIQYGGGPTAQLLLGNINAQNDHSSPDSNLSPSQEEHNINNFHSCLSKSKSNMHKIELLNNTENNHLISNLNQYNERPDSLGNNENLETSRLLYSDKFNREQQQNQHITDDFSTIPNVDNTEIRSTHLSDCFV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.3	Very low	29.7	Very low	228 Å²	228	122.6 Å²	122.6	100%	1.123	60%	0.595	S	S	*	*				0	117.9	0	-78.2	166.7	160.2	0	0	106.5
2	L	29.2	Very low	30	Very low	122 Å²	122	118.9 Å²	118.9	64%	0.639	58%	0.579	S	S	*	*				88.6	154.2	55.1	-90.7	102.7	0	0	0	113.5
3	T	29.2	Very low	30.2	Very low	74 Å²	74	119.5 Å²	119.5	45%	0.454	58%	0.584	S	S	.	*			trans	57.5	87.1	149.8	59.4	0	0	0	0	120.2	K5	T3-K5 HydrophobicContact CG2-CD 3.67Å; T3-K5 HydrophobicContact CG2-CG 4.11Å
4	I	34.5	Very low	30.3	Very low	132 Å²	132	119.9 Å²	119.9	68%	0.677	59%	0.588	S	S	*	*			trans	-127.7	115.4	139.1	-58.5	171.8	0	0	0	103.1	N1805	I4-N1805 PolarHBondContact N-ND2 3.44Å; I4-N1805 WeakPolarHBondContact O-CA 3.34Å; I4-N1805 VanDerWaalsContact O-CB 3.24Å; I4-N1805 WeakPolarHBondContact O-CB 3.48Å; I4-N1805 PolarHBondContact O-N 3.46Å
5	K	26.5	Very low	30.3	Very low	76 Å²	76	123.6 Å²	123.6	33%	0.33	60%	0.6	S	S	.	*	B	Isolated β-bridge	trans	-129	179.3	-157.2	-49.5	-177.3	66.4	123	0	110.5	T3 D1804	T3-K5 HydrophobicContact CG2-CD 3.67Å; T3-K5 HydrophobicContact CG2-CG 4.11Å; K5-D1804 VanDerWaalsContact CD-OD1 3.32Å; K5-D1804 WeakPolarHBondContact CD-OD1 3.29Å; K5-D1804 WeakPolarHBondContact CE-OD1 3.32Å; K5-D1804 WeakPolarHBondContact CE-OD2 3.2Å; K5-D1804 HydrophobicContact CG-CB 4.46Å; K5-D1804 WeakPolarHBondContact CG-OD1 3.17Å; K5-D1804 IonicContact NZ-OD1 2.66Å; K5-D1804 PolarHBondContact NZ-OD1 3.32Å; K5-D1804 IonicContact NZ-OD2 3.81Å; K5-D1804 PolarHBondContact NZ-OD2 3.49Å
6	F	28.4	Very low	30.4	Very low	110 Å²	110	125.2 Å²	125.2	48%	0.482	61%	0.612	S	S	.	*			trans	58.2	72.4	139.2	-65.2	-25.2	0	0	0	113.1	N1802 V1803	F6-N1802 VanDerWaalsContact C-OD1 3.24Å; F6-N1802 WeakPolarHBondContact CA-OD1 3.4Å; F6-N1802 HydrophobicContact CB-CB 4.4Å; F6-N1802 WeakPolarHBondContact CB-OD1 3.16Å; F6-N1802 HydrophobicContact CD1-CB 3.28Å; F6-N1802 VanDerWaalsContact CD1-CG 3.42Å; F6-N1802 HydrophobicContact CE1-CB 3.66Å; F6-N1802 VanDerWaalsContact CE1-O 3.31Å; F6-N1802 WeakPolarHBondContact CE1-O 3.31Å; F6-N1802 HydrophobicContact CG-CB 4.07Å; F6-V1803 VanDerWaalsContact CD1-N 3.35Å; F6-V1803 HydrophobicContact CE1-CG1 4.32Å; F6-V1803 PolarHBondContact N-O 3.24Å
7	L	29.5	Very low	30.4	Very low	124 Å²	124	124.5 Å²	124.5	65%	0.649	62%	0.621	S	S	*	*				56.5	173.6	70.7	-104	154.7	0	0	0	113.8	N1802	L7-N1802 WeakPolarHBondContact CA-OD1 3.43Å; L7-N1802 HydrophobicContact CB-CB 4.45Å; L7-N1802 WeakPolarHBondContact CB-OD1 3.33Å; L7-N1802 PolarHBondContact O-OD1 2.71Å
8	K	28.8	Very low	30.4	Very low	93 Å²	93	125.8 Å²	125.8	40%	0.404	63%	0.63	S	S	.	*			trans	-2.2	133.4	165.5	-72	160.4	154.1	-163.8	0	121.9	T1799 I1800 P1801 N1802	K8-T1799 PolarHBondContact NZ-O 2.81Å; K8-I1800 VanDerWaalsContact NZ-C 3.26Å; K8-I1800 PolarHBondContact NZ-O 2.93Å; K8-P1801 WeakPolarHBondContact CD-O 3.45Å; K8-P1801 PolarHBondContact NZ-O 3.23Å; K8-N1802 PolarHBondContact N-OD1 3.11Å; K8-N1802 PolarHBondContact O-ND2 3.27Å; K8-N1802 PolarHBondContact O-OD1 3.2Å
9	Q	28.9	Very low	30.2	Very low	148 Å²	148	126.3 Å²	126.3	69%	0.692	63%	0.63	S	S	*	*				-144.1	166.6	129.8	-72.9	-158.5	29.6	0	0	108.9
10	Q	30.4	Very low	30.1	Very low	117 Å²	117	127.7 Å²	127.7	55%	0.547	63%	0.634	S	S	.	*			cis	-124.4	-130.6	-4.6	-144.4	-179.6	84.6	0	0	113	T1799 I1800	Q10-T1799 CarbonylContact O-C 3.57Å; Q10-T1799 WeakPolarHBondContact O-CA 3.23Å; Q10-T1799 PolarHBondContact O-N 3.09Å; Q10-I1800 VanDerWaalsContact C-CG1 3.44Å; Q10-I1800 HydrophobicContact CG-CD1 3.9Å; Q10-I1800 WeakPolarHBondContact O-CG1 3.39Å; Q10-I1800 PolarHBondContact O-N 3.33Å
11	F	32	Very low	30	Very low	125 Å²	125	125.4 Å²	125.4	55%	0.548	63%	0.631	S	S	.	*				-114.8	147.5	-128.1	-121.4	-35.9	0	0	0	120	S1798 I1800	F11-S1798 WeakPolarHBondContact O-CB 3.34Å; F11-I1800 HydrophobicContact CB-CD1 4.18Å; F11-I1800 HydrophobicContact CD1-CD1 3.4Å; F11-I1800 HydrophobicContact CD1-CG1 4.4Å; F11-I1800 HydrophobicContact CD2-CD1 4.14Å; F11-I1800 HydrophobicContact CE1-CD1 3.76Å; F11-I1800 HydrophobicContact CE2-CD1 4.44Å; F11-I1800 HydrophobicContact CG-CD1 3.62Å; F11-I1800 HydrophobicContact CZ-CD1 4.27Å
12	I	33.1	Very low	29.9	Very low	78 Å²	78	125 Å²	125	40%	0.4	62%	0.617	S	S	.	*			trans	97.7	119.5	137.3	-99.4	154.7	0	0	0	122.8	S1798 T1799	I12-S1798 VanDerWaalsContact C-OG 3.3Å; I12-S1798 VanDerWaalsContact O-CB 3.27Å; I12-S1798 WeakPolarHBondContact O-CB 3.45Å; I12-S1798 PolarHBondContact O-OG 3.37Å; I12-T1799 WeakPolarHBondContact CA-OG1 3.48Å; I12-T1799 PolarHBondContact N-OG1 3.48Å
13	I	32.5	Very low	29.7	Very low	126 Å²	126	126 Å²	126	65%	0.646	62%	0.616	S	S	*	*			trans	77	139.7	143.5	-72.3	178.4	0	0	0	121.4
14	I	31.3	Very low	29.6	Very low	125 Å²	125	133.4 Å²	133.4	64%	0.641	64%	0.636	S	S	*	*			cis	-169.1	167.3	-24.2	-143.2	171.1	0	0	0	111.7
15	F	31.7	Very low	29.4	Very low	176 Å²	176	133.4 Å²	133.4	77%	0.772	64%	0.636	S	S	*	*			trans	51.2	124.3	176.6	-68.9	-64.7	0	0	0	117.9
16	L	30.4	Very low	29.5	Very low	149 Å²	149	136 Å²	136	78%	0.78	65%	0.653	S	S	*	*			cis	115.7	151.8	18.7	-84.8	170.9	0	0	0	113
17	C	30.3	Very low	29.6	Very low	113 Å²	113	138.8 Å²	138.8	76%	0.764	67%	0.665	S	S	*	*			trans	76.4	76.9	159.8	-69.3	0	0	0	0	121.1
18	N	30.5	Very low	29.8	Very low	149 Å²	149	139.7 Å²	139.7	80%	0.797	67%	0.669	S	S	*	*				76.8	148.7	113.7	-157.6	22.2	0	0	0	121.4
19	H	27.7	Very low	30	Very low	135 Å²	135	144.3 Å²	144.3	63%	0.625	69%	0.692	S	S	*	*			trans	65.4	99.5	160.5	-114.2	-104.5	0	0	0	120.6
20	Q	28.3	Very low	30.3	Very low	153 Å²	153	140.9 Å²	140.9	72%	0.715	70%	0.696	S	S	*	*				46.1	134	111.7	-155.6	-162.2	53.7	0	0	120.4
21	S	28.2	Very low	30.6	Very low	81 Å²	81	142.2 Å²	142.2	57%	0.566	71%	0.706	S	S	*	*			trans	105	130.9	151.1	-54	0	0	0	0	119
22	W	25.5	Very low	30.7	Very low	218 Å²	218	143.3 Å²	143.3	83%	0.826	71%	0.711	S	S	*	*			trans	68.6	154.5	154.7	-64.9	15.8	0	0	0	115.9
23	K	26.2	Very low	30.9	Very low	144 Å²	144	144.8 Å²	144.8	63%	0.626	72%	0.719	S	S	*	*			cis	-146.8	137.5	-16.8	-108.7	161.4	179.5	170	0	104.7
24	R	27.2	Very low	31.1	Very low	230 Å²	230	145.9 Å²	145.9	87%	0.868	72%	0.721	S	S	*	*				54.5	147.7	94	-131.1	-172	-160.7	-161.6	6.7	114.9
25	I	29.6	Very low	31.3	Very low	131 Å²	131	144.7 Å²	144.7	67%	0.672	72%	0.715	S	S	*	*			trans	99.1	106.9	152.8	-74.1	165.8	0	0	0	118.8
26	L	29.2	Very low	31.6	Very low	132 Å²	132	144.7 Å²	144.7	69%	0.691	72%	0.715	S	S	*	*			trans	78.9	151.8	146.8	-56	174.9	0	0	0	119.3
27	F	30.1	Very low	31.8	Very low	167 Å²	167	143.4 Å²	143.4	73%	0.732	71%	0.708	S	S	*	*			cis	-158.4	157.2	1.6	-125.3	-33.1	0	0	0	113.3
28	I	34.4	Very low	32.1	Very low	143 Å²	143	145.1 Å²	145.1	73%	0.733	71%	0.708	S	S	*	*			trans	78.7	132.1	148.1	-63.7	160.4	0	0	0	121.8
29	H	31.9	Very low	32.4	Very low	191 Å²	191	140.4 Å²	140.4	88%	0.884	69%	0.685	S	S	*	*			trans	-60	175.3	176.4	-68	-122.8	0	0	0	117.7
30	G	35.2	Very low	32.8	Very low	75 Å²	75	137.6 Å²	137.6	77%	0.773	67%	0.674	S	S	*	*			trans	166.4	24.2	141.8	0	0	0	0	0	127.5
31	N	37.1	Very low	33.3	Very low	145 Å²	145	136.2 Å²	136.2	78%	0.775	67%	0.671	S	S	*	*			trans	20.1	131.8	159.4	-97.9	-18.1	0	0	0	124.8
32	K	35	Very low	33.6	Very low	148 Å²	148	139.1 Å²	139.1	64%	0.643	68%	0.678	S	S	*	*				91.3	141.9	129.1	-83.7	-176.9	169.3	-170.3	0	125.6
33	L	36.1	Very low	34.2	Very low	109 Å²	109	131.7 Å²	131.7	57%	0.571	67%	0.669	S	S	*	*			trans	79.8	156.4	146.3	-97.9	55	0	0	0	119.3	Y1779	L33-Y1779 HydrophobicContact CD1-CE2 4.21Å
34	H	36.6	Very low	34.4	Very low	149 Å²	149	135.6 Å²	135.6	69%	0.69	68%	0.68	S	S	*	*			cis	-167.8	156.1	13	-138.4	-9.5	0	0	0	117.7
35	I	36.2	Very low	34.6	Very low	100 Å²	100	132.8 Å²	132.8	51%	0.513	68%	0.675	S	S	.	*			trans	58	142.8	151.4	-15.8	169.8	0	0	0	126.4	I37	I35-I37 HydrophobicContact CG2-CD1 3.52Å; I35-I37 HydrophobicContact CG2-CG1 4.25Å
36	F	37	Very low	34.8	Very low	177 Å²	177	133 Å²	133	78%	0.776	68%	0.676	S	S	*	*			trans	122.1	104.2	140	-79.5	-78.6	0	0	0	115
37	I	34.5	Very low	34.8	Very low	121 Å²	121	132.9 Å²	132.9	62%	0.621	68%	0.675	S	S	*	*			cis	105.1	157.2	39.2	-71.1	169.8	0	0	0	111.1	I35	I35-I37 HydrophobicContact CG2-CD1 3.52Å; I35-I37 HydrophobicContact CG2-CG1 4.25Å
38	I	37.1	Very low	34.8	Very low	150 Å²	150	134.1 Å²	134.1	77%	0.769	68%	0.681	S	S	*	*			trans	80.3	103.3	-172.7	-50.9	-173.6	0	0	0	111.7
39	T	36.8	Very low	34.5	Very low	50 Å²	50	130.8 Å²	130.8	31%	0.307	68%	0.675	S	S	.	*			cis	69.7	115.6	20.1	87.7	0	0	0	0	112.3	T1774 S1775	T39-T1774 WeakPolarHBondContact CB-O 3.06Å; T39-T1774 WeakPolarHBondContact CG2-O 3.33Å; T39-S1775 VanDerWaalsContact CG2-O 3.27Å; T39-S1775 WeakPolarHBondContact CG2-O 3.29Å
40	L	36.5	Very low	34.2	Very low	75 Å²	75	129.4 Å²	129.4	39%	0.393	67%	0.673	S	S	.	*				168.2	176.7	88.6	-74.5	-169.2	0	0	0	112.9	L1772 E1773	L40-L1772 HydrophobicContact CD1-CD2 4Å; L40-L1772 HydrophobicContact CD1-CG 4.11Å; L40-E1773 HydrophobicContact CD2-CB 3.51Å; L40-E1773 HydrophobicContact CD2-CG 3.57Å; L40-E1773 WeakPolarHBondContact CD2-O 3.5Å
41	L	38.8	Very low	33.8	Very low	125 Å²	125	129.6 Å²	129.6	65%	0.654	67%	0.667	S	S	*	*			trans	99.2	100.3	154.8	-54.6	-178.4	0	0	0	119.6	E1773	L41-E1773 WeakPolarHBondContact CA-OE1 3.39Å; L41-E1773 PolarHBondContact N-OE1 2.84Å
42	I	34.6	Very low	33.3	Very low	142 Å²	142	130.3 Å²	130.3	73%	0.728	67%	0.666	S	S	*	*				43.7	135.9	120.9	-54.7	171.8	0	0	0	117.8	E1773	I42-E1773 PolarHBondContact N-OE1 2.95Å; I42-E1773 VanDerWaalsContact N-OE1 3.14Å
43	G	37.3	Very low	32.8	Very low	61 Å²	61	130.7 Å²	130.7	63%	0.629	67%	0.668	S	S	*	*			cis	131.4	150.8	9.9	0	0	0	0	0	111.5
44	W	31.3	Very low	32.5	Very low	226 Å²	226	132.5 Å²	132.5	86%	0.856	67%	0.673	S	S	*	*			trans	44.6	114	166.7	-83.4	50.3	0	0	0	119.9
45	F	30.8	Very low	31.8	Very low	172 Å²	172	133.8 Å²	133.8	75%	0.754	68%	0.679	S	S	*	*				167.8	159.7	112.1	-101	-66.9	0	0	0	114.2
46	I	34.1	Very low	31.3	Very low	136 Å²	136	135.1 Å²	135.1	70%	0.697	70%	0.696	S	S	*	*			trans	66	99.9	148.6	-72.4	163.3	0	0	0	118
47	D	29.8	Very low	30.7	Very low	128 Å²	128	132.1 Å²	132.1	68%	0.684	69%	0.688	S	S	*	*				46.1	134.7	109.1	-82.3	-58.9	0	0	0	121.9
48	F	29.3	Very low	30.3	Very low	194 Å²	194	133.5 Å²	133.5	85%	0.851	69%	0.692	S	S	*	*			trans	64.8	154.1	158.7	-77.4	-124.4	0	0	0	116.4
49	A	27.7	Very low	29.9	Very low	73 Å²	73	133 Å²	133	60%	0.603	69%	0.691	S	S	*	*			cis	-159.2	164.6	-25.6	0	0	0	0	0	109.6
50	L	26.5	Very low	29.7	Very low	161 Å²	161	137.6 Å²	137.6	84%	0.843	72%	0.719	S	S	*	*			trans	18.2	121.7	157.3	-81.8	78.1	0	0	0	120.2
51	A	25.9	Very low	29.6	Very low	79 Å²	79	139.4 Å²	139.4	65%	0.653	74%	0.737	S	S	*	*				81.8	134.6	122	0	0	0	0	0	120.6
52	E	27.3	Very low	29.3	Very low	161 Å²	161	144.5 Å²	144.5	75%	0.752	75%	0.749	S	S	*	*			trans	40.2	128.7	143.5	-50.1	171.2	167.2	0	0	120.1
53	K	24.4	Very low	29.1	Very low	156 Å²	156	142.3 Å²	142.3	68%	0.678	75%	0.746	S	S	*	*				172.7	171.9	101.6	-96.5	162.3	-171.8	156.4	0	114.7
54	H	28.8	Very low	28.9	Very low	146 Å²	146	145.3 Å²	145.3	68%	0.676	75%	0.752	S	S	*	*			trans	102	111.2	150.4	-60.3	-62.2	0	0	0	116.1
55	E	23.5	Very low	28.7	Very low	176 Å²	176	141.7 Å²	141.7	82%	0.822	75%	0.749	S	S	*	*	S	Bend	cis	53.6	90.8	9.9	-163.6	169.7	-119.6	0	0	114.9	N57	E55-N57 PolarHBondContact O-N 2.81Å
56	C	25.3	Very low	28.7	Very low	128 Å²	128	139.1 Å²	139.1	87%	0.865	75%	0.752	S	S	*	*			trans	-57	127.3	-178.9	-178.3	0	0	0	0	112.1
57	N	24.6	Very low	28.6	Very low	115 Å²	115	139.3 Å²	139.3	62%	0.615	75%	0.754	S	S	*	*			trans	-144.3	109.6	164.6	-149.1	-0.9	0	0	0	112	E55	E55-N57 PolarHBondContact O-N 2.81Å
58	Q	25.3	Very low	28.6	Very low	150 Å²	150	139.2 Å²	139.2	70%	0.701	76%	0.759	S	S	*	*	S	Bend	trans	57.1	110.9	156.1	-67.3	168.6	49	0	0	120
59	N	28.6	Very low	28.5	Very low	140 Å²	140	134.1 Å²	134.1	75%	0.749	75%	0.752	S	S	*	*			trans	73	74.7	138.1	-53.4	-17.2	0	0	0	119.9
60	T	33.6	Very low	28.6	Very low	145 Å²	145	135 Å²	135	89%	0.89	76%	0.76	S	S	*	*				-168.7	139.2	111.6	16.9	0	0	0	0	111.9
61	C	33.8	Very low	29.1	Very low	114 Å²	114	138.9 Å²	138.9	77%	0.77	76%	0.764	S	S	*	*			trans	-136.5	176.9	-176.1	-70.9	0	0	0	0	111
62	Y	32.3	Very low	30.1	Very low	231 Å²	231	138 Å²	138	91%	0.906	75%	0.749	S	S	*	*			trans	75.5	144.4	-175.8	-57.1	-84.4	0	0	0	114.3
63	S	30.1	Very low	31.4	Very low	97 Å²	97	136.8 Å²	136.8	68%	0.678	75%	0.747	S	S	*	*			cis	-159.3	158	-13.3	43.3	0	0	0	0	107.9
64	V	33.4	Very low	34.1	Very low	123 Å²	123	132 Å²	132	75%	0.745	73%	0.727	S	S	*	*				174.4	111.7	87	161.1	0	0	0	0	104.8
65	L	28.4	Very low	36.9	Very low	150 Å²	150	126 Å²	126	79%	0.785	70%	0.701	S	S	*	*				73.6	82.5	89	-74.5	168.6	0	0	0	118.1
66	S	30.1	Very low	39.9	Very low	118 Å²	118	123.1 Å²	123.1	83%	0.825	69%	0.692	S	S	*	*			trans	178	141.6	140	58.9	0	0	0	0	110.1
67	D	32.5	Very low	43	Very low	140 Å²	140	124 Å²	124	75%	0.749	68%	0.677	S	S	*	*			cis	-139.4	89.3	-7.3	-163.5	-3.9	0	0	0	112.7	A69	D67-A69 VanDerWaalsContact C-N 3.34Å; D67-A69 PolarHBondContact O-N 2.94Å
68	T	28.8	Very low	46	Very low	126 Å²	126	118.9 Å²	118.9	77%	0.773	65%	0.65	S	S	*	*				35.9	30.3	124.5	17.5	0	0	0	0	124
69	A	27.5	Very low	49	Very low	87 Å²	87	115.1 Å²	115.1	72%	0.719	64%	0.638	S	S	*	*			trans	-108.6	128	163	0	0	0	0	0	113.6	D67 R71	D67-A69 VanDerWaalsContact C-N 3.34Å; D67-A69 PolarHBondContact O-N 2.94Å; A69-R71 PolarHBondContact O-N 3.12Å
70	A	30.4	Very low	51.8	Low	93 Å²	93	113.6 Å²	113.6	77%	0.769	63%	0.634	S	S	*	*			trans	60.1	33.9	163.7	0	0	0	0	0	119.7	V72	A70-V72 VanDerWaalsContact C-N 3.33Å; A70-V72 PolarHBondContact O-N 3.35Å
71	R	36.7	Very low	54.3	Low	242 Å²	242	111.9 Å²	111.9	91%	0.913	62%	0.615	S	S	*	*			trans	-64	95.1	154.6	-90.8	-169	176.4	-173.2	0.1	109.4	A69 I73	A69-R71 PolarHBondContact O-N 3.12Å; R71-I73 VanDerWaalsContact C-N 3.29Å; R71-I73 PolarHBondContact O-N 2.67Å
72	V	46	Very low	56.8	Low	59 Å²	59	108.5 Å²	108.5	36%	0.358	59%	0.588	S	S	.	*			trans	-72.7	83.4	176	-176.7	0	0	0	0	109.4	A70 Q74	A70-V72 VanDerWaalsContact C-N 3.33Å; A70-V72 PolarHBondContact O-N 3.35Å; V72-Q74 PolarHBondContact O-N 3.13Å; V72-Q74 VanDerWaalsContact O-N 3.11Å; V72-Q74 PolarHBondContact O-NE2 3.12Å
73	I	55.2	Low	59.5	Low	136 Å²	136	101.5 Å²	101.5	70%	0.697	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-52.3	118.6	176	-59.3	175.9	0	0	0	108.7	R71	R71-I73 VanDerWaalsContact C-N 3.29Å; R71-I73 PolarHBondContact O-N 2.67Å
74	Q	82.1	Confident	62.2	Low	55 Å²	55	104.6 Å²	104.6	26%	0.257	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-80.3	129.5	172.6	-60.4	-63.7	-62.1	0	0	108.2	V72 R182 R183	V72-Q74 PolarHBondContact O-N 3.13Å; V72-Q74 VanDerWaalsContact O-N 3.11Å; V72-Q74 PolarHBondContact O-NE2 3.12Å; Q74-R182 CarbonylContact C-O 3.58Å; Q74-R182 WeakPolarHBondContact CA-O 3.3Å; Q74-R183 VanDerWaalsContact OE1-CA 3.3Å
75	S	86	Confident	64.7	Low	20 Å²	20	105 Å²	105	14%	0.14	56%	0.555	C	S	.	*	P	Polyproline II helix	trans	-76.7	147.7	178.3	-48.7	0	0	0	0	110.5	L181 R182 R183	S75-L181 VanDerWaalsContact OG-CA 3.28Å; S75-L181 WeakPolarHBondContact OG-CA 3.37Å; S75-R182 PolarHBondContact N-O 2.79Å; S75-R182 PolarHBondContact OG-N 3.49Å; S75-R183 WeakPolarHBondContact O-CD 3.49Å; S75-R183 PolarHBondContact O-NH1 3.46Å
76	N	88.3	Confident	67.6	Low	116 Å²	116	106.8 Å²	106.8	62%	0.62	55%	0.552	S	S	*	*			trans	-98.8	-177.8	175.8	-70.5	-34.8	0	0	0	110.9	R183	N76-R183 PolarHBondContact OD1-NH1 2.84Å
77	R	89.1	Confident	70.3	Confident	146 Å²	146	103.2 Å²	103.2	55%	0.551	52%	0.523	S	S	*	.	B	Isolated β-bridge	trans	-70	147.1	175	-165.8	178.3	-179.1	-178.1	0.4	110.1	T79 F90 E91 L93	R77-T79 PolarHBondContact O-N 2.73Å; R77-F90 CarbonylContact C-O 3.47Å; R77-F90 VanDerWaalsContact CA-O 3.26Å; R77-F90 WeakPolarHBondContact CA-O 3.37Å; R77-F90 WeakPolarHBondContact CG-O 3.26Å; R77-E91 IonicContact CZ-OE1 2.75Å; R77-E91 PolarHBondContact NE-O 2.82Å; R77-E91 IonicContact NE-OE1 3.64Å; R77-E91 PolarHBondContact NE-OE1 3.46Å; R77-E91 PolarHBondContact NH2-O 2.96Å; R77-E91 IonicContact NH2-OE1 3.98Å; R77-E91 PolarHBondContact NH2-OE1 2.92Å; R77-L93 HydrophobicContact CB-CD1 4.11Å; R77-L93 HydrophobicContact CB-CG 4.46Å
78	C	87.8	Confident	73.2	Confident	9 Å²	9	96.5 Å²	96.5	6%	0.061	49%	0.487	C	S	.	.			trans	-40.2	120.7	179.6	-73.6	0	0	0	0	113.9	R83 C89 F90	C78-R83 HydrophobicContact CB-CG 4.07Å; C78-R83 VanDerWaalsContact CB-CZ 3.46Å; C78-R83 PolarHBondContact O-NH1 2.89Å; C78-C89 HydrophobicContact CB-CB 3.88Å; C78-C89 WeakPolarHBondContact CB-SG 3.47Å; C78-C89 WeakPolarHBondContact SG-CB 3.33Å; C78-C89 PolarHBondContact SG-O 3.47Å; C78-C89 CovalentContact SG-SG 2.03Å; C78-C89 PolarHBondContact SG-SG 3.09Å; C78-F90 PolarHBondContact N-O 2.78Å; C78-F90 PolarHBondContact SG-O 2.77Å; C78-F90 VanDerWaalsContact SG-O 3.34Å
79	T	88.8	Confident	76.2	Confident	71 Å²	71	90.6 Å²	90.6	44%	0.436	45%	0.451	S	S	.	.			trans	-69.4	161.7	165.3	64	0	0	0	0	111	R77 E81 E82 R83	R77-T79 PolarHBondContact O-N 2.73Å; T79-E81 VanDerWaalsContact C-N 3.28Å; T79-E81 PolarHBondContact O-N 3.2Å; T79-E82 WeakPolarHBondContact CB-OE2 3.09Å; T79-E82 WeakPolarHBondContact CG2-OE2 3.28Å; T79-E82 PolarHBondContact N-OE2 3.49Å; T79-E82 WeakPolarHBondContact OG1-CB 3.38Å; T79-E82 VanDerWaalsContact OG1-CD 3.3Å; T79-E82 VanDerWaalsContact OG1-CG 3.24Å; T79-E82 WeakPolarHBondContact OG1-CG 3.41Å; T79-E82 PolarHBondContact OG1-N 2.71Å; T79-E82 PolarHBondContact OG1-OE2 3.07Å; T79-R83 WeakPolarHBondContact O-CG 3.24Å; T79-R83 PolarHBondContact O-N 2.82Å
80	T	87	Confident	79.3	Confident	108 Å²	108	86.4 Å²	86.4	66%	0.663	42%	0.417	S	S	*	.	H	α-helix	trans	-62.8	-35.7	173.4	39.4	0	0	0	0	112.4	R83 Q84	T80-R83 PolarHBondContact O-N 2.88Å; T80-Q84 WeakPolarHBondContact O-CG 3.47Å; T80-Q84 PolarHBondContact O-N 3.43Å
81	E	86	Confident	82.3	Confident	108 Å²	108	84 Å²	84	51%	0.505	39%	0.389	S	S	.	.	H	α-helix	trans	-67.3	-44.5	179.1	-172.1	179.7	169.2	0	0	112.3	T79 R83 Q84 K85	T79-E81 VanDerWaalsContact C-N 3.28Å; T79-E81 PolarHBondContact O-N 3.2Å; E81-R83 VanDerWaalsContact C-N 3.32Å; E81-R83 PolarHBondContact O-N 2.74Å; E81-Q84 PolarHBondContact O-N 2.72Å; E81-K85 HydrophobicContact CG-CD 3.95Å; E81-K85 HydrophobicContact CG-CG 4.41Å; E81-K85 WeakPolarHBondContact O-CB 3.22Å; E81-K85 PolarHBondContact O-N 3.08Å; E81-K85 VanDerWaalsContact OE1-CE 3.29Å; E81-K85 WeakPolarHBondContact OE1-CE 3.03Å; E81-K85 IonicContact OE1-NZ 3.33Å; E81-K85 PolarHBondContact OE1-NZ 3.44Å
82	E	86.9	Confident	85	Confident	43 Å²	43	74.6 Å²	74.6	20%	0.201	36%	0.359	C	S	.	.	H	α-helix	trans	-60.7	-41.8	175	-71.4	162	124.6	0	0	111.6	T79 R86 I87 C89	T79-E82 WeakPolarHBondContact CB-OE2 3.09Å; T79-E82 WeakPolarHBondContact CG2-OE2 3.28Å; T79-E82 PolarHBondContact N-OE2 3.49Å; T79-E82 WeakPolarHBondContact OG1-CB 3.38Å; T79-E82 VanDerWaalsContact OG1-CD 3.3Å; T79-E82 VanDerWaalsContact OG1-CG 3.24Å; T79-E82 WeakPolarHBondContact OG1-CG 3.41Å; T79-E82 PolarHBondContact OG1-N 2.71Å; T79-E82 PolarHBondContact OG1-OE2 3.07Å; E82-R86 PolarHBondContact O-N 2.76Å; E82-R86 VanDerWaalsContact O-N 3.15Å; E82-I87 HydrophobicContact CB-CB 4.19Å; E82-I87 HydrophobicContact CG-CB 4.28Å; E82-I87 HydrophobicContact CG-CG2 4.26Å; E82-I87 PolarHBondContact O-N 2.94Å; E82-C89 HydrophobicContact CB-CB 4.1Å; E82-C89 HydrophobicContact CG-CB 4.39Å
83	R	89.3	Confident	87.2	Confident	85 Å²	85	73.7 Å²	73.7	32%	0.321	35%	0.352	S	S	.	.	H	α-helix	trans	-60.7	-45.2	175.4	-65.6	-154.7	-177	80	-9.9	111.6	C78 T79 T80 E81 R86 E91 L113	C78-R83 HydrophobicContact CB-CG 4.07Å; C78-R83 VanDerWaalsContact CB-CZ 3.46Å; C78-R83 PolarHBondContact O-NH1 2.89Å; T79-R83 WeakPolarHBondContact O-CG 3.24Å; T79-R83 PolarHBondContact O-N 2.82Å; T80-R83 PolarHBondContact O-N 2.88Å; E81-R83 VanDerWaalsContact C-N 3.32Å; E81-R83 PolarHBondContact O-N 2.74Å; R83-R86 PolarHBondContact O-N 2.85Å; R83-E91 IonicContact CZ-OE2 2.64Å; R83-E91 VanDerWaalsContact CZ-OE2 3.25Å; R83-E91 IonicContact NE-OE2 2.72Å; R83-E91 PolarHBondContact NE-OE2 2.76Å; R83-E91 IonicContact NH2-OE1 3.13Å; R83-E91 PolarHBondContact NH2-OE1 2.82Å; R83-E91 IonicContact NH2-OE2 3.93Å; R83-E91 PolarHBondContact NH2-OE2 3.13Å; R83-L113 HydrophobicContact CB-CD2 4.48Å; R83-L113 HydrophobicContact CG-CD2 3.63Å
84	Q	86.9	Confident	88.9	Confident	162 Å²	162	67.4 Å²	67.4	76%	0.757	32%	0.32	S	S	*	.	H	α-helix	trans	-67.9	-44.3	179.7	-74.6	176.6	-8.1	0	0	112.8	T80 E81 R86	T80-Q84 WeakPolarHBondContact O-CG 3.47Å; T80-Q84 PolarHBondContact O-N 3.43Å; E81-Q84 PolarHBondContact O-N 2.72Å; Q84-R86 PolarHBondContact O-N 3.28Å
85	K	84.8	Confident	89.4	Confident	130 Å²	130	67.6 Å²	67.6	57%	0.565	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	1	179.8	-68.8	-176.3	175.1	176.3	0	114	E81 I87	E81-K85 HydrophobicContact CG-CD 3.95Å; E81-K85 HydrophobicContact CG-CG 4.41Å; E81-K85 WeakPolarHBondContact O-CB 3.22Å; E81-K85 PolarHBondContact O-N 3.08Å; E81-K85 VanDerWaalsContact OE1-CE 3.29Å; E81-K85 WeakPolarHBondContact OE1-CE 3.03Å; E81-K85 IonicContact OE1-NZ 3.33Å; E81-K85 PolarHBondContact OE1-NZ 3.44Å; K85-I87 HydrophobicContact CB-CD1 3.68Å; K85-I87 HydrophobicContact CB-CG1 3.76Å; K85-I87 HydrophobicContact CD-CD1 3.98Å; K85-I87 HydrophobicContact CG-CD1 4.47Å; K85-I87 PolarHBondContact O-N 2.87Å
86	R	88.8	Confident	89.5	Confident	189 Å²	189	74 Å²	74	71%	0.713	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	32.6	-172.9	-60.7	-175.3	177.5	-176.3	-1.2	113.5	E82 R83 Q84 N114 H178	E82-R86 PolarHBondContact O-N 2.76Å; E82-R86 VanDerWaalsContact O-N 3.15Å; R83-R86 PolarHBondContact O-N 2.85Å; Q84-R86 PolarHBondContact O-N 3.28Å; R86-N114 WeakPolarHBondContact CA-ND2 3.38Å; R86-N114 WeakPolarHBondContact O-CB 3.23Å; R86-H178 PolarHBondContact O-CE1 2.91Å
87	I	87.9	Confident	89.6	Confident	42 Å²	42	73.7 Å²	73.7	22%	0.215	35%	0.35	C	S	.	.			trans	-79.1	147.3	174.5	-61.8	171	0	0	0	108.3	E82 K85 N114 P179	E82-I87 HydrophobicContact CB-CB 4.19Å; E82-I87 HydrophobicContact CG-CB 4.28Å; E82-I87 HydrophobicContact CG-CG2 4.26Å; E82-I87 PolarHBondContact O-N 2.94Å; K85-I87 HydrophobicContact CB-CD1 3.68Å; K85-I87 HydrophobicContact CB-CG1 3.76Å; K85-I87 HydrophobicContact CD-CD1 3.98Å; K85-I87 HydrophobicContact CG-CD1 4.47Å; K85-I87 PolarHBondContact O-N 2.87Å; I87-N114 WeakPolarHBondContact O-CB 3.5Å; I87-N114 PolarHBondContact O-ND2 3.14Å; I87-P179 HydrophobicContact CG2-CG 3.97Å
88	Q	92.5	Very high	89.7	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	33%	0.33	C	S	.	.			trans	-76.5	131.7	-178.6	81	-173.9	-4.8	0	0	110.9	L113 N114 T171 H178 P179 L181	Q88-L113 WeakPolarHBondContact CA-O 3.26Å; Q88-N114 WeakPolarHBondContact CA-O 3.19Å; Q88-N114 WeakPolarHBondContact CB-O 3.43Å; Q88-T171 PolarHBondContact NE2-O 2.83Å; Q88-H178 HydrophobicContact CG-CB 3.97Å; Q88-H178 PolarHBondContact N-ND1 3Å; Q88-P179 PolarHBondContact NE2-O 2.82Å; Q88-L181 HydrophobicContact CG-CD1 4.13Å; Q88-L181 HydrophobicContact CG-CG 4.39Å
89	C	92.4	Very high	89.7	Confident	1 Å²	1	70.3 Å²	70.3	1%	0.007	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	162.8	-176.2	57.9	0	0	0	0	110.9	C78 E82 E91 V112 L113	C78-C89 HydrophobicContact CB-CB 3.88Å; C78-C89 WeakPolarHBondContact CB-SG 3.47Å; C78-C89 WeakPolarHBondContact SG-CB 3.33Å; C78-C89 PolarHBondContact SG-O 3.47Å; C78-C89 CovalentContact SG-SG 2.03Å; C78-C89 PolarHBondContact SG-SG 3.09Å; E82-C89 HydrophobicContact CB-CB 4.1Å; E82-C89 HydrophobicContact CG-CB 4.39Å; C89-E91 PolarHBondContact O-N 2.8Å; C89-V112 CarbonylContact O-C 3.51Å; C89-V112 WeakPolarHBondContact O-CA 3.28Å; C89-L113 PolarHBondContact N-O 3.19Å; C89-L113 VanDerWaalsContact N-O 3.14Å; C89-L113 PolarHBondContact O-N 2.95Å
90	F	93.4	Very high	89.8	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	120	177.4	-71	-53.4	0	0	0	111.4	R77 C78 L93 C110 V111 V112 V170 L181 R183	R77-F90 CarbonylContact C-O 3.47Å; R77-F90 VanDerWaalsContact CA-O 3.26Å; R77-F90 WeakPolarHBondContact CA-O 3.37Å; R77-F90 WeakPolarHBondContact CG-O 3.26Å; C78-F90 PolarHBondContact N-O 2.78Å; C78-F90 PolarHBondContact SG-O 2.77Å; C78-F90 VanDerWaalsContact SG-O 3.34Å; F90-L93 HydrophobicContact CB-CD2 3.55Å; F90-L93 HydrophobicContact CB-CG 4.42Å; F90-L93 HydrophobicContact CD2-CD2 3.55Å; F90-L93 HydrophobicContact CE2-CD2 4.46Å; F90-L93 HydrophobicContact CG-CD2 3.8Å; F90-C110 WeakPolarHBondContact CE1-SG 3.35Å; F90-V111 CarbonylContact C-O 3.5Å; F90-V111 WeakPolarHBondContact CA-O 3.32Å; F90-V112 HydrophobicContact CD1-CG2 3.97Å; F90-V112 HydrophobicContact CE1-CG2 4.03Å; F90-V170 HydrophobicContact CE1-CG2 3.76Å; F90-V170 HydrophobicContact CZ-CG2 4.16Å; F90-L181 HydrophobicContact CD1-CD1 4.35Å; F90-L181 HydrophobicContact CD2-CB 4.27Å; F90-L181 HydrophobicContact CE1-CB 4.21Å; F90-L181 HydrophobicContact CE1-CD1 4.4Å; F90-L181 HydrophobicContact CE2-CB 3.69Å; F90-L181 HydrophobicContact CG-CD1 4.45Å; F90-L181 HydrophobicContact CZ-CB 3.65Å; F90-R183 HydrophobicContact CD2-CB 4.34Å; F90-R183 HydrophobicContact CE2-CB 3.77Å; F90-R183 HydrophobicContact CZ-CB 4.29Å
91	E	93	Very high	89.8	Confident	41 Å²	41	64.2 Å²	64.2	19%	0.192	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	-36.3	169.7	-172.6	52.6	-109.4	0	0	111.4	R77 R83 C89 V111 L113	R77-E91 IonicContact CZ-OE1 2.75Å; R77-E91 PolarHBondContact NE-O 2.82Å; R77-E91 IonicContact NE-OE1 3.64Å; R77-E91 PolarHBondContact NE-OE1 3.46Å; R77-E91 PolarHBondContact NH2-O 2.96Å; R77-E91 IonicContact NH2-OE1 3.98Å; R77-E91 PolarHBondContact NH2-OE1 2.92Å; R83-E91 IonicContact CZ-OE2 2.64Å; R83-E91 VanDerWaalsContact CZ-OE2 3.25Å; R83-E91 IonicContact NE-OE2 2.72Å; R83-E91 PolarHBondContact NE-OE2 2.76Å; R83-E91 IonicContact NH2-OE1 3.13Å; R83-E91 PolarHBondContact NH2-OE1 2.82Å; R83-E91 IonicContact NH2-OE2 3.93Å; R83-E91 PolarHBondContact NH2-OE2 3.13Å; C89-E91 PolarHBondContact O-N 2.8Å; E91-V111 HydrophobicContact CB-CG1 4.31Å; E91-V111 PolarHBondContact N-O 2.96Å; E91-L113 HydrophobicContact CB-CB 4.22Å
92	V	92.1	Very high	89.9	Confident	45 Å²	45	62.9 Å²	62.9	27%	0.273	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	129.7	174.5	-173.4	0	0	0	0	109.2	Q109 V111	V92-Q109 HydrophobicContact CG1-CB 4.09Å; V92-V111 HydrophobicContact CB-CB 3.84Å; V92-V111 HydrophobicContact CB-CG2 3.83Å; V92-V111 HydrophobicContact CG2-CB 3.99Å; V92-V111 HydrophobicContact CG2-CG2 3.96Å; V92-V111 PolarHBondContact N-O 2.58Å; V92-V111 PolarHBondContact O-N 3.09Å; V92-V111 VanDerWaalsContact O-N 3.07Å
93	L	92.3	Very high	89.9	Confident	40 Å²	40	62.6 Å²	62.6	21%	0.209	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-97.3	148.7	178.8	-60.4	168.4	0	0	0	109.9	R77 F90 Q109 R183	R77-L93 HydrophobicContact CB-CD1 4.11Å; R77-L93 HydrophobicContact CB-CG 4.46Å; F90-L93 HydrophobicContact CB-CD2 3.55Å; F90-L93 HydrophobicContact CB-CG 4.42Å; F90-L93 HydrophobicContact CD2-CD2 3.55Å; F90-L93 HydrophobicContact CE2-CD2 4.46Å; F90-L93 HydrophobicContact CG-CD2 3.8Å; L93-Q109 CarbonylContact C-O 3.5Å; L93-R183 HydrophobicContact CB-CG 4.34Å; L93-R183 HydrophobicContact CD2-CB 4.29Å; L93-R183 HydrophobicContact CD2-CG 3.91Å
94	P	92.5	Very high	89.8	Confident	5 Å²	5	63.4 Å²	63.4	3%	0.032	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-54.5	144.2	162.4	-21.7	28.7	0	0	0	111.8	Q109 W121 C168 R183 T185	P94-Q109 VanDerWaalsContact CA-O 3.25Å; P94-Q109 WeakPolarHBondContact CA-O 3.41Å; P94-Q109 WeakPolarHBondContact CD-O 3.44Å; P94-Q109 WeakPolarHBondContact CG-O 3.31Å; P94-W121 HydrophobicContact CB-CH2 4.36Å; P94-W121 HydrophobicContact CG-CH2 3.78Å; P94-W121 HydrophobicContact CG-CZ3 4.37Å; P94-C168 HydrophobicContact CG-CB 4.37Å; P94-R183 HydrophobicContact CG-CB 4.48Å; P94-R183 HydrophobicContact CG-CG 4.34Å; P94-T185 HydrophobicContact CB-CG2 4Å
95	S	91.6	Very high	90	Very high	59 Å²	59	59.1 Å²	59.1	41%	0.413	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-61.8	154.2	166.7	-54.4	0	0	0	0	110.5	Q97 Y98 T185	S95-Q97 PolarHBondContact O-N 2.84Å; S95-Y98 PolarHBondContact N-OH 2.9Å; S95-Y98 VanDerWaalsContact N-OH 3.14Å; S95-Y98 PolarHBondContact OG-OH 3.3Å; S95-T185 WeakPolarHBondContact O-CB 3.34Å; S95-T185 PolarHBondContact O-OG1 2.9Å
96	E	88.3	Confident	90.4	Very high	153 Å²	153	53.1 Å²	53.1	72%	0.715	28%	0.279	S	S	*	.	S	Bend	trans	-68.6	-37	-177.4	-56.8	-166.1	152.3	0	0	112.4	R183 Y186	E96-R183 IonicContact OE1-NH2 2.71Å; E96-Y186 PolarHBondContact O-N 3.12Å
97	Q	89.8	Confident	90.6	Very high	111 Å²	111	47.7 Å²	47.7	52%	0.519	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	143.5	173.7	-176	170.2	-14.7	0	0	111.1	S95 Y186 E188	S95-Q97 PolarHBondContact O-N 2.84Å; Q97-Y186 CarbonylContact C-O 3.6Å; Q97-Y186 VanDerWaalsContact CA-O 3.28Å; Q97-Y186 WeakPolarHBondContact CA-O 3.4Å; Q97-E188 PolarHBondContact NE2-OE2 2.83Å
98	Y	91.1	Very high	90.9	Very high	32 Å²	32	45.7 Å²	45.7	13%	0.125	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	122.4	168.8	-67.7	-90.9	0	0	0	108.5	S95 V106 M108 Q109 T185 Y186 E188	S95-Y98 PolarHBondContact N-OH 2.9Å; S95-Y98 VanDerWaalsContact N-OH 3.14Å; S95-Y98 PolarHBondContact OG-OH 3.3Å; Y98-V106 HydrophobicContact CD1-CG2 4.09Å; Y98-V106 HydrophobicContact CG-CG2 4.19Å; Y98-M108 HydrophobicContact CD2-CG 3.8Å; Y98-M108 HydrophobicContact CD2-SD 4.44Å; Y98-M108 HydrophobicContact CE2-CB 4.1Å; Y98-M108 HydrophobicContact CE2-CG 3.7Å; Y98-M108 HydrophobicContact CG-CG 4.37Å; Y98-Q109 PolarHBondContact OH-N 2.87Å; Y98-T185 VanDerWaalsContact CD2-OG1 3.3Å; Y98-T185 WeakPolarHBondContact CD2-OG1 3.43Å; Y98-T185 WeakPolarHBondContact CE2-OG1 3.19Å; Y98-Y186 PolarHBondContact N-O 3.29Å; Y98-E188 PolarHBondContact O-N 3.35Å
99	A	88.4	Confident	90.9	Very high	52 Å²	52	50.4 Å²	50.4	43%	0.43	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	115.2	177.9	0	0	0	0	0	110.2	E188 L190	A99-E188 WeakPolarHBondContact CA-O 3.5Å; A99-E188 HydrophobicContact CB-CB 4.43Å; A99-L190 HydrophobicContact CB-CD1 4.15Å; A99-L190 HydrophobicContact CB-CD2 4.31Å; A99-L190 HydrophobicContact CB-CG 4.3Å
100	I	90.6	Very high	91	Very high	30 Å²	30	50.3 Å²	50.3	15%	0.154	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	130.2	-163.3	-57.5	-69.6	0	0	0	110	H104 V106 V158 L187 E188 V189 L190	I100-H104 HydrophobicContact CG2-CB 3.84Å; I100-V106 HydrophobicContact CD1-CB 4.16Å; I100-V106 HydrophobicContact CD1-CG2 3.91Å; I100-V106 HydrophobicContact CG1-CB 3.91Å; I100-V106 HydrophobicContact CG1-CG2 3.78Å; I100-V106 HydrophobicContact CG2-CB 4.49Å; I100-V158 HydrophobicContact CG2-CB 4.37Å; I100-V158 HydrophobicContact CG2-CG2 4.29Å; I100-L187 HydrophobicContact CB-CD1 4.38Å; I100-L187 HydrophobicContact CG1-CD1 3.97Å; I100-E188 PolarHBondContact N-O 3.25Å; I100-V189 CarbonylContact O-C 3.56Å; I100-V189 VanDerWaalsContact O-CA 3.32Å; I100-V189 WeakPolarHBondContact O-CA 3.47Å; I100-L190 PolarHBondContact O-N 3.31Å
101	P	87.7	Confident	91	Very high	20 Å²	20	51.4 Å²	51.4	13%	0.13	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	148.1	176.5	-17.4	30.4	0	0	0	113.1	G103 H104 L190 I313	P101-G103 PolarHBondContact O-N 3.12Å; P101-H104 VanDerWaalsContact O-CB 3.32Å; P101-H104 WeakPolarHBondContact O-CB 3.45Å; P101-H104 PolarHBondContact O-N 3.47Å; P101-H104 VanDerWaalsContact O-N 3.12Å; P101-H104 PolarHBondContact O-ND1 3.4Å; P101-L190 WeakPolarHBondContact CA-O 3.34Å; P101-I313 HydrophobicContact CG-CD1 3.77Å; P101-I313 HydrophobicContact CG-CG2 4.23Å
102	L	88	Confident	91.1	Very high	80 Å²	80	49.6 Å²	49.6	42%	0.419	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	136.8	174.4	-165.9	75.2	0	0	0	111.7	H104 V158 R160 V189 L190	L102-H104 VanDerWaalsContact C-N 3.27Å; L102-H104 PolarHBondContact O-N 3.02Å; L102-H104 PolarHBondContact O-ND1 2.68Å; L102-H104 VanDerWaalsContact O-ND1 3.14Å; L102-V158 WeakPolarHBondContact CD1-O 3.31Å; L102-R160 HydrophobicContact CD1-CB 4.34Å; L102-R160 VanDerWaalsContact CD1-N 3.31Å; L102-V189 HydrophobicContact CB-CG1 4.34Å; L102-V189 HydrophobicContact CD1-CG1 3.89Å; L102-L190 PolarHBondContact N-O 3.25Å
103	G	85.6	Confident	91	Very high	37 Å²	37	50.2 Å²	50.2	38%	0.381	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	-3.2	-179.3	0	0	0	0	0	116.1	P101 V158	P101-G103 PolarHBondContact O-N 3.12Å; G103-V158 PolarHBondContact N-O 3.43Å
104	H	87.7	Confident	90.9	Very high	103 Å²	103	50.5 Å²	50.5	48%	0.477	28%	0.277	S	S	.	.			trans	-85	172.5	177.1	-67.2	55.7	0	0	0	111.6	I100 P101 L102 D157 V158	I100-H104 HydrophobicContact CG2-CB 3.84Å; P101-H104 VanDerWaalsContact O-CB 3.32Å; P101-H104 WeakPolarHBondContact O-CB 3.45Å; P101-H104 PolarHBondContact O-N 3.47Å; P101-H104 VanDerWaalsContact O-N 3.12Å; P101-H104 PolarHBondContact O-ND1 3.4Å; L102-H104 VanDerWaalsContact C-N 3.27Å; L102-H104 PolarHBondContact O-N 3.02Å; L102-H104 PolarHBondContact O-ND1 2.68Å; L102-H104 VanDerWaalsContact O-ND1 3.14Å; H104-D157 PolarHBondContact O-N 2.67Å; H104-V158 WeakPolarHBondContact O-CB 3.43Å; H104-V158 VanDerWaalsContact O-CG2 3.27Å; H104-V158 WeakPolarHBondContact O-CG2 3.32Å; H104-V158 PolarHBondContact O-N 3.21Å
105	T	90.9	Very high	90.7	Very high	71 Å²	71	53.1 Å²	53.1	44%	0.436	29%	0.289	S	S	.	.			trans	-105.5	136.5	178	-62.5	0	0	0	0	110.7	Q154 I155 T156	T105-Q154 HydrophobicContact CG2-CG 3.94Å; T105-I155 WeakPolarHBondContact CA-O 3.42Å; T105-T156 HydrophobicContact CG2-CG2 4.09Å
106	V	93.3	Very high	90.6	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.024	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	141.9	175.4	65.9	0	0	0	0	111.3	Y98 I100 M108 Q154 I155 V158 L187	Y98-V106 HydrophobicContact CD1-CG2 4.09Å; Y98-V106 HydrophobicContact CG-CG2 4.19Å; I100-V106 HydrophobicContact CD1-CB 4.16Å; I100-V106 HydrophobicContact CD1-CG2 3.91Å; I100-V106 HydrophobicContact CG1-CB 3.91Å; I100-V106 HydrophobicContact CG1-CG2 3.78Å; I100-V106 HydrophobicContact CG2-CB 4.49Å; V106-M108 HydrophobicContact CG2-CG 4.21Å; V106-Q154 CarbonylContact O-C 3.32Å; V106-Q154 WeakPolarHBondContact O-CA 3.45Å; V106-I155 HydrophobicContact CG1-CB 3.87Å; V106-I155 HydrophobicContact CG1-CG1 4.47Å; V106-I155 PolarHBondContact N-O 2.9Å; V106-I155 PolarHBondContact O-N 3.39Å; V106-V158 HydrophobicContact CB-CG2 4.29Å; V106-V158 HydrophobicContact CG1-CG2 3.7Å; V106-L187 HydrophobicContact CG1-CD1 4.18Å; V106-L187 HydrophobicContact CG1-CD2 4.31Å; V106-L187 HydrophobicContact CG2-CD1 4.29Å
107	N	94.2	Very high	90.5	Very high	75 Å²	75	48.1 Å²	48.1	40%	0.401	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	96.5	176.9	-65.3	-31.8	0	0	0	109.2	Q109 T152 Q154	N107-Q109 PolarHBondContact O-N 3.04Å; N107-T152 HydrophobicContact CB-CG2 3.96Å; N107-Q154 WeakPolarHBondContact OD1-CG 3.46Å; N107-Q154 PolarHBondContact OD1-NE2 2.88Å
108	M	94.3	Very high	90.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	108.6	178.3	-65.8	178.7	-83	0	0	109.6	Y98 V106 W121 T152 L153 I155 Y166 T185	Y98-M108 HydrophobicContact CD2-CG 3.8Å; Y98-M108 HydrophobicContact CD2-SD 4.44Å; Y98-M108 HydrophobicContact CE2-CB 4.1Å; Y98-M108 HydrophobicContact CE2-CG 3.7Å; Y98-M108 HydrophobicContact CG-CG 4.37Å; V106-M108 HydrophobicContact CG2-CG 4.21Å; M108-W121 HydrophobicContact CB-CH2 3.7Å; M108-W121 HydrophobicContact CB-CZ2 4.35Å; M108-W121 HydrophobicContact CB-CZ3 4.24Å; M108-W121 VanDerWaalsContact O-CZ2 3.23Å; M108-W121 WeakPolarHBondContact O-CZ2 3.41Å; M108-T152 CarbonylContact O-C 3.53Å; M108-T152 WeakPolarHBondContact O-CA 3.41Å; M108-T152 WeakPolarHBondContact O-CG2 3.48Å; M108-L153 HydrophobicContact CB-CB 4.47Å; M108-L153 HydrophobicContact CE-CB 4.47Å; M108-L153 HydrophobicContact CE-CD2 3.73Å; M108-L153 HydrophobicContact CE-CG 3.97Å; M108-L153 PolarHBondContact N-O 3Å; M108-L153 PolarHBondContact O-N 3.38Å; M108-I155 HydrophobicContact CE-CD1 3.53Å; M108-I155 HydrophobicContact CE-CG1 4.14Å; M108-Y166 HydrophobicContact CE-CD1 3.84Å; M108-Y166 HydrophobicContact CE-CD2 4.33Å; M108-Y166 HydrophobicContact CE-CE1 3.95Å; M108-Y166 HydrophobicContact CE-CE2 4.47Å; M108-Y166 HydrophobicContact CE-CG 4.06Å; M108-Y166 HydrophobicContact SD-CD1 4.42Å; M108-Y166 HydrophobicContact SD-CD2 4.17Å; M108-Y166 HydrophobicContact SD-CG 4.05Å; M108-T185 HydrophobicContact SD-CG2 3.89Å
109	Q	92.4	Very high	90.5	Very high	99 Å²	99	48.2 Å²	48.2	46%	0.463	26%	0.26	S	S	.	.			trans	-73	138.5	-169.3	-68.9	-177.3	-12.2	0	0	112.5	V92 L93 P94 Y98 N107	V92-Q109 HydrophobicContact CG1-CB 4.09Å; L93-Q109 CarbonylContact C-O 3.5Å; P94-Q109 VanDerWaalsContact CA-O 3.25Å; P94-Q109 WeakPolarHBondContact CA-O 3.41Å; P94-Q109 WeakPolarHBondContact CD-O 3.44Å; P94-Q109 WeakPolarHBondContact CG-O 3.31Å; Y98-Q109 PolarHBondContact OH-N 2.87Å; N107-Q109 PolarHBondContact O-N 3.04Å
110	C	93.7	Very high	90.6	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.244	C	C	.	.			trans	-151	123.1	166.2	-173.4	0	0	0	0	108.8	F90 W121 H151 C168	F90-C110 WeakPolarHBondContact CE1-SG 3.35Å; C110-W121 HydrophobicContact CB-CH2 4.28Å; C110-W121 HydrophobicContact CB-CZ2 3.48Å; C110-W121 VanDerWaalsContact CB-CZ2 3.48Å; C110-H151 CarbonylContact O-C 3.55Å; C110-H151 PolarHBondContact O-N 2.83Å; C110-C168 HydrophobicContact CB-CB 3.76Å; C110-C168 WeakPolarHBondContact CB-SG 3.45Å; C110-C168 WeakPolarHBondContact SG-CB 3.3Å; C110-C168 CovalentContact SG-SG 2.04Å; C110-C168 PolarHBondContact SG-SG 2.98Å
111	V	94.2	Very high	90.8	Very high	23 Å²	23	45.2 Å²	45.2	14%	0.139	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	132.2	-179.2	-174.5	0	0	0	0	109.6	F90 E91 V92 G149 E150	F90-V111 CarbonylContact C-O 3.5Å; F90-V111 WeakPolarHBondContact CA-O 3.32Å; E91-V111 HydrophobicContact CB-CG1 4.31Å; E91-V111 PolarHBondContact N-O 2.96Å; V92-V111 HydrophobicContact CB-CB 3.84Å; V92-V111 HydrophobicContact CB-CG2 3.83Å; V92-V111 HydrophobicContact CG2-CB 3.99Å; V92-V111 HydrophobicContact CG2-CG2 3.96Å; V92-V111 PolarHBondContact N-O 2.58Å; V92-V111 PolarHBondContact O-N 3.09Å; V92-V111 VanDerWaalsContact O-N 3.07Å; V111-G149 CarbonylContact C-O 3.42Å; V111-G149 WeakPolarHBondContact CA-O 3.13Å; V111-E150 HydrophobicContact CG1-CG 4Å; V111-E150 HydrophobicContact CG2-CB 4.39Å; V111-E150 HydrophobicContact CG2-CG 4.08Å
112	V	93.3	Very high	91	Very high	2 Å²	2	46 Å²	46	1%	0.012	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	112.2	-170.4	-172.4	0	0	0	0	110.2	C89 F90 Q115 V119 G149 V170 L181	C89-V112 CarbonylContact O-C 3.51Å; C89-V112 WeakPolarHBondContact O-CA 3.28Å; F90-V112 HydrophobicContact CD1-CG2 3.97Å; F90-V112 HydrophobicContact CE1-CG2 4.03Å; V112-Q115 HydrophobicContact CB-CB 4.22Å; V112-Q115 HydrophobicContact CB-CG 4.4Å; V112-Q115 HydrophobicContact CG1-CB 3.89Å; V112-Q115 HydrophobicContact CG1-CG 4.07Å; V112-V119 HydrophobicContact CG2-CG2 4Å; V112-G149 PolarHBondContact N-O 2.94Å; V112-G149 WeakPolarHBondContact O-CA 3.45Å; V112-V170 HydrophobicContact CG1-CG1 4.38Å; V112-V170 HydrophobicContact CG1-CG2 4.32Å; V112-V170 HydrophobicContact CG2-CG2 3.7Å; V112-L181 HydrophobicContact CG1-CD1 4.09Å
113	L	91.9	Very high	91.1	Very high	58 Å²	58	42.4 Å²	42.4	30%	0.304	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	147.3	174	-170.7	63.9	0	0	0	110.3	R83 Q88 C89 E91 Q115	R83-L113 HydrophobicContact CB-CD2 4.48Å; R83-L113 HydrophobicContact CG-CD2 3.63Å; Q88-L113 WeakPolarHBondContact CA-O 3.26Å; C89-L113 PolarHBondContact N-O 3.19Å; C89-L113 VanDerWaalsContact N-O 3.14Å; C89-L113 PolarHBondContact O-N 2.95Å; E91-L113 HydrophobicContact CB-CB 4.22Å; L113-Q115 PolarHBondContact O-N 2.92Å
114	N	88.8	Confident	91	Very high	46 Å²	46	44.8 Å²	44.8	25%	0.246	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	49	43.8	-177.2	-49.2	-48.1	0	0	0	112.5	R86 I87 Q88 H116	R86-N114 WeakPolarHBondContact CA-ND2 3.38Å; R86-N114 WeakPolarHBondContact O-CB 3.23Å; I87-N114 WeakPolarHBondContact O-CB 3.5Å; I87-N114 PolarHBondContact O-ND2 3.14Å; Q88-N114 WeakPolarHBondContact CA-O 3.19Å; Q88-N114 WeakPolarHBondContact CB-O 3.43Å; N114-H116 PolarHBondContact O-CD2 2.87Å; N114-H116 PolarHBondContact O-N 2.62Å
115	Q	89.6	Confident	90.6	Very high	60 Å²	60	48.7 Å²	48.7	28%	0.28	24%	0.235	S	C	.	.			trans	-64.2	118.5	-176.7	-173.4	-161.3	-33.9	0	0	111.3	V112 L113 G117 V119 H151	V112-Q115 HydrophobicContact CB-CB 4.22Å; V112-Q115 HydrophobicContact CB-CG 4.4Å; V112-Q115 HydrophobicContact CG1-CB 3.89Å; V112-Q115 HydrophobicContact CG1-CG 4.07Å; L113-Q115 PolarHBondContact O-N 2.92Å; Q115-G117 VanDerWaalsContact CG-O 3.31Å; Q115-G117 WeakPolarHBondContact CG-O 3.5Å; Q115-G117 PolarHBondContact NE2-O 3Å; Q115-V119 HydrophobicContact CG-CG2 4.1Å; Q115-H151 PolarHBondContact OE1-NE2 2.86Å
116	H	88.3	Confident	90.3	Very high	104 Å²	104	49.6 Å²	49.6	48%	0.481	24%	0.236	S	C	.	.			trans	-112.2	-28.2	168.8	-81.6	-107.3	0	0	0	112.2	N114 V173 H178	N114-H116 PolarHBondContact O-CD2 2.87Å; N114-H116 PolarHBondContact O-N 2.62Å; H116-V173 HydrophobicContact CB-CB 4.4Å; H116-V173 HydrophobicContact CB-CG2 3.99Å; H116-H178 AromaticContact CD2-CE1 3.11Å; H116-H178 PolarHBondContact CD2-CE1 3.44Å; H116-H178 AromaticContact CD2-ND1 3.75Å; H116-H178 AromaticContact CD2-NE2 3.59Å; H116-H178 AromaticContact CE1-NE2 3.89Å; H116-H178 AromaticContact CG-CE1 3.41Å; H116-H178 VanDerWaalsContact CG-CE1 3.41Å; H116-H178 AromaticContact CG-ND1 3.91Å; H116-H178 AromaticContact CG-NE2 3.46Å; H116-H178 AromaticContact ND1-CE1 3.99Å; H116-H178 AromaticContact ND1-NE2 3.67Å; H116-H178 AromaticContact NE2-CE1 3.58Å; H116-H178 AromaticContact NE2-NE2 3.86Å
117	G	86.4	Confident	89.9	Confident	4 Å²	4	53.8 Å²	53.8	4%	0.041	26%	0.257	C	S	.	.	S	Bend	trans	-81.3	167.8	176.2	0	0	0	0	0	113.8	Q115 T171	Q115-G117 VanDerWaalsContact CG-O 3.31Å; Q115-G117 WeakPolarHBondContact CG-O 3.5Å; Q115-G117 PolarHBondContact NE2-O 3Å; G117-T171 WeakPolarHBondContact CA-O 3.32Å; G117-T171 WeakPolarHBondContact CA-OG1 3.33Å
118	K	89.1	Confident	89.7	Confident	134 Å²	134	50.7 Å²	50.7	58%	0.583	24%	0.241	S	C	*	.			trans	-82.3	141.2	170.7	-57.8	-174.5	179.1	-176.5	0	109.6	Y130 V170 T171	K118-Y130 HydrophobicContact CB-CD1 3.46Å; K118-Y130 VanDerWaalsContact CB-CD1 3.46Å; K118-Y130 HydrophobicContact CB-CE1 3.35Å; K118-Y130 HydrophobicContact CB-CG 4.33Å; K118-Y130 HydrophobicContact CD-CD1 4.31Å; K118-Y130 HydrophobicContact CD-CE1 4.35Å; K118-Y130 HydrophobicContact CD-CG 4.42Å; K118-Y130 HydrophobicContact CG-CD1 4.49Å; K118-Y130 HydrophobicContact CG-CE1 4.49Å; K118-V170 WeakPolarHBondContact O-CA 3.37Å; K118-T171 HydrophobicContact CB-CG2 4.41Å; K118-T171 PolarHBondContact N-OG1 2.68Å; K118-T171 PolarHBondContact O-N 2.8Å
119	V	91.8	Very high	89.1	Confident	11 Å²	11	51.8 Å²	51.8	7%	0.067	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	132.4	-179.6	-175.2	0	0	0	0	109.6	V112 Q115 Y130 H151 Q169 V170	V112-V119 HydrophobicContact CG2-CG2 4Å; Q115-V119 HydrophobicContact CG-CG2 4.1Å; V119-Y130 WeakPolarHBondContact O-CD1 3.38Å; V119-H151 HydrophobicContact CB-CB 4.37Å; V119-H151 HydrophobicContact CG1-CB 3.74Å; V119-Q169 CarbonylContact C-O 3.58Å; V119-Q169 WeakPolarHBondContact CA-O 3.17Å; V119-V170 HydrophobicContact CG1-CG2 4.32Å; V119-V170 HydrophobicContact CG2-CB 4.43Å; V119-V170 HydrophobicContact CG2-CG1 3.96Å; V119-V170 HydrophobicContact CG2-CG2 3.95Å
120	Q	91.5	Very high	88.8	Confident	18 Å²	18	52.4 Å²	52.4	8%	0.084	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	158.6	175.9	63.4	178.3	6.6	0	0	110.5	G129 Y130 Q169	Q120-G129 WeakPolarHBondContact CB-O 3.43Å; Q120-Y130 HydrophobicContact CB-CD1 3.83Å; Q120-Y130 HydrophobicContact CB-CE1 3.76Å; Q120-Y130 HydrophobicContact CG-CE1 3.95Å; Q120-Y130 PolarHBondContact OE1-OH 3.1Å; Q120-Q169 HydrophobicContact CG-CB 4.02Å; Q120-Q169 PolarHBondContact N-O 2.8Å; Q120-Q169 PolarHBondContact O-N 2.92Å
121	W	94.2	Very high	88.5	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	144.5	170	-80	85	0	0	0	111.6	P94 M108 C110 L128 H151 L153 C168 T185	P94-W121 HydrophobicContact CB-CH2 4.36Å; P94-W121 HydrophobicContact CG-CH2 3.78Å; P94-W121 HydrophobicContact CG-CZ3 4.37Å; M108-W121 HydrophobicContact CB-CH2 3.7Å; M108-W121 HydrophobicContact CB-CZ2 4.35Å; M108-W121 HydrophobicContact CB-CZ3 4.24Å; M108-W121 VanDerWaalsContact O-CZ2 3.23Å; M108-W121 WeakPolarHBondContact O-CZ2 3.41Å; C110-W121 HydrophobicContact CB-CH2 4.28Å; C110-W121 HydrophobicContact CB-CZ2 3.48Å; C110-W121 VanDerWaalsContact CB-CZ2 3.48Å; W121-L128 HydrophobicContact CB-CD1 3.98Å; W121-L128 WeakPolarHBondContact O-CB 3.22Å; W121-L128 PolarHBondContact O-N 3.13Å; W121-H151 PolarHBondContact NE1-O 3.09Å; W121-L153 HydrophobicContact CB-CD2 4.09Å; W121-L153 HydrophobicContact CD2-CB 3.66Å; W121-L153 HydrophobicContact CD2-CD2 3.87Å; W121-L153 HydrophobicContact CD2-CG 4.4Å; W121-L153 VanDerWaalsContact CE2-CB 3.46Å; W121-L153 HydrophobicContact CE3-CB 4.2Å; W121-L153 HydrophobicContact CE3-CD2 3.89Å; W121-L153 HydrophobicContact CG-CB 3.96Å; W121-L153 HydrophobicContact CG-CD2 3.98Å; W121-L153 HydrophobicContact CG-CG 4.48Å; W121-L153 HydrophobicContact CH2-CB 4.31Å; W121-L153 HydrophobicContact CZ2-CB 3.8Å; W121-L153 HydrophobicContact CZ3-CB 4.5Å; W121-C168 HydrophobicContact CD2-CB 4.03Å; W121-C168 HydrophobicContact CE3-CB 4.1Å; W121-C168 HydrophobicContact CH2-CB 4Å; W121-C168 HydrophobicContact CZ2-CB 3.89Å; W121-C168 HydrophobicContact CZ3-CB 4.09Å; W121-T185 HydrophobicContact CZ3-CG2 4.13Å
122	R	91.5	Very high	88.2	Confident	36 Å²	36	58.6 Å²	58.6	14%	0.136	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	134	162.8	-167.2	176.5	75	-130.6	-3.5	108.8	I126 L127 E165 Y166 E167	R122-I126 CarbonylContact C-O 3.58Å; R122-I126 VanDerWaalsContact CA-O 3.23Å; R122-I126 WeakPolarHBondContact CA-O 3.25Å; R122-I126 VanDerWaalsContact CG-O 3.26Å; R122-I126 WeakPolarHBondContact CG-O 3.39Å; R122-L127 HydrophobicContact CB-CD2 3.98Å; R122-L127 HydrophobicContact CG-CD2 4.07Å; R122-E165 IonicContact CZ-OE1 2.71Å; R122-E165 IonicContact NE-OE1 3.09Å; R122-E165 IonicContact NH2-OE1 2.82Å; R122-E165 PolarHBondContact NH2-OE1 3.31Å; R122-Y166 CarbonylContact O-C 3Å; R122-Y166 WeakPolarHBondContact O-CA 3.37Å; R122-E167 HydrophobicContact CB-CB 4.19Å; R122-E167 VanDerWaalsContact CZ-CD 3.47Å; R122-E167 IonicContact CZ-OE1 3.85Å; R122-E167 IonicContact CZ-OE2 3.87Å; R122-E167 PolarHBondContact N-O 3.3Å; R122-E167 IonicContact NH1-OE1 3.17Å; R122-E167 PolarHBondContact NH1-OE1 2.77Å; R122-E167 VanDerWaalsContact NH1-OE1 3.15Å; R122-E167 IonicContact NH1-OE2 3.62Å; R122-E167 PolarHBondContact NH1-OE2 3.41Å; R122-E167 IonicContact NH2-OE1 3.55Å; R122-E167 PolarHBondContact NH2-OE1 2.95Å; R122-E167 IonicContact NH2-OE2 2.9Å; R122-E167 PolarHBondContact O-N 3.21Å
123	A	89.6	Confident	87.7	Confident	6 Å²	6	62.5 Å²	62.5	5%	0.05	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	125.3	168.4	0	0	0	0	0	108.5	K125 I126 L128 F140 Y166	A123-K125 VanDerWaalsContact C-N 3.27Å; A123-K125 PolarHBondContact O-N 2.93Å; A123-K125 VanDerWaalsContact O-N 3.12Å; A123-I126 PolarHBondContact N-O 2.63Å; A123-I126 WeakPolarHBondContact O-CA 3.3Å; A123-I126 WeakPolarHBondContact O-CB 3.33Å; A123-I126 PolarHBondContact O-N 3.1Å; A123-L128 HydrophobicContact CB-CD1 4Å; A123-L128 HydrophobicContact CB-CD2 4.06Å; A123-L128 HydrophobicContact CB-CG 4.15Å; A123-F140 HydrophobicContact CB-CE1 4.48Å; A123-Y166 HydrophobicContact CB-CD1 3.47Å; A123-Y166 VanDerWaalsContact CB-CD1 3.47Å; A123-Y166 HydrophobicContact CB-CE1 3.31Å; A123-Y166 HydrophobicContact CB-CG 4.4Å
124	K	83.3	Confident	87.4	Confident	87 Å²	87	60.1 Å²	60.1	38%	0.378	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	43.9	173.8	-55.6	-172.7	173.3	-160	0	114.3	I126 D161 D162 A163 E165	K124-I126 PolarHBondContact O-N 3.44Å; K124-D161 PolarHBondContact NZ-O 3.43Å; K124-D162 WeakPolarHBondContact CE-O 3.35Å; K124-A163 WeakPolarHBondContact CE-O 3.46Å; K124-A163 PolarHBondContact NZ-O 3.37Å; K124-E165 PolarHBondContact N-O 2.74Å
125	K	80.5	Confident	86.8	Confident	185 Å²	185	62.4 Å²	62.4	80%	0.804	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	-12.8	-173.6	-49.2	174.5	-176.5	175.6	0	116.3	A123	A123-K125 VanDerWaalsContact C-N 3.27Å; A123-K125 PolarHBondContact O-N 2.93Å; A123-K125 VanDerWaalsContact O-N 3.12Å
126	I	84	Confident	86.1	Confident	90 Å²	90	63.7 Å²	63.7	46%	0.462	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	134.7	176	-55.7	174.6	0	0	0	110.1	R122 A123 K124	R122-I126 CarbonylContact C-O 3.58Å; R122-I126 VanDerWaalsContact CA-O 3.23Å; R122-I126 WeakPolarHBondContact CA-O 3.25Å; R122-I126 VanDerWaalsContact CG-O 3.26Å; R122-I126 WeakPolarHBondContact CG-O 3.39Å; A123-I126 PolarHBondContact N-O 2.63Å; A123-I126 WeakPolarHBondContact O-CA 3.3Å; A123-I126 WeakPolarHBondContact O-CB 3.33Å; A123-I126 PolarHBondContact O-N 3.1Å; K124-I126 PolarHBondContact O-N 3.44Å
127	L	86.2	Confident	85.8	Confident	91 Å²	91	62.7 Å²	62.7	48%	0.476	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	126.1	169.5	-63.6	178.4	0	0	0	109.9	R122 G129	R122-L127 HydrophobicContact CB-CD2 3.98Å; R122-L127 HydrophobicContact CG-CD2 4.07Å; L127-G129 PolarHBondContact O-N 2.98Å
128	L	88.2	Confident	85.7	Confident	10 Å²	10	67.4 Å²	67.4	5%	0.052	36%	0.364	C	S	.	.			trans	-80.2	-6.7	179.1	-58.3	179.2	0	0	0	112.9	W121 A123 I134 Y137 F140 L153	W121-L128 HydrophobicContact CB-CD1 3.98Å; W121-L128 WeakPolarHBondContact O-CB 3.22Å; W121-L128 PolarHBondContact O-N 3.13Å; A123-L128 HydrophobicContact CB-CD1 4Å; A123-L128 HydrophobicContact CB-CD2 4.06Å; A123-L128 HydrophobicContact CB-CG 4.15Å; L128-I134 HydrophobicContact CB-CD1 4.19Å; L128-I134 HydrophobicContact CB-CG1 4.36Å; L128-I134 HydrophobicContact CB-CG2 4.01Å; L128-I134 HydrophobicContact CD1-CD1 3.99Å; L128-I134 HydrophobicContact CD2-CG2 4.28Å; L128-Y137 HydrophobicContact CD2-CD2 4.35Å; L128-Y137 HydrophobicContact CD2-CE1 4.5Å; L128-Y137 HydrophobicContact CD2-CE2 4.14Å; L128-F140 HydrophobicContact CD1-CD1 4.03Å; L128-L153 HydrophobicContact CD1-CD1 4.3Å; L128-L153 HydrophobicContact CD1-CD2 3.97Å
129	G	82.5	Confident	85.9	Confident	23 Å²	23	63.6 Å²	63.6	24%	0.237	35%	0.346	C	S	.	.			trans	82.4	-168.3	-178.9	0	0	0	0	0	114	Q120 L127	Q120-G129 WeakPolarHBondContact CB-O 3.43Å; L127-G129 PolarHBondContact O-N 2.98Å
130	Y	86.6	Confident	85.9	Confident	112 Å²	112	63.5 Å²	63.5	44%	0.439	35%	0.345	S	S	.	.	S	Bend	trans	-103.3	-2.6	-175.1	-56.3	-75.8	0	0	0	113.5	K118 V119 Q120 T171	K118-Y130 HydrophobicContact CB-CD1 3.46Å; K118-Y130 VanDerWaalsContact CB-CD1 3.46Å; K118-Y130 HydrophobicContact CB-CE1 3.35Å; K118-Y130 HydrophobicContact CB-CG 4.33Å; K118-Y130 HydrophobicContact CD-CD1 4.31Å; K118-Y130 HydrophobicContact CD-CE1 4.35Å; K118-Y130 HydrophobicContact CD-CG 4.42Å; K118-Y130 HydrophobicContact CG-CD1 4.49Å; K118-Y130 HydrophobicContact CG-CE1 4.49Å; V119-Y130 WeakPolarHBondContact O-CD1 3.38Å; Q120-Y130 HydrophobicContact CB-CD1 3.83Å; Q120-Y130 HydrophobicContact CB-CE1 3.76Å; Q120-Y130 HydrophobicContact CG-CE1 3.95Å; Q120-Y130 PolarHBondContact OE1-OH 3.1Å; Y130-T171 HydrophobicContact CE1-CG2 4.23Å; Y130-T171 WeakPolarHBondContact OH-CG2 3.43Å
131	D	86.7	Confident	85.9	Confident	75 Å²	75	69.2 Å²	69.2	40%	0.401	37%	0.365	S	S	.	.			trans	-77.6	141.8	176.8	-160.4	-39.1	0	0	0	109.8	S133	D131-S133 WeakPolarHBondContact OD1-CA 3.37Å; D131-S133 PolarHBondContact OD1-N 2.94Å; D131-S133 PolarHBondContact OD1-OG 2.89Å
132	R	88.7	Confident	85.8	Confident	79 Å²	79	69.6 Å²	69.6	30%	0.298	37%	0.367	S	S	.	.	S	Bend	trans	-81	-28.4	177.2	-68	-177	143.7	-142.7	-10.2	112.2	R141 I142 G144 E150	R132-R141 WeakPolarHBondContact O-CA 3.37Å; R132-I142 HydrophobicContact CB-CB 4.39Å; R132-I142 HydrophobicContact CG-CB 4.18Å; R132-I142 PolarHBondContact O-N 3.06Å; R132-G144 VanDerWaalsContact CZ-O 3.26Å; R132-G144 PolarHBondContact NH1-O 2.76Å; R132-G144 PolarHBondContact NH2-O 2.85Å; R132-E150 PolarHBondContact NH2-O 2.8Å
133	S	82.3	Confident	85.9	Confident	84 Å²	84	70.5 Å²	70.5	59%	0.587	38%	0.375	S	S	*	.	B	Isolated β-bridge	trans	-93.1	81	165.1	28.5	0	0	0	0	108.9	D131 P135	D131-S133 WeakPolarHBondContact OD1-CA 3.37Å; D131-S133 PolarHBondContact OD1-N 2.94Å; D131-S133 PolarHBondContact OD1-OG 2.89Å; S133-P135 WeakPolarHBondContact O-CD 3.47Å; S133-P135 VanDerWaalsContact O-N 3.08Å
134	I	85.7	Confident	85.7	Confident	8 Å²	8	71.9 Å²	71.9	4%	0.041	39%	0.389	C	S	.	.			trans	-58	111.6	-172.3	-64.4	159.3	0	0	0	110.5	L128 G136 Y137 F140 I142 L153	L128-I134 HydrophobicContact CB-CD1 4.19Å; L128-I134 HydrophobicContact CB-CG1 4.36Å; L128-I134 HydrophobicContact CB-CG2 4.01Å; L128-I134 HydrophobicContact CD1-CD1 3.99Å; L128-I134 HydrophobicContact CD2-CG2 4.28Å; I134-G136 PolarHBondContact O-N 2.89Å; I134-Y137 HydrophobicContact CG2-CD2 3.78Å; I134-Y137 HydrophobicContact CG2-CG 4.15Å; I134-Y137 PolarHBondContact O-N 2.85Å; I134-F140 HydrophobicContact CD1-CB 3.82Å; I134-I142 HydrophobicContact CD1-CG1 4.01Å; I134-I142 HydrophobicContact CG1-CG1 4.42Å; I134-L153 HydrophobicContact CD1-CD1 3.84Å
135	P	75.5	Confident	86	Confident	94 Å²	94	71.1 Å²	71.1	61%	0.61	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	135.1	-174.8	-23.9	35.8	0	0	0	111.7	S133 Y137	S133-P135 WeakPolarHBondContact O-CD 3.47Å; S133-P135 VanDerWaalsContact O-N 3.08Å; P135-Y137 VanDerWaalsContact C-N 3.28Å; P135-Y137 PolarHBondContact O-N 2.94Å
136	G	76.4	Confident	86.2	Confident	86 Å²	86	66.2 Å²	66.2	89%	0.887	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	-15.9	-177	0	0	0	0	0	115.5	I134	I134-G136 PolarHBondContact O-N 2.89Å
137	Y	81.2	Confident	86.2	Confident	83 Å²	83	65.5 Å²	65.5	33%	0.325	39%	0.39	S	S	.	.			trans	-114.9	75.4	-179.6	-65.3	-100.9	0	0	0	111	L128 I134 P135 R139 F140	L128-Y137 HydrophobicContact CD2-CD2 4.35Å; L128-Y137 HydrophobicContact CD2-CE1 4.5Å; L128-Y137 HydrophobicContact CD2-CE2 4.14Å; I134-Y137 HydrophobicContact CG2-CD2 3.78Å; I134-Y137 HydrophobicContact CG2-CG 4.15Å; I134-Y137 PolarHBondContact O-N 2.85Å; P135-Y137 VanDerWaalsContact C-N 3.28Å; P135-Y137 PolarHBondContact O-N 2.94Å; Y137-R139 PolarHBondContact O-N 2.98Å; Y137-F140 HydrophobicContact CD1-CD1 4.15Å; Y137-F140 HydrophobicContact CD1-CD2 4.34Å; Y137-F140 HydrophobicContact CD1-CE1 4.16Å; Y137-F140 HydrophobicContact CD1-CE2 4.36Å; Y137-F140 HydrophobicContact CD1-CG 4.26Å; Y137-F140 HydrophobicContact CD1-CZ 4.28Å; Y137-F140 HydrophobicContact CG-CG 4.45Å; Y137-F140 PolarHBondContact O-N 2.87Å
138	S	84.4	Confident	86.3	Confident	104 Å²	104	69.3 Å²	69.3	73%	0.727	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-29.1	-173.8	56.9	0	0	0	0	115.7
139	R	92.4	Very high	86.2	Confident	53 Å²	53	69 Å²	69	20%	0.2	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-13.9	177.8	-67.4	-171.6	-57.1	100.7	0.4	114.5	Y137 I155 T156 D157 D162	Y137-R139 PolarHBondContact O-N 2.98Å; R139-I155 WeakPolarHBondContact O-CA 3.45Å; R139-T156 WeakPolarHBondContact CA-OG1 3.41Å; R139-T156 WeakPolarHBondContact CB-O 3.48Å; R139-T156 WeakPolarHBondContact CD-O 3.33Å; R139-T156 PolarHBondContact NH1-O 2.77Å; R139-T156 VanDerWaalsContact NH1-O 3.1Å; R139-T156 PolarHBondContact O-N 2.98Å; R139-T156 PolarHBondContact O-OG1 2.91Å; R139-D157 WeakPolarHBondContact CD-O 3.44Å; R139-D157 WeakPolarHBondContact CD-OD2 3.4Å; R139-D157 PolarHBondContact NH1-O 2.79Å; R139-D162 IonicContact CZ-OD1 2.66Å; R139-D162 IonicContact CZ-OD2 3.22Å; R139-D162 IonicContact NH1-OD1 3.67Å; R139-D162 IonicContact NH1-OD2 3.98Å; R139-D162 PolarHBondContact NH1-OD2 3.44Å; R139-D162 VanDerWaalsContact NH2-CG 3.33Å; R139-D162 IonicContact NH2-OD1 2.68Å; R139-D162 PolarHBondContact NH2-OD1 3.23Å; R139-D162 IonicContact NH2-OD2 2.71Å; R139-D162 PolarHBondContact NH2-OD2 2.82Å; R139-D162 VanDerWaalsContact NH2-OD2 3.09Å
140	F	92.7	Very high	86.8	Confident	9 Å²	9	70.5 Å²	70.5	4%	0.039	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	129.7	-172.6	-70	-144.1	0	0	0	109.7	A123 L128 I134 Y137 L153 Q154 I155 Y166	A123-F140 HydrophobicContact CB-CE1 4.48Å; L128-F140 HydrophobicContact CD1-CD1 4.03Å; I134-F140 HydrophobicContact CD1-CB 3.82Å; Y137-F140 HydrophobicContact CD1-CD1 4.15Å; Y137-F140 HydrophobicContact CD1-CD2 4.34Å; Y137-F140 HydrophobicContact CD1-CE1 4.16Å; Y137-F140 HydrophobicContact CD1-CE2 4.36Å; Y137-F140 HydrophobicContact CD1-CG 4.26Å; Y137-F140 HydrophobicContact CD1-CZ 4.28Å; Y137-F140 HydrophobicContact CG-CG 4.45Å; Y137-F140 PolarHBondContact O-N 2.87Å; F140-L153 HydrophobicContact CB-CD1 4.4Å; F140-Q154 CarbonylContact C-O 3.6Å; F140-Q154 WeakPolarHBondContact CA-O 3.29Å; F140-I155 HydrophobicContact CD1-CD1 4.07Å; F140-I155 HydrophobicContact CD1-CG1 4.01Å; F140-I155 HydrophobicContact CD2-CB 4.4Å; F140-I155 HydrophobicContact CD2-CD1 4.41Å; F140-I155 HydrophobicContact CD2-CG1 3.97Å; F140-I155 HydrophobicContact CD2-CG2 3.83Å; F140-I155 HydrophobicContact CE1-CD1 3.69Å; F140-I155 HydrophobicContact CE1-CG1 4.12Å; F140-I155 HydrophobicContact CE2-CB 4.46Å; F140-I155 HydrophobicContact CE2-CD1 4.04Å; F140-I155 HydrophobicContact CE2-CG1 4.06Å; F140-I155 HydrophobicContact CE2-CG2 3.63Å; F140-I155 HydrophobicContact CG-CD1 4.43Å; F140-I155 HydrophobicContact CG-CG1 3.94Å; F140-I155 HydrophobicContact CZ-CD1 3.66Å; F140-I155 HydrophobicContact CZ-CG1 4.13Å; F140-I155 HydrophobicContact CZ-CG2 4.29Å; F140-Y166 AromaticContact CE1-CE1 3.98Å; F140-Y166 HydrophobicContact CE1-CE1 3.98Å
141	R	92.2	Very high	87.1	Confident	138 Å²	138	65.8 Å²	65.8	52%	0.521	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	144.3	-178.6	-59.1	-177.5	-173.9	-174.8	1.1	111.3	R132 I143 Q154	R132-R141 WeakPolarHBondContact O-CA 3.37Å; R141-I143 HydrophobicContact CB-CG2 4.3Å; R141-Q154 PolarHBondContact N-O 3.45Å; R141-Q154 PolarHBondContact O-N 2.93Å
142	I	92	Very high	87.4	Confident	8 Å²	8	63.1 Å²	63.1	4%	0.041	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	114.1	172.3	-54	176.5	0	0	0	108.7	R132 I134 H151 T152	R132-I142 HydrophobicContact CB-CB 4.39Å; R132-I142 HydrophobicContact CG-CB 4.18Å; R132-I142 PolarHBondContact O-N 3.06Å; I134-I142 HydrophobicContact CD1-CG1 4.01Å; I134-I142 HydrophobicContact CG1-CG1 4.42Å; I142-H151 HydrophobicContact CG2-CB 3.68Å; I142-T152 CarbonylContact C-O 3.49Å; I142-T152 WeakPolarHBondContact CA-O 3.49Å
143	I	92.3	Very high	87.7	Confident	56 Å²	56	59.3 Å²	59.3	29%	0.287	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	160.3	-173.8	64.6	166.6	0	0	0	112.3	R141 T152 Q154	R141-I143 HydrophobicContact CB-CG2 4.3Å; I143-T152 HydrophobicContact CD1-CG2 4.26Å; I143-T152 HydrophobicContact CG1-CG2 3.97Å; I143-T152 WeakPolarHBondContact CG1-O 3.45Å; I143-T152 PolarHBondContact N-O 2.87Å; I143-T152 PolarHBondContact O-N 2.82Å; I143-Q154 HydrophobicContact CD1-CB 3.97Å; I143-Q154 HydrophobicContact CG1-CB 4.16Å; I143-Q154 HydrophobicContact CG2-CB 4.26Å
144	G	86.7	Confident	88.3	Confident	34 Å²	34	57.3 Å²	57.3	35%	0.351	33%	0.333	S	S	.	.	S	Bend	trans	116	171.3	-175.7	0	0	0	0	0	113	R132 E150	R132-G144 VanDerWaalsContact CZ-O 3.26Å; R132-G144 PolarHBondContact NH1-O 2.76Å; R132-G144 PolarHBondContact NH2-O 2.85Å; G144-E150 WeakPolarHBondContact CA-OE2 3.46Å
145	D	88.3	Confident	88.7	Confident	71 Å²	71	56.9 Å²	56.9	38%	0.38	33%	0.331	S	S	.	.			trans	-81.7	123.1	175.8	-175.9	-2.7	0	0	0	112.5	G147 R148 G149 E150	D145-G147 VanDerWaalsContact C-N 3.29Å; D145-G147 PolarHBondContact O-N 3.1Å; D145-G147 PolarHBondContact OD1-N 3.03Å; D145-R148 HydrophobicContact CB-CB 4.13Å; D145-R148 HydrophobicContact CB-CG 3.98Å; D145-R148 PolarHBondContact O-N 3.41Å; D145-R148 WeakPolarHBondContact OD2-CD 3.38Å; D145-R148 WeakPolarHBondContact OD2-CG 3.18Å; D145-R148 IonicContact OD2-CZ 2.64Å; D145-R148 IonicContact OD2-NE 3.78Å; D145-R148 PolarHBondContact OD2-NE 2.96Å; D145-G149 PolarHBondContact O-N 2.83Å; D145-E150 PolarHBondContact N-OE2 2.83Å; D145-E150 PolarHBondContact O-N 3.25Å
146	V	86	Confident	89.5	Confident	82 Å²	82	54.4 Å²	54.4	50%	0.497	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-62.4	-36.9	175.7	-175.1	0	0	0	0	111.2	R148 G149	V146-R148 PolarHBondContact O-N 2.95Å; V146-G149 PolarHBondContact O-N 3.09Å
147	G	82.6	Confident	90.2	Very high	76 Å²	76	53.6 Å²	53.6	78%	0.784	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-67.2	-15.3	179.6	0	0	0	0	0	113.8	D145	D145-G147 VanDerWaalsContact C-N 3.29Å; D145-G147 PolarHBondContact O-N 3.1Å; D145-G147 PolarHBondContact OD1-N 3.03Å
148	R	88	Confident	90.6	Very high	170 Å²	170	49.7 Å²	49.7	64%	0.642	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-104.2	-0.3	173.7	-60.4	174.4	-165.1	-143.9	-7.7	112.9	D145 V146 E150	D145-R148 HydrophobicContact CB-CB 4.13Å; D145-R148 HydrophobicContact CB-CG 3.98Å; D145-R148 PolarHBondContact O-N 3.41Å; D145-R148 WeakPolarHBondContact OD2-CD 3.38Å; D145-R148 WeakPolarHBondContact OD2-CG 3.18Å; D145-R148 IonicContact OD2-CZ 2.64Å; D145-R148 IonicContact OD2-NE 3.78Å; D145-R148 PolarHBondContact OD2-NE 2.96Å; V146-R148 PolarHBondContact O-N 2.95Å; R148-E150 VanDerWaalsContact C-N 3.27Å; R148-E150 HydrophobicContact CB-CG 3.89Å; R148-E150 WeakPolarHBondContact CD-OE1 3.26Å; R148-E150 PolarHBondContact O-N 2.92Å
149	G	88	Confident	91	Very high	3 Å²	3	48.1 Å²	48.1	3%	0.031	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	24.5	-173.9	0	0	0	0	0	114.2	V111 V112 D145 V146 H151	V111-G149 CarbonylContact C-O 3.42Å; V111-G149 WeakPolarHBondContact CA-O 3.13Å; V112-G149 PolarHBondContact N-O 2.94Å; V112-G149 WeakPolarHBondContact O-CA 3.45Å; D145-G149 PolarHBondContact O-N 2.83Å; V146-G149 PolarHBondContact O-N 3.09Å; G149-H151 VanDerWaalsContact C-CD2 3.49Å; G149-H151 PolarHBondContact O-CD2 2.89Å
150	E	93.5	Very high	90.7	Very high	55 Å²	55	53.1 Å²	53.1	26%	0.257	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-82.9	119.6	178.3	-61.8	167.2	-171.6	0	0	110.5	V111 R132 G144 D145 R148	V111-E150 HydrophobicContact CG1-CG 4Å; V111-E150 HydrophobicContact CG2-CB 4.39Å; V111-E150 HydrophobicContact CG2-CG 4.08Å; R132-E150 PolarHBondContact NH2-O 2.8Å; G144-E150 WeakPolarHBondContact CA-OE2 3.46Å; D145-E150 PolarHBondContact N-OE2 2.83Å; D145-E150 PolarHBondContact O-N 3.25Å; R148-E150 VanDerWaalsContact C-N 3.27Å; R148-E150 HydrophobicContact CB-CG 3.89Å; R148-E150 WeakPolarHBondContact CD-OE1 3.26Å; R148-E150 PolarHBondContact O-N 2.92Å
151	H	92.9	Very high	90.6	Very high	13 Å²	13	59 Å²	59	6%	0.06	31%	0.306	C	S	.	.			trans	-137.8	57.4	-178.8	-58.3	-78.3	0	0	0	110.5	C110 Q115 V119 W121 I142 G149	C110-H151 CarbonylContact O-C 3.55Å; C110-H151 PolarHBondContact O-N 2.83Å; Q115-H151 PolarHBondContact OE1-NE2 2.86Å; V119-H151 HydrophobicContact CB-CB 4.37Å; V119-H151 HydrophobicContact CG1-CB 3.74Å; W121-H151 PolarHBondContact NE1-O 3.09Å; I142-H151 HydrophobicContact CG2-CB 3.68Å; G149-H151 VanDerWaalsContact C-CD2 3.49Å; G149-H151 PolarHBondContact O-CD2 2.89Å
152	T	94	Very high	90.5	Very high	19 Å²	19	52.8 Å²	52.8	12%	0.117	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	127.9	179.1	-69.7	0	0	0	0	110.1	N107 M108 I142 I143 Q154	N107-T152 HydrophobicContact CB-CG2 3.96Å; M108-T152 CarbonylContact O-C 3.53Å; M108-T152 WeakPolarHBondContact O-CA 3.41Å; M108-T152 WeakPolarHBondContact O-CG2 3.48Å; I142-T152 CarbonylContact C-O 3.49Å; I142-T152 WeakPolarHBondContact CA-O 3.49Å; I143-T152 HydrophobicContact CD1-CG2 4.26Å; I143-T152 HydrophobicContact CG1-CG2 3.97Å; I143-T152 WeakPolarHBondContact CG1-O 3.45Å; I143-T152 PolarHBondContact N-O 2.87Å; I143-T152 PolarHBondContact O-N 2.82Å; T152-Q154 PolarHBondContact O-N 2.93Å
153	L	94.4	Very high	90.4	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	110.7	175.2	175.9	59.3	0	0	0	109.8	M108 W121 L128 I134 F140 I155 Y166	M108-L153 HydrophobicContact CB-CB 4.47Å; M108-L153 HydrophobicContact CE-CB 4.47Å; M108-L153 HydrophobicContact CE-CD2 3.73Å; M108-L153 HydrophobicContact CE-CG 3.97Å; M108-L153 PolarHBondContact N-O 3Å; M108-L153 PolarHBondContact O-N 3.38Å; W121-L153 HydrophobicContact CB-CD2 4.09Å; W121-L153 HydrophobicContact CD2-CB 3.66Å; W121-L153 HydrophobicContact CD2-CD2 3.87Å; W121-L153 HydrophobicContact CD2-CG 4.4Å; W121-L153 VanDerWaalsContact CE2-CB 3.46Å; W121-L153 HydrophobicContact CE3-CB 4.2Å; W121-L153 HydrophobicContact CE3-CD2 3.89Å; W121-L153 HydrophobicContact CG-CB 3.96Å; W121-L153 HydrophobicContact CG-CD2 3.98Å; W121-L153 HydrophobicContact CG-CG 4.48Å; W121-L153 HydrophobicContact CH2-CB 4.31Å; W121-L153 HydrophobicContact CZ2-CB 3.8Å; W121-L153 HydrophobicContact CZ3-CB 4.5Å; L128-L153 HydrophobicContact CD1-CD1 4.3Å; L128-L153 HydrophobicContact CD1-CD2 3.97Å; I134-L153 HydrophobicContact CD1-CD1 3.84Å; F140-L153 HydrophobicContact CB-CD1 4.4Å; L153-I155 HydrophobicContact CG-CG1 4.38Å; L153-Y166 HydrophobicContact CD2-CD1 3.73Å; L153-Y166 HydrophobicContact CD2-CE1 4.07Å
154	Q	95	Very high	90.3	Very high	41 Å²	41	51 Å²	51	19%	0.192	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	132.3	169.4	175.4	165.6	91.1	0	0	110.1	T105 V106 N107 F140 R141 I143 T152 T156	T105-Q154 HydrophobicContact CG2-CG 3.94Å; V106-Q154 CarbonylContact O-C 3.32Å; V106-Q154 WeakPolarHBondContact O-CA 3.45Å; N107-Q154 WeakPolarHBondContact OD1-CG 3.46Å; N107-Q154 PolarHBondContact OD1-NE2 2.88Å; F140-Q154 CarbonylContact C-O 3.6Å; F140-Q154 WeakPolarHBondContact CA-O 3.29Å; R141-Q154 PolarHBondContact N-O 3.45Å; R141-Q154 PolarHBondContact O-N 2.93Å; I143-Q154 HydrophobicContact CD1-CB 3.97Å; I143-Q154 HydrophobicContact CG1-CB 4.16Å; I143-Q154 HydrophobicContact CG2-CB 4.26Å; T152-Q154 PolarHBondContact O-N 2.93Å; Q154-T156 HydrophobicContact CG-CG2 4.17Å
155	I	94.2	Very high	90.5	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	112.2	164.8	-57.1	173.6	0	0	0	107.5	T105 V106 M108 R139 F140 L153 V158 Y166 L187	T105-I155 WeakPolarHBondContact CA-O 3.42Å; V106-I155 HydrophobicContact CG1-CB 3.87Å; V106-I155 HydrophobicContact CG1-CG1 4.47Å; V106-I155 PolarHBondContact N-O 2.9Å; V106-I155 PolarHBondContact O-N 3.39Å; M108-I155 HydrophobicContact CE-CD1 3.53Å; M108-I155 HydrophobicContact CE-CG1 4.14Å; R139-I155 WeakPolarHBondContact O-CA 3.45Å; F140-I155 HydrophobicContact CD1-CD1 4.07Å; F140-I155 HydrophobicContact CD1-CG1 4.01Å; F140-I155 HydrophobicContact CD2-CB 4.4Å; F140-I155 HydrophobicContact CD2-CD1 4.41Å; F140-I155 HydrophobicContact CD2-CG1 3.97Å; F140-I155 HydrophobicContact CD2-CG2 3.83Å; F140-I155 HydrophobicContact CE1-CD1 3.69Å; F140-I155 HydrophobicContact CE1-CG1 4.12Å; F140-I155 HydrophobicContact CE2-CB 4.46Å; F140-I155 HydrophobicContact CE2-CD1 4.04Å; F140-I155 HydrophobicContact CE2-CG1 4.06Å; F140-I155 HydrophobicContact CE2-CG2 3.63Å; F140-I155 HydrophobicContact CG-CD1 4.43Å; F140-I155 HydrophobicContact CG-CG1 3.94Å; F140-I155 HydrophobicContact CZ-CD1 3.66Å; F140-I155 HydrophobicContact CZ-CG1 4.13Å; F140-I155 HydrophobicContact CZ-CG2 4.29Å; L153-I155 HydrophobicContact CG-CG1 4.38Å; I155-V158 HydrophobicContact CB-CG2 4.32Å; I155-V158 HydrophobicContact CG2-CG2 3.99Å; I155-Y166 HydrophobicContact CD1-CE1 3.71Å; I155-Y166 WeakPolarHBondContact CD1-OH 3.3Å; I155-L187 HydrophobicContact CD1-CD2 4.27Å
156	T	92.8	Very high	90.8	Very high	42 Å²	42	49.1 Å²	49.1	26%	0.258	26%	0.259	S	S	.	.	S	Bend	trans	-81.7	150.9	172.2	57	0	0	0	0	110.8	T105 R139 Q154	T105-T156 HydrophobicContact CG2-CG2 4.09Å; R139-T156 WeakPolarHBondContact CA-OG1 3.41Å; R139-T156 WeakPolarHBondContact CB-O 3.48Å; R139-T156 WeakPolarHBondContact CD-O 3.33Å; R139-T156 PolarHBondContact NH1-O 2.77Å; R139-T156 VanDerWaalsContact NH1-O 3.1Å; R139-T156 PolarHBondContact O-N 2.98Å; R139-T156 PolarHBondContact O-OG1 2.91Å; Q154-T156 HydrophobicContact CG-CG2 4.17Å
157	D	90.4	Very high	91.1	Very high	69 Å²	69	45.2 Å²	45.2	37%	0.369	24%	0.235	S	C	.	.	S	Bend	trans	50.6	63.7	175.2	173.7	54.7	0	0	0	111.8	H104 R139 Q159	H104-D157 PolarHBondContact O-N 2.67Å; R139-D157 WeakPolarHBondContact CD-O 3.44Å; R139-D157 WeakPolarHBondContact CD-OD2 3.4Å; R139-D157 PolarHBondContact NH1-O 2.79Å; D157-Q159 VanDerWaalsContact CG-NE2 3.27Å; D157-Q159 PolarHBondContact O-N 3Å; D157-Q159 PolarHBondContact OD1-NE2 2.83Å; D157-Q159 PolarHBondContact OD2-NE2 2.84Å
158	V	90.2	Very high	91.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.198	C	C	.	.			trans	-62.8	119.3	-174.1	167.9	0	0	0	0	110.5	I100 L102 G103 H104 V106 I155 D162 L187 V189	I100-V158 HydrophobicContact CG2-CB 4.37Å; I100-V158 HydrophobicContact CG2-CG2 4.29Å; L102-V158 WeakPolarHBondContact CD1-O 3.31Å; G103-V158 PolarHBondContact N-O 3.43Å; H104-V158 WeakPolarHBondContact O-CB 3.43Å; H104-V158 VanDerWaalsContact O-CG2 3.27Å; H104-V158 WeakPolarHBondContact O-CG2 3.32Å; H104-V158 PolarHBondContact O-N 3.21Å; V106-V158 HydrophobicContact CB-CG2 4.29Å; V106-V158 HydrophobicContact CG1-CG2 3.7Å; I155-V158 HydrophobicContact CB-CG2 4.32Å; I155-V158 HydrophobicContact CG2-CG2 3.99Å; V158-D162 WeakPolarHBondContact CA-OD2 3.48Å; V158-D162 HydrophobicContact CG1-CB 4.33Å; V158-L187 HydrophobicContact CG1-CD2 4.39Å; V158-V189 HydrophobicContact CG1-CG1 4.3Å; V158-V189 HydrophobicContact CG1-CG2 3.55Å
159	Q	91.6	Very high	91.9	Very high	71 Å²	71	34.6 Å²	34.6	33%	0.332	17%	0.172	S	C	.	.			trans	-96.2	159.6	-177.8	-66.2	-59.2	-24.3	0	0	111.5	D157 D161 D162	D157-Q159 VanDerWaalsContact CG-NE2 3.27Å; D157-Q159 PolarHBondContact O-N 3Å; D157-Q159 PolarHBondContact OD1-NE2 2.83Å; D157-Q159 PolarHBondContact OD2-NE2 2.84Å; Q159-D161 PolarHBondContact O-N 2.95Å; Q159-D161 VanDerWaalsContact O-N 3.1Å; Q159-D162 PolarHBondContact N-OD2 2.77Å; Q159-D162 WeakPolarHBondContact O-CB 3.17Å; Q159-D162 PolarHBondContact O-N 3.12Å
160	R	87.8	Confident	92.1	Very high	159 Å²	159	34.5 Å²	34.5	60%	0.6	17%	0.171	S	C	*	.	G	3₁₀ helix	trans	-50.9	-38.6	176.4	-178	-177.2	-71.7	-158.5	-1.1	111.5	L102 D162 A163 I191	L102-R160 HydrophobicContact CD1-CB 4.34Å; L102-R160 VanDerWaalsContact CD1-N 3.31Å; R160-D162 VanDerWaalsContact C-N 3.27Å; R160-D162 PolarHBondContact O-N 2.89Å; R160-A163 PolarHBondContact O-N 3.42Å; R160-I191 HydrophobicContact CG-CD1 4.45Å
161	D	89.4	Confident	91.9	Very high	131 Å²	131	33.6 Å²	33.6	70%	0.701	17%	0.169	S	C	*	.	G	3₁₀ helix	trans	-82.8	6.4	-177.2	-56	-34.3	0	0	0	114.1	K124 Q159	K124-D161 PolarHBondContact NZ-O 3.43Å; Q159-D161 PolarHBondContact O-N 2.95Å; Q159-D161 VanDerWaalsContact O-N 3.1Å
162	D	91	Very high	91.7	Very high	9 Å²	9	36.2 Å²	36.2	5%	0.048	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-85.3	-20.8	169.1	-65.6	-30	0	0	0	112.5	K124 R139 V158 Q159 R160 G164 Y166 L187	K124-D162 WeakPolarHBondContact CE-O 3.35Å; R139-D162 IonicContact CZ-OD1 2.66Å; R139-D162 IonicContact CZ-OD2 3.22Å; R139-D162 IonicContact NH1-OD1 3.67Å; R139-D162 IonicContact NH1-OD2 3.98Å; R139-D162 PolarHBondContact NH1-OD2 3.44Å; R139-D162 VanDerWaalsContact NH2-CG 3.33Å; R139-D162 IonicContact NH2-OD1 2.68Å; R139-D162 PolarHBondContact NH2-OD1 3.23Å; R139-D162 IonicContact NH2-OD2 2.71Å; R139-D162 PolarHBondContact NH2-OD2 2.82Å; R139-D162 VanDerWaalsContact NH2-OD2 3.09Å; V158-D162 WeakPolarHBondContact CA-OD2 3.48Å; V158-D162 HydrophobicContact CG1-CB 4.33Å; Q159-D162 PolarHBondContact N-OD2 2.77Å; Q159-D162 WeakPolarHBondContact O-CB 3.17Å; Q159-D162 PolarHBondContact O-N 3.12Å; R160-D162 VanDerWaalsContact C-N 3.27Å; R160-D162 PolarHBondContact O-N 2.89Å; D162-G164 PolarHBondContact O-N 3.47Å; D162-Y166 WeakPolarHBondContact O-CE2 3.21Å; D162-Y166 PolarHBondContact O-OH 3.38Å; D162-L187 HydrophobicContact CB-CD2 3.95Å
163	A	89	Confident	91.4	Very high	17 Å²	17	37 Å²	37	14%	0.14	19%	0.192	C	C	.	.			trans	-61	127.2	-173.6	0	0	0	0	0	113.3	K124 R160 L187 V189	K124-A163 WeakPolarHBondContact CE-O 3.46Å; K124-A163 PolarHBondContact NZ-O 3.37Å; R160-A163 PolarHBondContact O-N 3.42Å; A163-L187 CarbonylContact C-O 3.26Å; A163-L187 WeakPolarHBondContact CA-O 3.47Å; A163-V189 HydrophobicContact CB-CB 4.35Å; A163-V189 HydrophobicContact CB-CG2 3.83Å
164	G	90	Very high	90.6	Very high	10 Å²	10	42.6 Å²	42.6	10%	0.103	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151.9	-168.4	179.7	0	0	0	0	0	115.2	D162 Y166 L187	D162-G164 PolarHBondContact O-N 3.47Å; G164-Y166 WeakPolarHBondContact O-CD2 3.26Å; G164-L187 PolarHBondContact N-O 2.96Å; G164-L187 PolarHBondContact O-N 3.43Å
165	E	92.3	Very high	89.6	Confident	63 Å²	63	46.9 Å²	46.9	29%	0.294	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	133.6	-179.9	-173.2	-166.1	107.8	0	0	113	R122 K124 K184 T185	R122-E165 IonicContact CZ-OE1 2.71Å; R122-E165 IonicContact NE-OE1 3.09Å; R122-E165 IonicContact NH2-OE1 2.82Å; R122-E165 PolarHBondContact NH2-OE1 3.31Å; K124-E165 PolarHBondContact N-O 2.74Å; E165-K184 VanDerWaalsContact CD-CE 3.48Å; E165-K184 VanDerWaalsContact CD-NZ 3.29Å; E165-K184 HydrophobicContact CG-CD 4.27Å; E165-K184 HydrophobicContact CG-CG 4.42Å; E165-K184 VanDerWaalsContact OE1-CE 3.26Å; E165-K184 WeakPolarHBondContact OE1-CE 3.38Å; E165-K184 IonicContact OE1-NZ 3.78Å; E165-K184 PolarHBondContact OE1-NZ 2.85Å; E165-K184 WeakPolarHBondContact OE2-CE 3.27Å; E165-K184 IonicContact OE2-NZ 2.95Å; E165-K184 PolarHBondContact OE2-NZ 2.88Å; E165-T185 WeakPolarHBondContact CA-O 3.47Å
166	Y	93.9	Very high	88.5	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.008	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	156.7	166.9	-64.8	-108.7	0	0	0	110.1	M108 R122 A123 F140 L153 I155 D162 G164 K184 T185 L187	M108-Y166 HydrophobicContact CE-CD1 3.84Å; M108-Y166 HydrophobicContact CE-CD2 4.33Å; M108-Y166 HydrophobicContact CE-CE1 3.95Å; M108-Y166 HydrophobicContact CE-CE2 4.47Å; M108-Y166 HydrophobicContact CE-CG 4.06Å; M108-Y166 HydrophobicContact SD-CD1 4.42Å; M108-Y166 HydrophobicContact SD-CD2 4.17Å; M108-Y166 HydrophobicContact SD-CG 4.05Å; R122-Y166 CarbonylContact O-C 3Å; R122-Y166 WeakPolarHBondContact O-CA 3.37Å; A123-Y166 HydrophobicContact CB-CD1 3.47Å; A123-Y166 VanDerWaalsContact CB-CD1 3.47Å; A123-Y166 HydrophobicContact CB-CE1 3.31Å; A123-Y166 HydrophobicContact CB-CG 4.4Å; F140-Y166 AromaticContact CE1-CE1 3.98Å; F140-Y166 HydrophobicContact CE1-CE1 3.98Å; L153-Y166 HydrophobicContact CD2-CD1 3.73Å; L153-Y166 HydrophobicContact CD2-CE1 4.07Å; I155-Y166 HydrophobicContact CD1-CE1 3.71Å; I155-Y166 WeakPolarHBondContact CD1-OH 3.3Å; D162-Y166 WeakPolarHBondContact O-CE2 3.21Å; D162-Y166 PolarHBondContact O-OH 3.38Å; G164-Y166 WeakPolarHBondContact O-CD2 3.26Å; Y166-K184 CarbonylContact O-C 3.53Å; Y166-K184 VanDerWaalsContact O-CA 3.28Å; Y166-K184 WeakPolarHBondContact O-CA 2.92Å; Y166-T185 PolarHBondContact N-O 2.89Å; Y166-T185 PolarHBondContact O-N 3.44Å; Y166-L187 HydrophobicContact CD2-CB 4.18Å; Y166-L187 HydrophobicContact CE2-CB 3.8Å; Y166-L187 HydrophobicContact CE2-CD2 4.08Å
167	E	93.3	Very high	87.9	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	123.3	175.9	-169.4	-175.6	-80.3	0	0	111.2	R122 Q169 R182 R183 K184	R122-E167 HydrophobicContact CB-CB 4.19Å; R122-E167 VanDerWaalsContact CZ-CD 3.47Å; R122-E167 IonicContact CZ-OE1 3.85Å; R122-E167 IonicContact CZ-OE2 3.87Å; R122-E167 PolarHBondContact N-O 3.3Å; R122-E167 IonicContact NH1-OE1 3.17Å; R122-E167 PolarHBondContact NH1-OE1 2.77Å; R122-E167 VanDerWaalsContact NH1-OE1 3.15Å; R122-E167 IonicContact NH1-OE2 3.62Å; R122-E167 PolarHBondContact NH1-OE2 3.41Å; R122-E167 IonicContact NH2-OE1 3.55Å; R122-E167 PolarHBondContact NH2-OE1 2.95Å; R122-E167 IonicContact NH2-OE2 2.9Å; R122-E167 PolarHBondContact O-N 3.21Å; E167-Q169 HydrophobicContact CG-CG 4.33Å; E167-Q169 PolarHBondContact OE2-NE2 2.87Å; E167-R182 HydrophobicContact CG-CB 4.42Å; E167-R182 WeakPolarHBondContact OE2-CD 3.43Å; E167-R183 CarbonylContact C-O 3.58Å; E167-R183 VanDerWaalsContact CA-O 3.28Å; E167-R183 WeakPolarHBondContact CA-O 3.39Å; E167-K184 HydrophobicContact CB-CG 4.08Å; E167-K184 HydrophobicContact CG-CG 3.88Å; E167-K184 WeakPolarHBondContact OE1-CE 3.27Å; E167-K184 WeakPolarHBondContact OE1-CG 3.35Å
168	C	93.7	Very high	87.8	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	135.7	169.7	-171.4	0	0	0	0	109.6	P94 C110 W121 R182 R183	P94-C168 HydrophobicContact CG-CB 4.37Å; C110-C168 HydrophobicContact CB-CB 3.76Å; C110-C168 WeakPolarHBondContact CB-SG 3.45Å; C110-C168 WeakPolarHBondContact SG-CB 3.3Å; C110-C168 CovalentContact SG-SG 2.04Å; C110-C168 PolarHBondContact SG-SG 2.98Å; W121-C168 HydrophobicContact CD2-CB 4.03Å; W121-C168 HydrophobicContact CE3-CB 4.1Å; W121-C168 HydrophobicContact CH2-CB 4Å; W121-C168 HydrophobicContact CZ2-CB 3.89Å; W121-C168 HydrophobicContact CZ3-CB 4.09Å; C168-R182 CarbonylContact O-C 3.52Å; C168-R182 VanDerWaalsContact O-CA 3.3Å; C168-R182 WeakPolarHBondContact O-CA 3.18Å; C168-R183 PolarHBondContact N-O 2.91Å; C168-R183 PolarHBondContact O-N 2.79Å
169	Q	92.4	Very high	87.6	Confident	23 Å²	23	56.2 Å²	56.2	11%	0.107	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	143.4	-175.4	-51.7	-169.5	-29	0	0	112.4	V119 Q120 E167 L181 R182	V119-Q169 CarbonylContact C-O 3.58Å; V119-Q169 WeakPolarHBondContact CA-O 3.17Å; Q120-Q169 HydrophobicContact CG-CB 4.02Å; Q120-Q169 PolarHBondContact N-O 2.8Å; Q120-Q169 PolarHBondContact O-N 2.92Å; E167-Q169 HydrophobicContact CG-CG 4.33Å; E167-Q169 PolarHBondContact OE2-NE2 2.87Å; Q169-L181 CarbonylContact C-O 3.46Å; Q169-L181 WeakPolarHBondContact CA-O 3.29Å; Q169-R182 HydrophobicContact CB-CG 4.37Å; Q169-R182 HydrophobicContact CG-CG 4.12Å
170	V	92.3	Very high	87.5	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.006	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	123.2	177.5	-167.8	0	0	0	0	110.4	F90 V112 K118 V119 L180 L181	F90-V170 HydrophobicContact CE1-CG2 3.76Å; F90-V170 HydrophobicContact CZ-CG2 4.16Å; V112-V170 HydrophobicContact CG1-CG1 4.38Å; V112-V170 HydrophobicContact CG1-CG2 4.32Å; V112-V170 HydrophobicContact CG2-CG2 3.7Å; K118-V170 WeakPolarHBondContact O-CA 3.37Å; V119-V170 HydrophobicContact CG1-CG2 4.32Å; V119-V170 HydrophobicContact CG2-CB 4.43Å; V119-V170 HydrophobicContact CG2-CG1 3.96Å; V119-V170 HydrophobicContact CG2-CG2 3.95Å; V170-L180 WeakPolarHBondContact O-CA 3.4Å; V170-L180 WeakPolarHBondContact O-CD1 3Å; V170-L181 HydrophobicContact CB-CB 3.87Å; V170-L181 HydrophobicContact CB-CD1 4.1Å; V170-L181 HydrophobicContact CB-CG 4.16Å; V170-L181 HydrophobicContact CG2-CB 3.9Å; V170-L181 HydrophobicContact CG2-CD1 3.97Å; V170-L181 HydrophobicContact CG2-CG 4.38Å; V170-L181 PolarHBondContact N-O 3.03Å; V170-L181 PolarHBondContact O-N 3.17Å
171	T	89.3	Confident	87.7	Confident	35 Å²	35	49 Å²	49	22%	0.215	28%	0.283	C	S	.	.			trans	-68.3	145.9	-175.3	64.6	0	0	0	0	112.9	Q88 G117 K118 Y130	Q88-T171 PolarHBondContact NE2-O 2.83Å; G117-T171 WeakPolarHBondContact CA-O 3.32Å; G117-T171 WeakPolarHBondContact CA-OG1 3.33Å; K118-T171 HydrophobicContact CB-CG2 4.41Å; K118-T171 PolarHBondContact N-OG1 2.68Å; K118-T171 PolarHBondContact O-N 2.8Å; Y130-T171 HydrophobicContact CE1-CG2 4.23Å; Y130-T171 WeakPolarHBondContact OH-CG2 3.43Å
172	P	89.9	Confident	87.8	Confident	69 Å²	69	46 Å²	46	45%	0.448	26%	0.262	S	S	.	.			trans	-69.2	159.8	173.5	32	-35.8	0	0	0	111.7	H178 L180	P172-H178 VanDerWaalsContact CA-O 3.23Å; P172-H178 WeakPolarHBondContact CA-O 2.83Å; P172-H178 VanDerWaalsContact CB-O 3.32Å; P172-H178 WeakPolarHBondContact CB-O 3.42Å; P172-L180 HydrophobicContact CB-CB 4.34Å; P172-L180 HydrophobicContact CG-CB 4.35Å
173	V	87	Confident	87.9	Confident	35 Å²	35	47.5 Å²	47.5	21%	0.212	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-130.7	105.9	173.5	-178.5	0	0	0	0	109.7	H116 V175 N177 H178	H116-V173 HydrophobicContact CB-CB 4.4Å; H116-V173 HydrophobicContact CB-CG2 3.99Å; V173-V175 PolarHBondContact O-N 2.71Å; V173-N177 PolarHBondContact O-N 3.28Å; V173-H178 HydrophobicContact CB-CB 4.11Å; V173-H178 PolarHBondContact N-O 3.12Å; V173-H178 PolarHBondContact O-N 2.86Å
174	P	77.1	Confident	88	Confident	118 Å²	118	50.6 Å²	50.6	77%	0.766	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-60.8	-37.8	-172.6	-27.3	35.4	0	0	0	114.9	N176 N177	P174-N176 PolarHBondContact O-N 3.2Å; P174-N176 VanDerWaalsContact O-N 3.1Å; P174-N177 PolarHBondContact O-N 3.22Å
175	V	74.1	Confident	88.1	Confident	130 Å²	130	50.3 Å²	50.3	79%	0.788	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-54.2	-37.2	-170.3	-176.4	0	0	0	0	113.1	V173	V173-V175 PolarHBondContact O-N 2.71Å
176	N	70.9	Confident	88.1	Confident	102 Å²	102	52.1 Å²	52.1	55%	0.545	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-122	19.9	179.9	-72.8	-2.1	0	0	0	111.9	P174 H178	P174-N176 PolarHBondContact O-N 3.2Å; P174-N176 VanDerWaalsContact O-N 3.1Å; N176-H178 VanDerWaalsContact CB-CD2 3.4Å; N176-H178 WeakPolarHBondContact CB-CD2 2.9Å; N176-H178 WeakPolarHBondContact CB-NE2 3.27Å; N176-H178 PolarHBondContact O-N 3.44Å
177	N	79.6	Confident	88.1	Confident	144 Å²	144	52 Å²	52	77%	0.77	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	33.7	176.1	-145.3	21	0	0	0	115.7	V173 P174	V173-N177 PolarHBondContact O-N 3.28Å; P174-N177 PolarHBondContact O-N 3.22Å
178	H	88.2	Confident	88	Confident	10 Å²	10	53.9 Å²	53.9	5%	0.046	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-76	129.7	179.7	-62.6	-101.1	0	0	0	111.4	R86 Q88 H116 P172 V173 N176	R86-H178 PolarHBondContact O-CE1 2.91Å; Q88-H178 HydrophobicContact CG-CB 3.97Å; Q88-H178 PolarHBondContact N-ND1 3Å; H116-H178 AromaticContact CD2-CE1 3.11Å; H116-H178 PolarHBondContact CD2-CE1 3.44Å; H116-H178 AromaticContact CD2-ND1 3.75Å; H116-H178 AromaticContact CD2-NE2 3.59Å; H116-H178 AromaticContact CE1-NE2 3.89Å; H116-H178 AromaticContact CG-CE1 3.41Å; H116-H178 VanDerWaalsContact CG-CE1 3.41Å; H116-H178 AromaticContact CG-ND1 3.91Å; H116-H178 AromaticContact CG-NE2 3.46Å; H116-H178 AromaticContact ND1-CE1 3.99Å; H116-H178 AromaticContact ND1-NE2 3.67Å; H116-H178 AromaticContact NE2-CE1 3.58Å; H116-H178 AromaticContact NE2-NE2 3.86Å; P172-H178 VanDerWaalsContact CA-O 3.23Å; P172-H178 WeakPolarHBondContact CA-O 2.83Å; P172-H178 VanDerWaalsContact CB-O 3.32Å; P172-H178 WeakPolarHBondContact CB-O 3.42Å; V173-H178 HydrophobicContact CB-CB 4.11Å; V173-H178 PolarHBondContact N-O 3.12Å; V173-H178 PolarHBondContact O-N 2.86Å; N176-H178 VanDerWaalsContact CB-CD2 3.4Å; N176-H178 WeakPolarHBondContact CB-CD2 2.9Å; N176-H178 WeakPolarHBondContact CB-NE2 3.27Å; N176-H178 PolarHBondContact O-N 3.44Å
179	P	86.7	Confident	87.8	Confident	51 Å²	51	54 Å²	54	33%	0.331	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-77.6	158.4	-173.5	31.8	-36.9	0	0	0	113.7	I87 Q88 L181	I87-P179 HydrophobicContact CG2-CG 3.97Å; Q88-P179 PolarHBondContact NE2-O 2.82Å; P179-L181 HydrophobicContact CG-CD2 4.25Å
180	L	89.4	Confident	87.7	Confident	74 Å²	74	53.4 Å²	53.4	39%	0.387	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-71.5	125.2	168.5	174.5	77.2	0	0	0	109.6	V170 P172 R182	V170-L180 WeakPolarHBondContact O-CA 3.4Å; V170-L180 WeakPolarHBondContact O-CD1 3Å; P172-L180 HydrophobicContact CB-CB 4.34Å; P172-L180 HydrophobicContact CG-CB 4.35Å; L180-R182 VanDerWaalsContact CD2-CZ 3.45Å
181	L	92.1	Very high	87.5	Confident	5 Å²	5	54.8 Å²	54.8	3%	0.026	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	140.7	176.8	-48.3	174.1	0	0	0	111.7	S75 Q88 F90 V112 Q169 V170 P179	S75-L181 VanDerWaalsContact OG-CA 3.28Å; S75-L181 WeakPolarHBondContact OG-CA 3.37Å; Q88-L181 HydrophobicContact CG-CD1 4.13Å; Q88-L181 HydrophobicContact CG-CG 4.39Å; F90-L181 HydrophobicContact CD1-CD1 4.35Å; F90-L181 HydrophobicContact CD2-CB 4.27Å; F90-L181 HydrophobicContact CE1-CB 4.21Å; F90-L181 HydrophobicContact CE1-CD1 4.4Å; F90-L181 HydrophobicContact CE2-CB 3.69Å; F90-L181 HydrophobicContact CG-CD1 4.45Å; F90-L181 HydrophobicContact CZ-CB 3.65Å; V112-L181 HydrophobicContact CG1-CD1 4.09Å; Q169-L181 CarbonylContact C-O 3.46Å; Q169-L181 WeakPolarHBondContact CA-O 3.29Å; V170-L181 HydrophobicContact CB-CB 3.87Å; V170-L181 HydrophobicContact CB-CD1 4.1Å; V170-L181 HydrophobicContact CB-CG 4.16Å; V170-L181 HydrophobicContact CG2-CB 3.9Å; V170-L181 HydrophobicContact CG2-CD1 3.97Å; V170-L181 HydrophobicContact CG2-CG 4.38Å; V170-L181 PolarHBondContact N-O 3.03Å; V170-L181 PolarHBondContact O-N 3.17Å; P179-L181 HydrophobicContact CG-CD2 4.25Å
182	R	91.8	Very high	87.3	Confident	69 Å²	69	60.3 Å²	60.3	26%	0.26	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	132.9	177	-69	-174.4	-80.5	-155.3	-2.6	112.3	Q74 S75 E167 C168 Q169 L180	Q74-R182 CarbonylContact C-O 3.58Å; Q74-R182 WeakPolarHBondContact CA-O 3.3Å; S75-R182 PolarHBondContact N-O 2.79Å; S75-R182 PolarHBondContact OG-N 3.49Å; E167-R182 HydrophobicContact CG-CB 4.42Å; E167-R182 WeakPolarHBondContact OE2-CD 3.43Å; C168-R182 CarbonylContact O-C 3.52Å; C168-R182 VanDerWaalsContact O-CA 3.3Å; C168-R182 WeakPolarHBondContact O-CA 3.18Å; Q169-R182 HydrophobicContact CB-CG 4.37Å; Q169-R182 HydrophobicContact CG-CG 4.12Å; L180-R182 VanDerWaalsContact CD2-CZ 3.45Å
183	R	92.6	Very high	87.3	Confident	40 Å²	40	57.1 Å²	57.1	15%	0.151	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	122.9	173.9	-169.1	64.6	169.5	-147.4	11.7	113.3	Q74 S75 N76 F90 L93 P94 E96 E167 C168	Q74-R183 VanDerWaalsContact OE1-CA 3.3Å; S75-R183 WeakPolarHBondContact O-CD 3.49Å; S75-R183 PolarHBondContact O-NH1 3.46Å; N76-R183 PolarHBondContact OD1-NH1 2.84Å; F90-R183 HydrophobicContact CD2-CB 4.34Å; F90-R183 HydrophobicContact CE2-CB 3.77Å; F90-R183 HydrophobicContact CZ-CB 4.29Å; L93-R183 HydrophobicContact CB-CG 4.34Å; L93-R183 HydrophobicContact CD2-CB 4.29Å; L93-R183 HydrophobicContact CD2-CG 3.91Å; P94-R183 HydrophobicContact CG-CB 4.48Å; P94-R183 HydrophobicContact CG-CG 4.34Å; E96-R183 IonicContact OE1-NH2 2.71Å; E167-R183 CarbonylContact C-O 3.58Å; E167-R183 VanDerWaalsContact CA-O 3.28Å; E167-R183 WeakPolarHBondContact CA-O 3.39Å; C168-R183 PolarHBondContact N-O 2.91Å; C168-R183 PolarHBondContact O-N 2.79Å
184	K	91.4	Very high	87.3	Confident	81 Å²	81	60.3 Å²	60.3	35%	0.352	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	157.7	178.4	-74.6	-176.5	176.1	-158.5	0	114.2	E165 Y166 E167	E165-K184 VanDerWaalsContact CD-CE 3.48Å; E165-K184 VanDerWaalsContact CD-NZ 3.29Å; E165-K184 HydrophobicContact CG-CD 4.27Å; E165-K184 HydrophobicContact CG-CG 4.42Å; E165-K184 VanDerWaalsContact OE1-CE 3.26Å; E165-K184 WeakPolarHBondContact OE1-CE 3.38Å; E165-K184 IonicContact OE1-NZ 3.78Å; E165-K184 PolarHBondContact OE1-NZ 2.85Å; E165-K184 WeakPolarHBondContact OE2-CE 3.27Å; E165-K184 IonicContact OE2-NZ 2.95Å; E165-K184 PolarHBondContact OE2-NZ 2.88Å; Y166-K184 CarbonylContact O-C 3.53Å; Y166-K184 VanDerWaalsContact O-CA 3.28Å; Y166-K184 WeakPolarHBondContact O-CA 2.92Å; E167-K184 HydrophobicContact CB-CG 4.08Å; E167-K184 HydrophobicContact CG-CG 3.88Å; E167-K184 WeakPolarHBondContact OE1-CE 3.27Å; E167-K184 WeakPolarHBondContact OE1-CG 3.35Å
185	T	92.9	Very high	87.7	Confident	5 Å²	5	62.3 Å²	62.3	3%	0.031	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	160.8	169.8	-178.3	0	0	0	0	110.2	P94 S95 Y98 M108 W121 E165 Y166	P94-T185 HydrophobicContact CB-CG2 4Å; S95-T185 WeakPolarHBondContact O-CB 3.34Å; S95-T185 PolarHBondContact O-OG1 2.9Å; Y98-T185 VanDerWaalsContact CD2-OG1 3.3Å; Y98-T185 WeakPolarHBondContact CD2-OG1 3.43Å; Y98-T185 WeakPolarHBondContact CE2-OG1 3.19Å; M108-T185 HydrophobicContact SD-CG2 3.89Å; W121-T185 HydrophobicContact CZ3-CG2 4.13Å; E165-T185 WeakPolarHBondContact CA-O 3.47Å; Y166-T185 PolarHBondContact N-O 2.89Å; Y166-T185 PolarHBondContact O-N 3.44Å
186	Y	92.5	Very high	88.4	Confident	101 Å²	101	56.4 Å²	56.4	40%	0.396	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129.2	177.2	-165	-94.5	0	0	0	112.1	E96 Q97 Y98	E96-Y186 PolarHBondContact O-N 3.12Å; Q97-Y186 CarbonylContact C-O 3.6Å; Q97-Y186 VanDerWaalsContact CA-O 3.28Å; Q97-Y186 WeakPolarHBondContact CA-O 3.4Å; Y98-Y186 PolarHBondContact N-O 3.29Å
187	L	92.8	Very high	89.3	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	122.7	174.1	-179.1	60.3	0	0	0	110.3	I100 V106 I155 V158 D162 A163 G164 Y166	I100-L187 HydrophobicContact CB-CD1 4.38Å; I100-L187 HydrophobicContact CG1-CD1 3.97Å; V106-L187 HydrophobicContact CG1-CD1 4.18Å; V106-L187 HydrophobicContact CG1-CD2 4.31Å; V106-L187 HydrophobicContact CG2-CD1 4.29Å; I155-L187 HydrophobicContact CD1-CD2 4.27Å; V158-L187 HydrophobicContact CG1-CD2 4.39Å; D162-L187 HydrophobicContact CB-CD2 3.95Å; A163-L187 CarbonylContact C-O 3.26Å; A163-L187 WeakPolarHBondContact CA-O 3.47Å; G164-L187 PolarHBondContact N-O 2.96Å; G164-L187 PolarHBondContact O-N 3.43Å; Y166-L187 HydrophobicContact CD2-CB 4.18Å; Y166-L187 HydrophobicContact CE2-CB 3.8Å; Y166-L187 HydrophobicContact CE2-CD2 4.08Å
188	E	90.8	Very high	89.8	Confident	39 Å²	39	49.3 Å²	49.3	18%	0.182	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	138.1	169.8	176	163.4	-135.3	0	0	110.9	Q97 Y98 A99 I100 L190 R231	Q97-E188 PolarHBondContact NE2-OE2 2.83Å; Y98-E188 PolarHBondContact O-N 3.35Å; A99-E188 WeakPolarHBondContact CA-O 3.5Å; A99-E188 HydrophobicContact CB-CB 4.43Å; I100-E188 PolarHBondContact N-O 3.25Å; E188-L190 HydrophobicContact CG-CD2 4.35Å; E188-R231 IonicContact OE1-NE 3.02Å
189	V	90.6	Very high	89.8	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.012	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	113.5	-178.2	-178.8	0	0	0	0	109.7	I100 L102 V158 A163 R231	I100-V189 CarbonylContact O-C 3.56Å; I100-V189 VanDerWaalsContact O-CA 3.32Å; I100-V189 WeakPolarHBondContact O-CA 3.47Å; L102-V189 HydrophobicContact CB-CG1 4.34Å; L102-V189 HydrophobicContact CD1-CG1 3.89Å; V158-V189 HydrophobicContact CG1-CG1 4.3Å; V158-V189 HydrophobicContact CG1-CG2 3.55Å; A163-V189 HydrophobicContact CB-CB 4.35Å; A163-V189 HydrophobicContact CB-CG2 3.83Å; V189-R231 WeakPolarHBondContact O-CD 2.93Å
190	L	90.4	Very high	89.6	Confident	11 Å²	11	49.8 Å²	49.8	6%	0.058	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	136.9	-177.2	-56.1	174.2	0	0	0	110.7	A99 I100 P101 L102 E188 R231 A310 I313	A99-L190 HydrophobicContact CB-CD1 4.15Å; A99-L190 HydrophobicContact CB-CD2 4.31Å; A99-L190 HydrophobicContact CB-CG 4.3Å; I100-L190 PolarHBondContact O-N 3.31Å; P101-L190 WeakPolarHBondContact CA-O 3.34Å; L102-L190 PolarHBondContact N-O 3.25Å; E188-L190 HydrophobicContact CG-CD2 4.35Å; L190-R231 WeakPolarHBondContact CA-O 3.27Å; L190-A310 HydrophobicContact CB-CB 3.99Å; L190-I313 HydrophobicContact CD1-CD1 3.64Å
191	I	88	Confident	88.7	Confident	30 Å²	30	51.4 Å²	51.4	15%	0.154	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-134	134.5	-173.6	-54.2	176.8	0	0	0	108.4	R160 G230 R231 N308 A310	R160-I191 HydrophobicContact CG-CD1 4.45Å; I191-G230 CarbonylContact O-C 3.59Å; I191-G230 VanDerWaalsContact O-CA 3.32Å; I191-G230 WeakPolarHBondContact O-CA 3.04Å; I191-R231 HydrophobicContact CB-CB 3.96Å; I191-R231 HydrophobicContact CD1-CB 4.25Å; I191-R231 HydrophobicContact CG1-CB 4.09Å; I191-R231 PolarHBondContact N-O 3.49Å; I191-R231 PolarHBondContact O-N 3.49Å; I191-N308 PolarHBondContact O-ND2 2.92Å; I191-A310 WeakPolarHBondContact O-CB 3.32Å
192	K	85.5	Confident	87.7	Confident	151 Å²	151	57.4 Å²	57.4	66%	0.657	27%	0.265	S	S	*	.	P	Polyproline II helix	trans	-75.4	150.2	174.8	63	168.5	-173	164	0	111.9	A310 T311	K192-A310 HydrophobicContact CB-CB 4.45Å; K192-T311 HydrophobicContact CB-CG2 4.01Å
193	P	88.1	Confident	86.7	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.013	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-70.2	170.7	169.5	31.9	-35.8	0	0	0	111.9	G229 P234 V306 T311 L322	P193-G229 VanDerWaalsContact CA-O 3.3Å; P193-G229 WeakPolarHBondContact CA-O 3.01Å; P193-G229 VanDerWaalsContact CB-O 3.24Å; P193-G229 WeakPolarHBondContact CB-O 3.39Å; P193-P234 HydrophobicContact CB-CB 4.17Å; P193-P234 HydrophobicContact CB-CG 4.38Å; P193-P234 HydrophobicContact CG-CB 4.38Å; P193-V306 HydrophobicContact CG-CG1 4.3Å; P193-T311 HydrophobicContact CG-CG2 4.44Å; P193-L322 HydrophobicContact CG-CD1 4.13Å
194	N	87	Confident	85.7	Confident	101 Å²	101	60 Å²	60	54%	0.54	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-71.1	168.2	167.5	-71.2	-35.9	0	0	0	111.9	V228 L322	N194-V228 VanDerWaalsContact CB-O 3.32Å; N194-V228 WeakPolarHBondContact CB-O 3.43Å; N194-V228 VanDerWaalsContact CG-O 3.29Å; N194-V228 PolarHBondContact N-O 2.76Å; N194-V228 VanDerWaalsContact N-O 3.17Å; N194-V228 PolarHBondContact ND2-O 2.77Å; N194-L322 WeakPolarHBondContact O-CD1 3.5Å
195	E	85.3	Confident	84.9	Confident	160 Å²	160	57.3 Å²	57.3	75%	0.748	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-66	132.4	172.6	-68.9	-179.1	-171.5	0	0	110.6
196	P	90	Very high	83.6	Confident	7 Å²	7	61.4 Å²	61.4	5%	0.045	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-69.5	146.7	-174.8	27	-34.5	0	0	0	112.6	S226 A227 V306 L322 I324	P196-S226 WeakPolarHBondContact CA-O 3.13Å; P196-A227 HydrophobicContact CB-CB 4.27Å; P196-V306 HydrophobicContact CB-CG2 3.82Å; P196-V306 HydrophobicContact CG-CG2 4.2Å; P196-L322 HydrophobicContact CG-CB 4.3Å; P196-I324 HydrophobicContact CB-CG2 4.01Å; P196-I324 HydrophobicContact CG-CB 4.4Å; P196-I324 HydrophobicContact CG-CG2 3.96Å; P196-I324 WeakPolarHBondContact O-CD1 3.27Å; P196-I324 WeakPolarHBondContact O-CG2 3.4Å
197	Q	89.7	Confident	82.6	Confident	92 Å²	92	64 Å²	64	43%	0.43	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	133.1	174.6	-58	-171.1	14.4	0	0	110.4	C225 S226	Q197-C225 CarbonylContact O-C 3.37Å; Q197-C225 VanDerWaalsContact O-CA 3.31Å; Q197-C225 WeakPolarHBondContact O-CA 3.04Å; Q197-S226 PolarHBondContact N-O 3.49Å; Q197-S226 PolarHBondContact O-N 2.7Å
198	I	90	Very high	82.2	Confident	4 Å²	4	70.7 Å²	70.7	2%	0.021	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	126.3	169.7	-65.7	164.4	0	0	0	109.2	L223 V224 C225 W238 C304 I324 I326	I198-L223 HydrophobicContact CG2-CB 4.17Å; I198-L223 HydrophobicContact CG2-CD2 4.07Å; I198-V224 CarbonylContact C-O 3.47Å; I198-V224 WeakPolarHBondContact CA-O 2.98Å; I198-C225 HydrophobicContact CG1-CB 4.49Å; I198-W238 HydrophobicContact CD1-CZ3 3.97Å; I198-W238 HydrophobicContact CG1-CH2 4.15Å; I198-W238 HydrophobicContact CG1-CZ3 4.12Å; I198-C304 HydrophobicContact CD1-CB 3.91Å; I198-C304 HydrophobicContact CG1-CB 3.94Å; I198-I324 HydrophobicContact CD1-CG2 3.86Å; I198-I324 HydrophobicContact CG1-CG2 3.8Å; I198-I326 HydrophobicContact CB-CG2 4.28Å; I198-I326 HydrophobicContact CD1-CG1 4.34Å; I198-I326 HydrophobicContact CD1-CG2 4.17Å; I198-I326 HydrophobicContact CG2-CD1 4.01Å; I198-I326 HydrophobicContact CG2-CG2 4.45Å
199	L	87.2	Confident	81.7	Confident	33 Å²	33	72 Å²	72	17%	0.173	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	141.5	175.9	-52.2	176.7	0	0	0	109.5	V203 Q204 L223 V224	L199-V203 WeakPolarHBondContact CA-O 3.41Å; L199-Q204 HydrophobicContact CD2-CB 4.05Å; L199-L223 WeakPolarHBondContact O-CA 3.16Å; L199-V224 HydrophobicContact CB-CB 4.45Å; L199-V224 PolarHBondContact N-O 3.39Å; L199-V224 PolarHBondContact O-N 3.33Å
200	Y	82.9	Confident	81.4	Confident	39 Å²	39	72 Å²	72	15%	0.153	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	123.7	171	175.3	-117.4	0	0	0	108.4	N202 V203 L205 L210 I221 S222 L223	Y200-N202 PolarHBondContact O-N 2.66Å; Y200-V203 PolarHBondContact N-O 3.06Å; Y200-V203 PolarHBondContact O-N 2.85Å; Y200-L205 HydrophobicContact CD1-CD2 4.12Å; Y200-L205 HydrophobicContact CG-CD2 4.24Å; Y200-L210 HydrophobicContact CD1-CD1 3.61Å; Y200-L210 HydrophobicContact CD2-CD1 3.96Å; Y200-L210 HydrophobicContact CE1-CD1 3.89Å; Y200-L210 HydrophobicContact CE2-CD1 4.24Å; Y200-L210 HydrophobicContact CG-CD1 3.65Å; Y200-I221 HydrophobicContact CE2-CB 3.95Å; Y200-I221 HydrophobicContact CE2-CG2 3.95Å; Y200-S222 WeakPolarHBondContact CD2-O 3.48Å; Y200-L223 HydrophobicContact CD2-CD2 3.9Å; Y200-L223 HydrophobicContact CG-CD2 4.29Å
201	Q	71.6	Confident	80.7	Confident	108 Å²	108	75.9 Å²	75.9	51%	0.505	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	40.1	-172.1	-50.1	-172.9	10.4	0	0	112.3	V203	Q201-V203 PolarHBondContact O-N 2.82Å; Q201-V203 VanDerWaalsContact O-N 3.15Å
202	N	70.4	Confident	80	Confident	130 Å²	130	74.5 Å²	74.5	70%	0.695	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.3	-3.5	-173.6	-56.3	-13.5	0	0	0	116.5	Y200	Y200-N202 PolarHBondContact O-N 2.66Å
203	V	70.5	Confident	79.1	Confident	50 Å²	50	68.4 Å²	68.4	30%	0.303	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	140.5	178.1	-176	0	0	0	0	110.8	L199 Y200 Q201 L205	L199-V203 WeakPolarHBondContact CA-O 3.41Å; Y200-V203 PolarHBondContact N-O 3.06Å; Y200-V203 PolarHBondContact O-N 2.85Å; Q201-V203 PolarHBondContact O-N 2.82Å; Q201-V203 VanDerWaalsContact O-N 3.15Å; V203-L205 PolarHBondContact O-N 2.78Å
204	Q	72.8	Confident	77.9	Confident	115 Å²	115	71.9 Å²	71.9	54%	0.537	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	126.3	173.3	-170.9	178.5	40.6	0	0	110.9	L199 P206	L199-Q204 HydrophobicContact CD2-CB 4.05Å; Q204-P206 WeakPolarHBondContact O-CD 3.34Å
205	L	74.2	Confident	76.4	Confident	24 Å²	24	72.9 Å²	72.9	13%	0.126	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-66.1	121.9	-173.7	-74	173.4	0	0	0	113.2	Y200 V203 R208 L210 I326	Y200-L205 HydrophobicContact CD1-CD2 4.12Å; Y200-L205 HydrophobicContact CG-CD2 4.24Å; V203-L205 PolarHBondContact O-N 2.78Å; L205-R208 PolarHBondContact O-N 3.37Å; L205-L210 HydrophobicContact CD1-CB 4.06Å; L205-L210 HydrophobicContact CD1-CD1 4.18Å; L205-L210 HydrophobicContact CD2-CD1 3.86Å; L205-I326 HydrophobicContact CD1-CB 4.39Å; L205-I326 HydrophobicContact CD1-CD1 3.54Å; L205-I326 HydrophobicContact CD1-CG2 4.12Å
206	P	65.5	Low	74.7	Confident	90 Å²	90	68.1 Å²	68.1	58%	0.584	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-57.2	138.9	174.3	-23.7	34.2	0	0	0	112	Q204 R208 K209	Q204-P206 WeakPolarHBondContact O-CD 3.34Å; P206-R208 PolarHBondContact O-N 3.04Å; P206-K209 PolarHBondContact O-N 2.97Å
207	E	72.4	Confident	72.6	Confident	156 Å²	156	71.7 Å²	71.7	73%	0.729	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	53.7	10.3	-177.5	-55.2	-167	159.7	0	0	115.8	K209	E207-K209 HydrophobicContact CB-CD 4.15Å; E207-K209 HydrophobicContact CB-CG 4.2Å; E207-K209 PolarHBondContact O-N 3.31Å; E207-K209 WeakPolarHBondContact OE2-CE 3.24Å; E207-K209 IonicContact OE2-NZ 2.63Å; E207-K209 PolarHBondContact OE2-NZ 3.48Å
208	R	82.4	Confident	70.8	Confident	140 Å²	140	69 Å²	69	53%	0.528	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	60.3	27.6	-165.3	-55.2	179.2	175.5	-170.2	-3.9	113.5	L205 P206 T325 I326 T327	L205-R208 PolarHBondContact O-N 3.37Å; P206-R208 PolarHBondContact O-N 3.04Å; R208-T325 WeakPolarHBondContact CD-O 3.39Å; R208-I326 HydrophobicContact CB-CG2 4.13Å; R208-I326 CarbonylContact O-C 3.58Å; R208-I326 WeakPolarHBondContact O-CA 3.47Å; R208-I326 VanDerWaalsContact O-CB 3.24Å; R208-I326 WeakPolarHBondContact O-CB 3.42Å; R208-T327 PolarHBondContact O-N 3.27Å
209	K	80.6	Confident	69.4	Low	68 Å²	68	71.7 Å²	71.7	30%	0.296	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	141.4	175.5	-68.6	175.1	179.6	165.6	0	111.9	P206 E207 T327	P206-K209 PolarHBondContact O-N 2.97Å; E207-K209 HydrophobicContact CB-CD 4.15Å; E207-K209 HydrophobicContact CB-CG 4.2Å; E207-K209 PolarHBondContact O-N 3.31Å; E207-K209 WeakPolarHBondContact OE2-CE 3.24Å; E207-K209 IonicContact OE2-NZ 2.63Å; E207-K209 PolarHBondContact OE2-NZ 3.48Å; K209-T327 CarbonylContact C-O 3.53Å; K209-T327 VanDerWaalsContact CA-O 3.32Å; K209-T327 WeakPolarHBondContact CA-O 3.49Å
210	L	84.2	Confident	68.8	Low	1 Å²	1	72.2 Å²	72.2	1%	0.005	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	105.3	172.4	179.6	64.7	0	0	0	109.8	Y200 L205 I212 I221 L223 I326 T327 V328 D329	Y200-L210 HydrophobicContact CD1-CD1 3.61Å; Y200-L210 HydrophobicContact CD2-CD1 3.96Å; Y200-L210 HydrophobicContact CE1-CD1 3.89Å; Y200-L210 HydrophobicContact CE2-CD1 4.24Å; Y200-L210 HydrophobicContact CG-CD1 3.65Å; L205-L210 HydrophobicContact CD1-CB 4.06Å; L205-L210 HydrophobicContact CD1-CD1 4.18Å; L205-L210 HydrophobicContact CD2-CD1 3.86Å; L210-I212 HydrophobicContact CD2-CD1 4.1Å; L210-I212 HydrophobicContact CD2-CG1 4.46Å; L210-I212 HydrophobicContact CG-CD1 4.28Å; L210-I212 HydrophobicContact CG-CG1 4.1Å; L210-I221 HydrophobicContact CD2-CD1 3.51Å; L210-L223 HydrophobicContact CD2-CD2 4.26Å; L210-I326 HydrophobicContact CB-CD1 4.35Å; L210-T327 PolarHBondContact N-O 2.64Å; L210-V328 HydrophobicContact CD2-CG2 4.44Å; L210-D329 PolarHBondContact O-N 2.8Å
211	I	76.1	Confident	68.7	Low	92 Å²	92	70.4 Å²	70.4	47%	0.472	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	128.7	179.9	-60.9	174.4	0	0	0	110.1	D329 H331	I211-D329 CarbonylContact C-O 3.59Å; I211-D329 WeakPolarHBondContact CA-O 3.13Å; I211-D329 HydrophobicContact CG1-CB 4.47Å; I211-H331 HydrophobicContact CG2-CB 4.43Å
212	I	74.5	Confident	69.4	Low	2 Å²	2	67.1 Å²	67.1	1%	0.01	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	105.8	-170	-72.3	-163.1	0	0	0	109.6	L210 K293 L296 V328 D329 V330 H331	L210-I212 HydrophobicContact CD2-CD1 4.1Å; L210-I212 HydrophobicContact CD2-CG1 4.46Å; L210-I212 HydrophobicContact CG-CD1 4.28Å; L210-I212 HydrophobicContact CG-CG1 4.1Å; I212-K293 HydrophobicContact CD1-CG 4.48Å; I212-K293 HydrophobicContact CG2-CD 4.26Å; I212-K293 VanDerWaalsContact CG2-CE 3.43Å; I212-K293 HydrophobicContact CG2-CG 3.85Å; I212-L296 HydrophobicContact CD1-CB 4.38Å; I212-L296 HydrophobicContact CD1-CD1 3.58Å; I212-V328 HydrophobicContact CB-CG1 4.44Å; I212-V328 HydrophobicContact CD1-CG1 3.62Å; I212-V328 HydrophobicContact CG1-CG1 4.08Å; I212-D329 PolarHBondContact N-O 3.41Å; I212-V330 HydrophobicContact CB-CG2 4.42Å; I212-V330 HydrophobicContact CG2-CG1 4.45Å; I212-V330 HydrophobicContact CG2-CG2 4.28Å; I212-V330 CarbonylContact O-C 3.55Å; I212-V330 WeakPolarHBondContact O-CA 3.16Å; I212-H331 PolarHBondContact O-N 2.82Å
213	S	66.5	Low	70.3	Confident	23 Å²	23	60.9 Å²	60.9	16%	0.161	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	138.4	172	43.7	0	0	0	0	112.9	D216 K293 H331	S213-D216 VanDerWaalsContact O-CB 3.31Å; S213-D216 WeakPolarHBondContact O-CB 3.19Å; S213-D216 WeakPolarHBondContact OG-CB 3.32Å; S213-D216 PolarHBondContact OG-OD1 3.16Å; S213-K293 WeakPolarHBondContact O-CE 3.29Å; S213-K293 PolarHBondContact O-NZ 3.37Å; S213-K293 PolarHBondContact OG-NZ 2.8Å; S213-H331 CarbonylContact C-O 3.55Å; S213-H331 WeakPolarHBondContact CA-O 3.47Å
214	Q	61.4	Low	71.2	Confident	74 Å²	74	59.4 Å²	59.4	35%	0.346	31%	0.309	S	S	.	.	S	Bend	trans	-137.7	135.4	164.9	-65.1	-170.7	7.9	0	0	111	V330 H331 T332 P333	Q214-V330 HydrophobicContact CG-CG1 4.05Å; Q214-H331 PolarHBondContact N-O 2.74Å; Q214-T332 HydrophobicContact CB-CG2 4.39Å; Q214-T332 WeakPolarHBondContact O-CA 3.47Å; Q214-P333 VanDerWaalsContact O-CD 3.29Å; Q214-P333 WeakPolarHBondContact O-CD 3.28Å
215	P	55.8	Low	72.1	Confident	123 Å²	123	54 Å²	54	80%	0.799	28%	0.284	S	S	*	.	S	Bend	cis	-68.6	154.7	-10.7	32.4	-36.1	0	0	0	111.6
216	D	50.8	Low	72.8	Confident	59 Å²	59	53.9 Å²	53.9	32%	0.316	29%	0.285	S	S	.	.			trans	-160.9	139	180	-177.1	83	0	0	0	109.1	S213 I218 K293	S213-D216 VanDerWaalsContact O-CB 3.31Å; S213-D216 WeakPolarHBondContact O-CB 3.19Å; S213-D216 WeakPolarHBondContact OG-CB 3.32Å; S213-D216 PolarHBondContact OG-OD1 3.16Å; D216-I218 PolarHBondContact O-N 2.68Å; D216-I218 VanDerWaalsContact OD2-CB 3.3Å; D216-I218 WeakPolarHBondContact OD2-CB 3.36Å; D216-I218 PolarHBondContact OD2-N 2.73Å; D216-K293 IonicContact OD1-NZ 3.18Å; D216-K293 IonicContact OD2-NZ 2.67Å; D216-K293 PolarHBondContact OD2-NZ 3.08Å
217	P	45.6	Very low	73.9	Confident	82 Å²	82	49.7 Å²	49.7	53%	0.532	26%	0.258	S	S	.	.	S	Bend	trans	-74.3	-4.8	-174.9	29.5	-35.7	0	0	0	114.5	L219	P217-L219 PolarHBondContact O-N 2.71Å
218	I	51.4	Low	74.4	Confident	35 Å²	35	45.5 Å²	45.5	18%	0.179	24%	0.243	C	C	.	.			trans	-82.9	102.6	179.8	-56.6	176.5	0	0	0	110	D216 R220 K293	D216-I218 PolarHBondContact O-N 2.68Å; D216-I218 VanDerWaalsContact OD2-CB 3.3Å; D216-I218 WeakPolarHBondContact OD2-CB 3.36Å; D216-I218 PolarHBondContact OD2-N 2.73Å; I218-R220 VanDerWaalsContact CG2-O 3.26Å; I218-R220 WeakPolarHBondContact CG2-O 3.37Å; I218-K293 WeakPolarHBondContact O-CB 3.33Å; I218-K293 WeakPolarHBondContact O-CD 3.13Å
219	L	60.1	Low	73.9	Confident	62 Å²	62	40 Å²	40	33%	0.325	23%	0.23	S	C	.	.			trans	-82.2	-25.3	-170	-67.8	150.7	0	0	0	113.9	P217 L292 K293 Y1026	P217-L219 PolarHBondContact O-N 2.71Å; L219-L292 WeakPolarHBondContact O-CA 3.32Å; L219-K293 PolarHBondContact O-N 2.78Å; L219-Y1026 HydrophobicContact CB-CE1 4.19Å; L219-Y1026 HydrophobicContact CD1-CD1 3.91Å; L219-Y1026 HydrophobicContact CD1-CE1 3.25Å; L219-Y1026 HydrophobicContact CD2-CE1 4.17Å; L219-Y1026 VanDerWaalsContact CD2-OH 3.24Å; L219-Y1026 WeakPolarHBondContact CD2-OH 3.49Å; L219-Y1026 HydrophobicContact CG-CE1 4Å
220	R	75.7	Confident	73.7	Confident	44 Å²	44	38.1 Å²	38.1	17%	0.166	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	137.6	171	-83.8	-173.8	151.1	174.1	-6.2	111.5	I218 H275 I277 I291 L292	I218-R220 VanDerWaalsContact CG2-O 3.26Å; I218-R220 WeakPolarHBondContact CG2-O 3.37Å; R220-H275 PolarHBondContact NH2-O 3.29Å; R220-I277 VanDerWaalsContact NH1-CD1 3.29Å; R220-I291 VanDerWaalsContact CA-O 3.3Å; R220-I291 WeakPolarHBondContact CA-O 3.17Å; R220-L292 HydrophobicContact CG-CD2 3.91Å; R220-L292 HydrophobicContact CG-CG 4.42Å
221	I	81.1	Confident	73.5	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	161.9	163	62.1	165.4	0	0	0	110.1	Y200 L210 L223 S290 I291 K293 L296	Y200-I221 HydrophobicContact CE2-CB 3.95Å; Y200-I221 HydrophobicContact CE2-CG2 3.95Å; L210-I221 HydrophobicContact CD2-CD1 3.51Å; I221-L223 HydrophobicContact CD1-CD1 4.04Å; I221-L223 HydrophobicContact CD1-CG 4.28Å; I221-S290 VanDerWaalsContact O-CA 3.27Å; I221-S290 WeakPolarHBondContact O-CA 3.4Å; I221-S290 WeakPolarHBondContact O-CB 3.19Å; I221-S290 PolarHBondContact O-OG 2.76Å; I221-I291 HydrophobicContact CD1-CD1 4.06Å; I221-I291 HydrophobicContact CD1-CG1 3.83Å; I221-I291 HydrophobicContact CG1-CD1 4.37Å; I221-I291 HydrophobicContact CG1-CG1 3.58Å; I221-I291 PolarHBondContact N-O 2.72Å; I221-I291 PolarHBondContact O-N 2.7Å; I221-K293 HydrophobicContact CG2-CG 4.41Å; I221-L296 HydrophobicContact CD1-CD1 3.58Å; I221-L296 HydrophobicContact CG1-CD1 4.28Å
222	S	84.6	Confident	73.8	Confident	38 Å²	38	40.8 Å²	40.8	27%	0.266	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	129.6	173.2	166.9	0	0	0	0	107.9	Y200 N288 L289	Y200-S222 WeakPolarHBondContact CD2-O 3.48Å; S222-N288 VanDerWaalsContact OG-CG 3.29Å; S222-N288 PolarHBondContact OG-ND2 3.02Å; S222-N288 VanDerWaalsContact OG-ND2 3.07Å; S222-N288 PolarHBondContact OG-OD1 2.71Å; S222-L289 CarbonylContact C-O 3.6Å; S222-L289 WeakPolarHBondContact CA-O 3.44Å
223	L	90.2	Very high	74.1	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	118.3	-173.9	-66.3	170.8	0	0	0	108.2	I198 L199 Y200 L210 I221 W238 N288 L289 I302 I326	I198-L223 HydrophobicContact CG2-CB 4.17Å; I198-L223 HydrophobicContact CG2-CD2 4.07Å; L199-L223 WeakPolarHBondContact O-CA 3.16Å; Y200-L223 HydrophobicContact CD2-CD2 3.9Å; Y200-L223 HydrophobicContact CG-CD2 4.29Å; L210-L223 HydrophobicContact CD2-CD2 4.26Å; I221-L223 HydrophobicContact CD1-CD1 4.04Å; I221-L223 HydrophobicContact CD1-CG 4.28Å; L223-W238 HydrophobicContact CB-CH2 3.95Å; L223-W238 HydrophobicContact CB-CZ3 4.37Å; L223-W238 WeakPolarHBondContact O-CH2 3.17Å; L223-W238 WeakPolarHBondContact O-CZ2 3.12Å; L223-N288 WeakPolarHBondContact O-CA 2.95Å; L223-L289 PolarHBondContact N-O 2.79Å; L223-L289 PolarHBondContact O-N 2.86Å; L223-I302 HydrophobicContact CD1-CD1 3.73Å; L223-I302 HydrophobicContact CD1-CG2 4.12Å; L223-I326 HydrophobicContact CD1-CD1 4.02Å; L223-I326 HydrophobicContact CD2-CD1 4.13Å
224	V	89.9	Confident	75	Confident	19 Å²	19	41.5 Å²	41.5	12%	0.115	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	120	179.7	-178	0	0	0	0	108.8	I198 L199 Q286 S287 N288	I198-V224 CarbonylContact C-O 3.47Å; I198-V224 WeakPolarHBondContact CA-O 2.98Å; L199-V224 HydrophobicContact CB-CB 4.45Å; L199-V224 PolarHBondContact N-O 3.39Å; L199-V224 PolarHBondContact O-N 3.33Å; V224-Q286 HydrophobicContact CG1-CB 4.42Å; V224-S287 CarbonylContact C-O 3.59Å; V224-N288 HydrophobicContact CG2-CB 4.36Å
225	C	91.4	Very high	76.2	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	115	167.1	-174.7	0	0	0	0	109.4	Q197 I198 F236 W238 Q286 S287 C304	Q197-C225 CarbonylContact O-C 3.37Å; Q197-C225 VanDerWaalsContact O-CA 3.31Å; Q197-C225 WeakPolarHBondContact O-CA 3.04Å; I198-C225 HydrophobicContact CG1-CB 4.49Å; C225-F236 HydrophobicContact CB-CD1 4.37Å; C225-W238 HydrophobicContact CB-CH2 3.64Å; C225-W238 HydrophobicContact CB-CZ2 3.37Å; C225-Q286 WeakPolarHBondContact O-CA 3.48Å; C225-S287 PolarHBondContact N-O 2.67Å; C225-S287 PolarHBondContact O-N 2.68Å; C225-C304 HydrophobicContact CB-CB 3.66Å; C225-C304 WeakPolarHBondContact CB-SG 3.3Å; C225-C304 WeakPolarHBondContact SG-CB 3.06Å; C225-C304 CovalentContact SG-SG 2.02Å; C225-C304 PolarHBondContact SG-SG 2.73Å
226	S	88.8	Confident	77.8	Confident	23 Å²	23	37.2 Å²	37.2	16%	0.161	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	134.3	176.8	-177.1	0	0	0	0	110.1	P196 Q197	P196-S226 WeakPolarHBondContact CA-O 3.13Å; Q197-S226 PolarHBondContact N-O 3.49Å; Q197-S226 PolarHBondContact O-N 2.7Å
227	A	87.7	Confident	79.5	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.008	22%	0.223	C	C	.	.			trans	-144	73.8	176.6	0	0	0	0	0	110.5	P196 P234 F236 E285 V306	P196-A227 HydrophobicContact CB-CB 4.27Å; A227-P234 WeakPolarHBondContact O-CG 3.37Å; A227-F236 HydrophobicContact CB-CE1 3.82Å; A227-F236 HydrophobicContact CB-CZ 3.87Å; A227-E285 PolarHBondContact N-O 3.2Å; A227-V306 HydrophobicContact CB-CB 4.45Å; A227-V306 HydrophobicContact CB-CG1 3.92Å; A227-V306 HydrophobicContact CB-CG2 4.1Å
228	V	84	Confident	81.7	Confident	69 Å²	69	34.4 Å²	34.4	42%	0.418	20%	0.198	S	C	.	.			trans	-60.7	141.4	-176.4	175.8	0	0	0	0	112.5	N194	N194-V228 VanDerWaalsContact CB-O 3.32Å; N194-V228 WeakPolarHBondContact CB-O 3.43Å; N194-V228 VanDerWaalsContact CG-O 3.29Å; N194-V228 PolarHBondContact N-O 2.76Å; N194-V228 VanDerWaalsContact N-O 3.17Å; N194-V228 PolarHBondContact ND2-O 2.77Å
229	G	72.1	Confident	83.5	Confident	24 Å²	24	34.4 Å²	34.4	25%	0.247	20%	0.198	C	C	.	.			trans	82.5	178	174.7	0	0	0	0	0	114.9	P193 E285	P193-G229 VanDerWaalsContact CA-O 3.3Å; P193-G229 WeakPolarHBondContact CA-O 3.01Å; P193-G229 VanDerWaalsContact CB-O 3.24Å; P193-G229 WeakPolarHBondContact CB-O 3.39Å; G229-E285 WeakPolarHBondContact CA-OE1 3.5Å; G229-E285 PolarHBondContact N-OE1 3.21Å
230	G	75.9	Confident	84.8	Confident	28 Å²	28	31.6 Å²	31.6	29%	0.289	18%	0.184	S	C	.	.			trans	115.1	163.2	-173.6	0	0	0	0	0	112	I191 P232	I191-G230 CarbonylContact O-C 3.59Å; I191-G230 VanDerWaalsContact O-CA 3.32Å; I191-G230 WeakPolarHBondContact O-CA 3.04Å; G230-P232 CarbonylContact C-O 3.42Å
231	R	80.2	Confident	85.2	Confident	97 Å²	97	32.9 Å²	32.9	37%	0.366	19%	0.194	S	C	.	.	B	Isolated β-bridge	trans	-154.3	118.1	171.8	-171	171.3	-179.2	156.9	9.7	109.7	E188 V189 L190 I191	E188-R231 IonicContact OE1-NE 3.02Å; V189-R231 WeakPolarHBondContact O-CD 2.93Å; L190-R231 WeakPolarHBondContact CA-O 3.27Å; I191-R231 HydrophobicContact CB-CB 3.96Å; I191-R231 HydrophobicContact CD1-CB 4.25Å; I191-R231 HydrophobicContact CG1-CB 4.09Å; I191-R231 PolarHBondContact N-O 3.49Å; I191-R231 PolarHBondContact O-N 3.49Å
232	P	81.9	Confident	85.1	Confident	52 Å²	52	41.6 Å²	41.6	34%	0.338	23%	0.227	S	C	.	.	S	Bend	cis	-60	175.8	-9.9	29.6	-37.1	0	0	0	112.5	G230 N308 S309	G230-P232 CarbonylContact C-O 3.42Å; P232-N308 PolarHBondContact O-ND2 3.49Å; P232-S309 WeakPolarHBondContact CG-OG 2.92Å
233	A	81.4	Confident	85	Confident	32 Å²	32	45.5 Å²	45.5	26%	0.264	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-57.9	157.3	-178.5	0	0	0	0	0	113.2	E284	A233-E284 HydrophobicContact CB-CB 3.59Å; A233-E284 HydrophobicContact CB-CG 4.48Å; A233-E284 VanDerWaalsContact CB-OE2 3.23Å; A233-E284 WeakPolarHBondContact CB-OE2 3.25Å
234	P	85.8	Confident	84.5	Confident	8 Å²	8	49.9 Å²	49.9	5%	0.052	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-70.9	142.8	178.4	20.1	-22.8	0	0	0	113.7	P193 A227 F236 E284 V306	P193-P234 HydrophobicContact CB-CB 4.17Å; P193-P234 HydrophobicContact CB-CG 4.38Å; P193-P234 HydrophobicContact CG-CB 4.38Å; A227-P234 WeakPolarHBondContact O-CG 3.37Å; P234-F236 HydrophobicContact CB-CE2 4Å; P234-F236 HydrophobicContact CB-CZ 4.18Å; P234-F236 HydrophobicContact CG-CE2 3.98Å; P234-F236 HydrophobicContact CG-CZ 4.05Å; P234-F236 WeakPolarHBondContact O-CE2 3.4Å; P234-E284 WeakPolarHBondContact CD-O 3.1Å; P234-E284 WeakPolarHBondContact CG-O 3.46Å; P234-V306 HydrophobicContact CB-CG1 3.41Å; P234-V306 VanDerWaalsContact CB-CG1 3.41Å
235	T	86.4	Confident	84	Confident	78 Å²	78	49.3 Å²	49.3	48%	0.479	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	134.8	170.4	59	0	0	0	0	109.8	V306 S307	T235-V306 VanDerWaalsContact O-CA 3.29Å; T235-V306 WeakPolarHBondContact O-CA 3.2Å; T235-S307 PolarHBondContact N-O 2.78Å; T235-S307 PolarHBondContact O-N 3.03Å; T235-S307 PolarHBondContact OG1-O 2.83Å; T235-S307 PolarHBondContact OG1-OG 3.36Å; T235-S307 VanDerWaalsContact OG1-OG 3.05Å
236	F	88.7	Confident	82.8	Confident	29 Å²	29	51.2 Å²	51.2	13%	0.127	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	143.5	-173	-64.3	-99.9	0	0	0	112.1	C225 A227 P234 E285 S287 V306	C225-F236 HydrophobicContact CB-CD1 4.37Å; A227-F236 HydrophobicContact CB-CE1 3.82Å; A227-F236 HydrophobicContact CB-CZ 3.87Å; P234-F236 HydrophobicContact CB-CE2 4Å; P234-F236 HydrophobicContact CB-CZ 4.18Å; P234-F236 HydrophobicContact CG-CE2 3.98Å; P234-F236 HydrophobicContact CG-CZ 4.05Å; P234-F236 WeakPolarHBondContact O-CE2 3.4Å; F236-E285 VanDerWaalsContact CZ-C 3.49Å; F236-E285 WeakPolarHBondContact CZ-O 3.25Å; F236-S287 VanDerWaalsContact CG-CB 3.47Å; F236-V306 HydrophobicContact CD1-CG2 3.57Å; F236-V306 HydrophobicContact CE1-CG1 4.45Å; F236-V306 HydrophobicContact CE1-CG2 3.71Å; F236-V306 HydrophobicContact CG-CG2 4.36Å
237	K	87.7	Confident	81.3	Confident	81 Å²	81	53.7 Å²	53.7	35%	0.352	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	137.2	173.6	-78.6	170.2	168	-79.3	0	109	E244 S305	K237-E244 IonicContact NZ-OE1 3.31Å; K237-E244 PolarHBondContact NZ-OE1 2.78Å; K237-E244 IonicContact NZ-OE2 2.68Å; K237-E244 PolarHBondContact NZ-OE2 2.89Å; K237-S305 PolarHBondContact N-O 3.35Å; K237-S305 PolarHBondContact O-N 2.68Å
238	W	90.1	Very high	79.5	Confident	1 Å²	1	57.8 Å²	57.8	0%	0.004	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	143	173.7	-70.4	94.5	0	0	0	110.8	I198 L223 C225 I245 I278 S287 L289 I302 V303 C304	I198-W238 HydrophobicContact CD1-CZ3 3.97Å; I198-W238 HydrophobicContact CG1-CH2 4.15Å; I198-W238 HydrophobicContact CG1-CZ3 4.12Å; L223-W238 HydrophobicContact CB-CH2 3.95Å; L223-W238 HydrophobicContact CB-CZ3 4.37Å; L223-W238 WeakPolarHBondContact O-CH2 3.17Å; L223-W238 WeakPolarHBondContact O-CZ2 3.12Å; C225-W238 HydrophobicContact CB-CH2 3.64Å; C225-W238 HydrophobicContact CB-CZ2 3.37Å; W238-I245 HydrophobicContact CB-CB 4.48Å; W238-I245 HydrophobicContact CB-CD1 3.98Å; W238-I245 HydrophobicContact CB-CG1 4.46Å; W238-I245 PolarHBondContact O-N 2.85Å; W238-I278 HydrophobicContact CB-CD1 4.1Å; W238-I278 HydrophobicContact CG-CD1 4.35Å; W238-S287 PolarHBondContact NE1-OG 3.13Å; W238-L289 HydrophobicContact CB-CD2 4.29Å; W238-L289 HydrophobicContact CD2-CB 3.62Å; W238-L289 HydrophobicContact CD2-CD2 3.83Å; W238-L289 HydrophobicContact CD2-CG 4.28Å; W238-L289 HydrophobicContact CE3-CB 3.94Å; W238-L289 HydrophobicContact CE3-CD2 3.53Å; W238-L289 HydrophobicContact CE3-CG 4.37Å; W238-L289 HydrophobicContact CG-CB 4.08Å; W238-L289 HydrophobicContact CG-CD2 4.19Å; W238-L289 HydrophobicContact CH2-CB 3.97Å; W238-L289 HydrophobicContact CZ2-CB 3.68Å; W238-L289 HydrophobicContact CZ3-CB 4.11Å; W238-L289 HydrophobicContact CZ3-CD2 4.01Å; W238-I302 HydrophobicContact CE3-CG2 4.27Å; W238-I302 HydrophobicContact CZ3-CG2 4.24Å; W238-V303 WeakPolarHBondContact CA-O 3.09Å; W238-C304 HydrophobicContact CD2-CB 4.42Å; W238-C304 HydrophobicContact CE3-CB 4.03Å; W238-C304 HydrophobicContact CH2-CB 4.28Å; W238-C304 HydrophobicContact CZ3-CB 3.96Å
239	L	89.3	Confident	77.6	Confident	35 Å²	35	59.1 Å²	59.1	18%	0.183	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	148.5	173.7	-46.2	88.7	0	0	0	109.7	H243 E244 V303	L239-H243 CarbonylContact C-O 3.47Å; L239-H243 WeakPolarHBondContact CA-O 3.21Å; L239-H243 WeakPolarHBondContact CB-O 3.16Å; L239-E244 HydrophobicContact CD2-CB 4.27Å; L239-E244 HydrophobicContact CG-CB 4.29Å; L239-V303 HydrophobicContact CB-CB 4.14Å; L239-V303 HydrophobicContact CD1-CB 4.08Å; L239-V303 HydrophobicContact CD1-CG1 4.14Å; L239-V303 PolarHBondContact N-O 2.81Å; L239-V303 PolarHBondContact O-N 3.06Å
240	I	87.2	Confident	75.8	Confident	4 Å²	4	61.8 Å²	61.8	2%	0.021	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	134.4	167.7	-64.7	169.1	0	0	0	107.6	R242 H243 I245 W271 L274 I291 E301 I302	I240-R242 PolarHBondContact O-N 2.82Å; I240-R242 VanDerWaalsContact O-N 3.08Å; I240-H243 PolarHBondContact N-O 2.64Å; I240-H243 PolarHBondContact O-N 3.47Å; I240-I245 HydrophobicContact CD1-CD1 3.83Å; I240-I245 HydrophobicContact CG1-CD1 4.04Å; I240-W271 HydrophobicContact CB-CH2 3.97Å; I240-W271 HydrophobicContact CB-CZ3 3.84Å; I240-W271 HydrophobicContact CD1-CZ3 4.25Å; I240-W271 HydrophobicContact CG1-CZ3 4.47Å; I240-W271 HydrophobicContact CG2-CZ3 4.49Å; I240-L274 HydrophobicContact CD1-CD1 4.01Å; I240-L274 HydrophobicContact CG2-CD1 4.38Å; I240-I291 HydrophobicContact CD1-CD1 3.85Å; I240-I291 HydrophobicContact CD1-CG2 4.37Å; I240-E301 CarbonylContact C-O 3.57Å; I240-E301 VanDerWaalsContact CA-O 3.3Å; I240-E301 WeakPolarHBondContact CA-O 3.49Å; I240-I302 HydrophobicContact CG1-CB 4.49Å; I240-I302 HydrophobicContact CG1-CG1 4.23Å; I240-I302 HydrophobicContact CG1-CG2 4.15Å
241	N	83.8	Confident	73.7	Confident	70 Å²	70	68.3 Å²	68.3	37%	0.374	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.7	42.8	-174	-63.5	-24.1	0	0	0	111.8	H243 D300 E301	N241-H243 PolarHBondContact O-N 2.71Å; N241-H243 VanDerWaalsContact O-N 3.15Å; N241-H243 PolarHBondContact O-ND1 2.7Å; N241-D300 PolarHBondContact ND2-OD1 2.74Å; N241-E301 PolarHBondContact N-O 2.96Å; N241-E301 PolarHBondContact OD1-N 2.65Å
242	R	81	Confident	71.2	Confident	185 Å²	185	69.1 Å²	69.1	70%	0.698	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	6.6	180	-51.5	177.4	-175	-139.1	-7.6	116.1	I240 E301	I240-R242 PolarHBondContact O-N 2.82Å; I240-R242 VanDerWaalsContact O-N 3.08Å; R242-E301 WeakPolarHBondContact CG-OE2 3.38Å; R242-E301 IonicContact CZ-OE1 2.66Å; R242-E301 IonicContact CZ-OE2 3.35Å; R242-E301 IonicContact NE-OE1 1.8Å; R242-E301 IonicContact NE-OE2 2.64Å; R242-E301 PolarHBondContact NE-OE2 2.74Å; R242-E301 IonicContact NH2-OE1 2.61Å; R242-E301 PolarHBondContact NH2-OE1 2.77Å; R242-E301 IonicContact NH2-OE2 3.04Å; R242-E301 PolarHBondContact NH2-OE2 3.03Å
243	H	81.6	Confident	68.7	Low	119 Å²	119	76.5 Å²	76.5	55%	0.551	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.5	127.9	172.7	-65.8	74.2	0	0	0	109.9	L239 I240 N241 W271	L239-H243 CarbonylContact C-O 3.47Å; L239-H243 WeakPolarHBondContact CA-O 3.21Å; L239-H243 WeakPolarHBondContact CB-O 3.16Å; I240-H243 PolarHBondContact N-O 2.64Å; I240-H243 PolarHBondContact O-N 3.47Å; N241-H243 PolarHBondContact O-N 2.71Å; N241-H243 VanDerWaalsContact O-N 3.15Å; N241-H243 PolarHBondContact O-ND1 2.7Å; H243-W271 HydrophobicContact CB-CH2 3.92Å; H243-W271 HydrophobicContact CB-CZ2 3.76Å; H243-W271 WeakPolarHBondContact O-CH2 2.9Å; H243-W271 WeakPolarHBondContact O-CZ2 3.34Å
244	E	79.3	Confident	66.5	Low	92 Å²	92	81 Å²	81	43%	0.43	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	131.5	179.7	-170.4	177.7	143.1	0	0	111.3	K237 L239 W271	K237-E244 IonicContact NZ-OE1 3.31Å; K237-E244 PolarHBondContact NZ-OE1 2.78Å; K237-E244 IonicContact NZ-OE2 2.68Å; K237-E244 PolarHBondContact NZ-OE2 2.89Å; L239-E244 HydrophobicContact CD2-CB 4.27Å; L239-E244 HydrophobicContact CG-CB 4.29Å; E244-W271 WeakPolarHBondContact O-CZ2 3.16Å
245	I	79.3	Confident	64.5	Low	7 Å²	7	86.6 Å²	86.6	4%	0.036	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-78.9	120.5	173.2	-56.5	179	0	0	0	108.1	W238 I240 N247 W271 P276 I278 L289	W238-I245 HydrophobicContact CB-CB 4.48Å; W238-I245 HydrophobicContact CB-CD1 3.98Å; W238-I245 HydrophobicContact CB-CG1 4.46Å; W238-I245 PolarHBondContact O-N 2.85Å; I240-I245 HydrophobicContact CD1-CD1 3.83Å; I240-I245 HydrophobicContact CG1-CD1 4.04Å; I245-N247 PolarHBondContact O-N 3.42Å; I245-W271 HydrophobicContact CG1-CH2 3.85Å; I245-W271 HydrophobicContact CG1-CZ2 3.98Å; I245-W271 HydrophobicContact CG1-CZ3 4.15Å; I245-P276 HydrophobicContact CD1-CB 4.08Å; I245-P276 HydrophobicContact CG2-CB 3.76Å; I245-P276 HydrophobicContact CG2-CG 3.65Å; I245-I278 HydrophobicContact CB-CD1 4.04Å; I245-I278 HydrophobicContact CG2-CD1 3.73Å; I245-I278 HydrophobicContact CG2-CG1 4.47Å; I245-L289 HydrophobicContact CD1-CD1 3.69Å; I245-L289 HydrophobicContact CD1-CD2 4.01Å
246	P	66.1	Low	62.6	Low	40 Å²	40	88.2 Å²	88.2	26%	0.26	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-70.2	123.3	179.3	29.1	-34.7	0	0	0	111	L248 L267	P246-L248 PolarHBondContact O-N 3.21Å; P246-L248 VanDerWaalsContact O-N 3.11Å; P246-L267 HydrophobicContact CB-CD1 4.49Å; P246-L267 HydrophobicContact CG-CD1 4.27Å; P246-L267 HydrophobicContact CG-CD2 4.33Å
247	N	57.7	Low	61.2	Low	75 Å²	75	89.1 Å²	89.1	40%	0.401	45%	0.452	S	S	.	.			trans	-74.1	99.5	172.6	-174.1	22.6	0	0	0	110.4	I245 E249	I245-N247 PolarHBondContact O-N 3.42Å; N247-E249 VanDerWaalsContact C-N 3.29Å; N247-E249 PolarHBondContact ND2-OE1 3.29Å; N247-E249 PolarHBondContact O-N 2.91Å; N247-E249 VanDerWaalsContact O-N 3.1Å
248	L	50.8	Low	59.6	Low	88 Å²	88	90.5 Å²	90.5	46%	0.461	47%	0.47	S	S	.	.			trans	-85.8	58.7	-175.2	-76.1	160.8	0	0	0	112.5	P246 V250 I1032	P246-L248 PolarHBondContact O-N 3.21Å; P246-L248 VanDerWaalsContact O-N 3.11Å; L248-V250 PolarHBondContact O-N 3.37Å; L248-I1032 HydrophobicContact CD1-CD1 3.72Å; L248-I1032 HydrophobicContact CD1-CG1 4.19Å
249	E	43.6	Very low	57.9	Low	97 Å²	97	96.6 Å²	96.6	45%	0.453	50%	0.502	S	S	.	.			trans	-71.6	94.1	169.9	-81.3	-177.5	-136.7	0	0	111.4	N247 K251	N247-E249 VanDerWaalsContact C-N 3.29Å; N247-E249 PolarHBondContact ND2-OE1 3.29Å; N247-E249 PolarHBondContact O-N 2.91Å; N247-E249 VanDerWaalsContact O-N 3.1Å; E249-K251 VanDerWaalsContact C-N 3.27Å; E249-K251 PolarHBondContact O-N 2.99Å; E249-K251 VanDerWaalsContact OE2-CE 3.27Å; E249-K251 WeakPolarHBondContact OE2-CE 3.46Å; E249-K251 IonicContact OE2-NZ 3.98Å; E249-K251 PolarHBondContact OE2-NZ 2.68Å
250	V	33.5	Very low	56.1	Low	80 Å²	80	97.9 Å²	97.9	49%	0.485	51%	0.51	S	S	.	.			trans	-75.1	75.3	178	-172.5	0	0	0	0	111.4	L248 T252	L248-V250 PolarHBondContact O-N 3.37Å; V250-T252 VanDerWaalsContact C-N 3.3Å; V250-T252 PolarHBondContact O-N 2.62Å
251	K	32.6	Very low	54.6	Low	165 Å²	165	100.6 Å²	100.6	72%	0.717	53%	0.526	S	S	*	.			trans	-81.5	69.6	175.4	-81	170	170.8	157.9	0	112.7	E249	E249-K251 VanDerWaalsContact C-N 3.27Å; E249-K251 PolarHBondContact O-N 2.99Å; E249-K251 VanDerWaalsContact OE2-CE 3.27Å; E249-K251 WeakPolarHBondContact OE2-CE 3.46Å; E249-K251 IonicContact OE2-NZ 3.98Å; E249-K251 PolarHBondContact OE2-NZ 2.68Å
252	T	27	Very low	53.2	Low	114 Å²	114	99.9 Å²	99.9	70%	0.699	53%	0.53	S	S	*	.	S	Bend	trans	47.4	124.3	151.9	57.6	0	0	0	0	121.3	V250	V250-T252 VanDerWaalsContact C-N 3.3Å; V250-T252 PolarHBondContact O-N 2.62Å
253	K	29.8	Very low	51.9	Low	207 Å²	207	97.8 Å²	97.8	90%	0.9	53%	0.526	S	S	*	.	S	Bend	trans	77.1	37.4	149.6	-64.2	-175.6	176.1	-179.1	0	120
254	T	36.2	Very low	50.2	Low	125 Å²	125	94.4 Å²	94.4	77%	0.767	51%	0.511	S	S	*	.			trans	-138.9	143.2	156.5	26.8	0	0	0	0	111.8
255	P	43.5	Very low	48.9	Very low	127 Å²	127	94.5 Å²	94.5	83%	0.825	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-73.6	132.3	176.2	29.8	-33.4	0	0	0	111.4
256	M	46.8	Very low	47.6	Very low	111 Å²	111	99.7 Å²	99.7	55%	0.547	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-70.3	154.4	177.1	-67.5	172.9	65.2	0	0	112.3	D260 M264	M256-D260 HydrophobicContact CB-CB 4.46Å; M256-D260 HydrophobicContact CE-CB 3.7Å; M256-M264 HydrophobicContact CE-SD 4.32Å
257	S	57.7	Low	47	Very low	48 Å²	48	101 Å²	101	34%	0.336	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-78.5	157.2	175.9	90.1	0	0	0	0	112	N259 D260 V261	S257-N259 PolarHBondContact O-N 2.7Å; S257-N259 VanDerWaalsContact O-N 3.15Å; S257-N259 PolarHBondContact OG-N 3.5Å; S257-D260 VanDerWaalsContact CB-OD2 3.26Å; S257-D260 WeakPolarHBondContact CB-OD2 3.21Å; S257-D260 PolarHBondContact N-OD2 2.94Å; S257-D260 PolarHBondContact O-N 2.89Å; S257-D260 PolarHBondContact OG-OD2 2.94Å; S257-V261 PolarHBondContact O-N 3.28Å
258	P	55.3	Low	46.6	Very low	111 Å²	111	101.2 Å²	101.2	72%	0.721	55%	0.547	S	S	*	.	H	α-helix	trans	-56.5	-30.4	176.8	-26.9	35.7	0	0	0	114.3	D260 A262	P258-D260 VanDerWaalsContact C-N 3.34Å; P258-A262 PolarHBondContact O-N 3.25Å; P258-A262 VanDerWaalsContact O-N 3.13Å
259	N	53.3	Low	46.7	Very low	128 Å²	128	105.8 Å²	105.8	68%	0.684	56%	0.563	S	S	*	*	H	α-helix	trans	-69.8	-31.1	177.4	-74.2	-23.3	0	0	0	112.5	S257 K263	S257-N259 PolarHBondContact O-N 2.7Å; S257-N259 VanDerWaalsContact O-N 3.15Å; S257-N259 PolarHBondContact OG-N 3.5Å; N259-K263 PolarHBondContact O-N 3.27Å; N259-K263 VanDerWaalsContact O-N 3.14Å
260	D	52.5	Low	47.3	Very low	63 Å²	63	105.2 Å²	105.2	34%	0.337	57%	0.567	S	S	.	*	H	α-helix	trans	-77.6	-36.5	179.9	-54.1	-55.8	0	0	0	110.8	M256 S257 P258 A262 K263 M264	M256-D260 HydrophobicContact CB-CB 4.46Å; M256-D260 HydrophobicContact CE-CB 3.7Å; S257-D260 VanDerWaalsContact CB-OD2 3.26Å; S257-D260 WeakPolarHBondContact CB-OD2 3.21Å; S257-D260 PolarHBondContact N-OD2 2.94Å; S257-D260 PolarHBondContact O-N 2.89Å; S257-D260 PolarHBondContact OG-OD2 2.94Å; P258-D260 VanDerWaalsContact C-N 3.34Å; D260-A262 VanDerWaalsContact C-N 3.33Å; D260-A262 PolarHBondContact O-N 2.57Å; D260-K263 WeakPolarHBondContact O-CB 3.45Å; D260-K263 PolarHBondContact O-N 3.19Å; D260-M264 WeakPolarHBondContact O-CB 3.37Å; D260-M264 PolarHBondContact O-N 2.96Å
261	V	55.1	Low	48.8	Very low	61 Å²	61	102.4 Å²	102.4	37%	0.37	55%	0.547	S	S	.	.	H	α-helix	trans	-61.5	-41.4	170.5	-179.2	0	0	0	0	111.1	S257 M264 N265	S257-V261 PolarHBondContact O-N 3.28Å; V261-M264 PolarHBondContact O-N 3.09Å; V261-N265 PolarHBondContact O-N 3.45Å
262	A	54.5	Low	49.8	Very low	55 Å²	55	95.9 Å²	95.9	46%	0.455	53%	0.527	S	S	.	.	H	α-helix	trans	-63.6	-40.2	175.9	0	0	0	0	0	112.8	P258 D260 N266	P258-A262 PolarHBondContact O-N 3.25Å; P258-A262 VanDerWaalsContact O-N 3.13Å; D260-A262 VanDerWaalsContact C-N 3.33Å; D260-A262 PolarHBondContact O-N 2.57Å; A262-N266 PolarHBondContact O-N 3.04Å
263	K	53.3	Low	51.6	Low	141 Å²	141	96.5 Å²	96.5	61%	0.613	52%	0.52	S	S	*	.	H	α-helix	trans	-60.7	-47.4	170	-80.6	177.8	175.8	172.1	0	111.7	N259 D260 N265 N266 L267	N259-K263 PolarHBondContact O-N 3.27Å; N259-K263 VanDerWaalsContact O-N 3.14Å; D260-K263 WeakPolarHBondContact O-CB 3.45Å; D260-K263 PolarHBondContact O-N 3.19Å; K263-N265 PolarHBondContact O-N 2.78Å; K263-N266 PolarHBondContact O-N 2.83Å; K263-L267 WeakPolarHBondContact O-CG 3.48Å; K263-L267 PolarHBondContact O-N 2.79Å
264	M	45.7	Very low	53.5	Low	48 Å²	48	87.3 Å²	87.3	24%	0.236	48%	0.481	C	S	.	.	H	α-helix	trans	-62.3	-40.8	-175.6	-163.9	169.3	74.6	0	0	112.2	M256 D260 V261 N266 L267 L268 I1032	M256-M264 HydrophobicContact CE-SD 4.32Å; D260-M264 WeakPolarHBondContact O-CB 3.37Å; D260-M264 PolarHBondContact O-N 2.96Å; V261-M264 PolarHBondContact O-N 3.09Å; M264-N266 PolarHBondContact O-N 3.1Å; M264-L267 PolarHBondContact O-N 3.13Å; M264-L268 HydrophobicContact CG-CD1 4.42Å; M264-L268 PolarHBondContact O-N 2.82Å; M264-I1032 HydrophobicContact SD-CG2 4.42Å
265	N	52.4	Low	55.1	Low	94 Å²	94	85.2 Å²	85.2	50%	0.503	46%	0.462	S	S	.	.	H	α-helix	trans	-65	-34.8	176.4	-77.1	-24.9	0	0	0	113.5	V261 K263 K269	V261-N265 PolarHBondContact O-N 3.45Å; K263-N265 PolarHBondContact O-N 2.78Å; N265-K269 PolarHBondContact O-N 2.87Å
266	N	53.3	Low	56.6	Low	115 Å²	115	80.8 Å²	80.8	62%	0.615	43%	0.433	S	S	*	.	H	α-helix	trans	-72.5	-37.6	173.3	-85.6	-19.3	0	0	0	112.1	A262 K263 M264 K269	A262-N266 PolarHBondContact O-N 3.04Å; K263-N266 PolarHBondContact O-N 2.83Å; M264-N266 PolarHBondContact O-N 3.1Å; N266-K269 WeakPolarHBondContact O-CB 3.17Å; N266-K269 PolarHBondContact O-N 3.27Å
267	L	51.8	Low	58	Low	68 Å²	68	78 Å²	78	36%	0.356	42%	0.42	S	S	.	.	H	α-helix	trans	-64.1	-41.4	175.5	-72.9	162.5	0	0	0	112.1	P246 K263 M264 K269 V270 W271	P246-L267 HydrophobicContact CB-CD1 4.49Å; P246-L267 HydrophobicContact CG-CD1 4.27Å; P246-L267 HydrophobicContact CG-CD2 4.33Å; K263-L267 WeakPolarHBondContact O-CG 3.48Å; K263-L267 PolarHBondContact O-N 2.79Å; M264-L267 PolarHBondContact O-N 3.13Å; L267-K269 PolarHBondContact O-N 3.41Å; L267-V270 PolarHBondContact O-N 2.75Å; L267-V270 VanDerWaalsContact O-N 3.1Å; L267-W271 VanDerWaalsContact O-CD1 3.28Å; L267-W271 PolarHBondContact O-N 2.97Å
268	L	50.4	Low	59.1	Low	79 Å²	79	76.8 Å²	76.8	41%	0.414	41%	0.409	S	S	.	.	H	α-helix	trans	-58.2	-33.7	175.2	-89.2	158.8	0	0	0	113.1	M264 V270 G272 I1032	M264-L268 HydrophobicContact CG-CD1 4.42Å; M264-L268 PolarHBondContact O-N 2.82Å; L268-V270 VanDerWaalsContact C-N 3.34Å; L268-G272 WeakPolarHBondContact O-CA 3.47Å; L268-G272 PolarHBondContact O-N 2.66Å; L268-G272 VanDerWaalsContact O-N 3.08Å; L268-I1032 HydrophobicContact CD1-CD1 4.5Å; L268-I1032 HydrophobicContact CD2-CD1 4.11Å; L268-I1032 HydrophobicContact CG-CD1 4.41Å
269	K	52.9	Low	60.1	Low	184 Å²	184	76.3 Å²	76.3	80%	0.8	40%	0.401	S	S	*	.	H	α-helix	trans	-68	-29.7	176.1	-110.1	-177.7	178.4	-179.4	0	114	N265 N266 L267	N265-K269 PolarHBondContact O-N 2.87Å; N266-K269 WeakPolarHBondContact O-CB 3.17Å; N266-K269 PolarHBondContact O-N 3.27Å; L267-K269 PolarHBondContact O-N 3.41Å
270	V	55.8	Low	61.1	Low	86 Å²	86	73.6 Å²	73.6	52%	0.521	39%	0.386	S	S	.	.	H	α-helix	trans	-84.6	-43.6	179	179.8	0	0	0	0	110.6	L267 L268	L267-V270 PolarHBondContact O-N 2.75Å; L267-V270 VanDerWaalsContact O-N 3.1Å; L268-V270 VanDerWaalsContact C-N 3.34Å
271	W	64.1	Low	61.7	Low	21 Å²	21	74.6 Å²	74.6	8%	0.08	39%	0.389	C	S	.	.	H	α-helix	trans	-91.2	-6.4	-171.6	-62.1	119.9	0	0	0	115.3	I240 H243 E244 I245 L267 K273 L274 H275 P276	I240-W271 HydrophobicContact CB-CH2 3.97Å; I240-W271 HydrophobicContact CB-CZ3 3.84Å; I240-W271 HydrophobicContact CD1-CZ3 4.25Å; I240-W271 HydrophobicContact CG1-CZ3 4.47Å; I240-W271 HydrophobicContact CG2-CZ3 4.49Å; H243-W271 HydrophobicContact CB-CH2 3.92Å; H243-W271 HydrophobicContact CB-CZ2 3.76Å; H243-W271 WeakPolarHBondContact O-CH2 2.9Å; H243-W271 WeakPolarHBondContact O-CZ2 3.34Å; E244-W271 WeakPolarHBondContact O-CZ2 3.16Å; I245-W271 HydrophobicContact CG1-CH2 3.85Å; I245-W271 HydrophobicContact CG1-CZ2 3.98Å; I245-W271 HydrophobicContact CG1-CZ3 4.15Å; L267-W271 VanDerWaalsContact O-CD1 3.28Å; L267-W271 PolarHBondContact O-N 2.97Å; W271-K273 VanDerWaalsContact C-N 3.28Å; W271-K273 PolarHBondContact O-N 3.35Å; W271-K273 VanDerWaalsContact O-N 3.16Å; W271-L274 HydrophobicContact CE3-CD1 4.04Å; W271-L274 HydrophobicContact CZ3-CD1 4.03Å; W271-L274 PolarHBondContact O-N 2.72Å; W271-H275 PolarHBondContact O-N 2.72Å; W271-H275 VanDerWaalsContact O-N 3.14Å; W271-P276 HydrophobicContact CB-CG 4.35Å
272	G	54.3	Low	61.7	Low	28 Å²	28	81.3 Å²	81.3	29%	0.289	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-12.4	-172	0	0	0	0	0	117.4	L268 H275	L268-G272 WeakPolarHBondContact O-CA 3.47Å; L268-G272 PolarHBondContact O-N 2.66Å; L268-G272 VanDerWaalsContact O-N 3.08Å; G272-H275 PolarHBondContact O-CE1 3.5Å; G272-H275 PolarHBondContact O-ND1 2.82Å
273	K	65.7	Low	61.9	Low	127 Å²	127	84.3 Å²	84.3	55%	0.552	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-32.6	167.8	-84.3	-175.3	172.8	177.4	0	112.8	W271 G295 E297	W271-K273 VanDerWaalsContact C-N 3.28Å; W271-K273 PolarHBondContact O-N 3.35Å; W271-K273 VanDerWaalsContact O-N 3.16Å; K273-G295 WeakPolarHBondContact O-CA 3.42Å; K273-E297 IonicContact NZ-OE1 2.87Å; K273-E297 PolarHBondContact NZ-OE1 2.89Å
274	L	68.1	Low	62.5	Low	14 Å²	14	83.6 Å²	83.6	7%	0.073	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-27.6	-163.8	-74.1	162.7	0	0	0	113.2	I240 W271 I291 L292 G295 L296	I240-L274 HydrophobicContact CD1-CD1 4.01Å; I240-L274 HydrophobicContact CG2-CD1 4.38Å; W271-L274 HydrophobicContact CE3-CD1 4.04Å; W271-L274 HydrophobicContact CZ3-CD1 4.03Å; W271-L274 PolarHBondContact O-N 2.72Å; L274-I291 HydrophobicContact CB-CG2 4.35Å; L274-I291 HydrophobicContact CD2-CB 4.4Å; L274-I291 HydrophobicContact CD2-CD1 4.46Å; L274-I291 WeakPolarHBondContact O-CA 3.09Å; L274-L292 PolarHBondContact O-N 2.88Å; L274-G295 VanDerWaalsContact CD2-O 3.31Å; L274-G295 WeakPolarHBondContact CD2-O 3.27Å; L274-L296 HydrophobicContact CD2-CD2 3.65Å; L274-L296 HydrophobicContact CD2-CG 3.82Å
275	H	70.6	Confident	64.2	Low	81 Å²	81	84.5 Å²	84.5	38%	0.375	43%	0.427	S	S	.	.			trans	41	63.2	-174.3	-68.7	89	0	0	0	113.1	R220 W271 G272 L292 Q1031	R220-H275 PolarHBondContact NH2-O 3.29Å; W271-H275 PolarHBondContact O-N 2.72Å; W271-H275 VanDerWaalsContact O-N 3.14Å; G272-H275 PolarHBondContact O-CE1 3.5Å; G272-H275 PolarHBondContact O-ND1 2.82Å; H275-L292 HydrophobicContact CB-CD1 3.89Å; H275-L292 HydrophobicContact CB-CG 4.36Å; H275-L292 VanDerWaalsContact ND1-CD1 3.35Å; H275-L292 WeakPolarHBondContact ND1-CD1 2.97Å; H275-Q1031 PolarHBondContact NE2-NE2 3.32Å
276	P	74.7	Confident	65.8	Low	34 Å²	34	82.4 Å²	82.4	22%	0.221	41%	0.414	C	S	.	.			trans	-67.7	140.8	-177.5	28.1	-34.6	0	0	0	113.1	I245 W271 L289 S290 I291	I245-P276 HydrophobicContact CD1-CB 4.08Å; I245-P276 HydrophobicContact CG2-CB 3.76Å; I245-P276 HydrophobicContact CG2-CG 3.65Å; W271-P276 HydrophobicContact CB-CG 4.35Å; P276-L289 HydrophobicContact CB-CD1 3.95Å; P276-S290 CarbonylContact C-O 3.59Å; P276-S290 WeakPolarHBondContact CA-O 3.16Å; P276-I291 HydrophobicContact CB-CG2 3.7Å
277	I	77.1	Confident	67.4	Low	51 Å²	51	77 Å²	77	26%	0.262	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	135.8	166.2	-63.4	-176.8	0	0	0	107.8	R220 N279 L289 S290	R220-I277 VanDerWaalsContact NH1-CD1 3.29Å; I277-N279 WeakPolarHBondContact CG2-OD1 3.2Å; I277-L289 CarbonylContact O-C 3.59Å; I277-L289 WeakPolarHBondContact O-CA 3.25Å; I277-S290 PolarHBondContact N-O 2.87Å; I277-S290 PolarHBondContact O-N 3.4Å
278	I	81.2	Confident	69.1	Low	24 Å²	24	76.1 Å²	76.1	12%	0.123	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	120.9	176	-61.3	168.4	0	0	0	108.2	W238 I245 N288 L289	W238-I278 HydrophobicContact CB-CD1 4.1Å; W238-I278 HydrophobicContact CG-CD1 4.35Å; I245-I278 HydrophobicContact CB-CD1 4.04Å; I245-I278 HydrophobicContact CG2-CD1 3.73Å; I245-I278 HydrophobicContact CG2-CG1 4.47Å; I278-N288 WeakPolarHBondContact CA-O 3.33Å; I278-L289 HydrophobicContact CG1-CD1 3.98Å
279	N	76.4	Confident	71	Confident	100 Å²	100	72.3 Å²	72.3	54%	0.535	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	126.2	174.5	-65.9	-5.8	0	0	0	109.1	I277 S287 N288	I277-N279 WeakPolarHBondContact CG2-OD1 3.2Å; N279-S287 CarbonylContact O-C 3.55Å; N279-S287 WeakPolarHBondContact O-CA 2.74Å; N279-N288 PolarHBondContact N-O 2.84Å; N279-N288 PolarHBondContact O-N 2.73Å
280	N	72.6	Confident	72.5	Confident	71 Å²	71	64.6 Å²	64.6	38%	0.38	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	141.4	172.2	-56.4	-41	0	0	0	109.4	S287	N280-S287 WeakPolarHBondContact OD1-CB 2.62Å; N280-S287 PolarHBondContact OD1-OG 3.17Å
281	E	65.5	Low	73.9	Confident	85 Å²	85	60.5 Å²	60.5	40%	0.397	31%	0.306	S	S	.	.			trans	-76	152.7	179	-70.5	-169.2	165.6	0	0	112.5	N283 E284 Q286	E281-N283 PolarHBondContact O-N 3.23Å; E281-E284 PolarHBondContact O-N 3.47Å; E281-Q286 HydrophobicContact CB-CB 4.38Å; E281-Q286 VanDerWaalsContact CD-NE2 3.31Å; E281-Q286 HydrophobicContact CG-CB 4.02Å; E281-Q286 PolarHBondContact N-O 2.77Å; E281-Q286 PolarHBondContact OE1-NE2 3.05Å; E281-Q286 PolarHBondContact OE2-NE2 2.74Å
282	E	55.5	Low	74.5	Confident	201 Å²	201	60.6 Å²	60.6	94%	0.939	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-19.6	177	-60.4	-172.5	148.8	0	0	113.8	E284	E282-E284 VanDerWaalsContact C-N 3.33Å
283	N	57.8	Low	75.4	Confident	119 Å²	119	59.8 Å²	59.8	64%	0.636	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-7.8	178.2	-57.6	-48.6	0	0	0	113.8	E281 E285	E281-N283 PolarHBondContact O-N 3.23Å; N283-E285 PolarHBondContact O-N 2.99Å
284	E	67	Low	75.5	Confident	125 Å²	125	58.3 Å²	58.3	58%	0.584	31%	0.307	S	S	*	.	S	Bend	trans	56.2	11	-174.6	-57.9	-169.4	147	0	0	116.1	A233 P234 E281 E282	A233-E284 HydrophobicContact CB-CB 3.59Å; A233-E284 HydrophobicContact CB-CG 4.48Å; A233-E284 VanDerWaalsContact CB-OE2 3.23Å; A233-E284 WeakPolarHBondContact CB-OE2 3.25Å; P234-E284 WeakPolarHBondContact CD-O 3.1Å; P234-E284 WeakPolarHBondContact CG-O 3.46Å; E281-E284 PolarHBondContact O-N 3.47Å; E282-E284 VanDerWaalsContact C-N 3.33Å
285	E	80.9	Confident	75.7	Confident	68 Å²	68	58 Å²	58	32%	0.318	31%	0.307	S	S	.	.	S	Bend	trans	-101.5	-4.4	177.6	-65.2	-162.2	142.7	0	0	114.8	A227 G229 F236 N283	A227-E285 PolarHBondContact N-O 3.2Å; G229-E285 WeakPolarHBondContact CA-OE1 3.5Å; G229-E285 PolarHBondContact N-OE1 3.21Å; F236-E285 VanDerWaalsContact CZ-C 3.49Å; F236-E285 WeakPolarHBondContact CZ-O 3.25Å; N283-E285 PolarHBondContact O-N 2.99Å
286	Q	86.2	Confident	76.1	Confident	50 Å²	50	54.3 Å²	54.3	23%	0.234	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	149.7	-178	-55.7	-163.8	89.4	0	0	113.5	V224 C225 E281	V224-Q286 HydrophobicContact CG1-CB 4.42Å; C225-Q286 WeakPolarHBondContact O-CA 3.48Å; E281-Q286 HydrophobicContact CB-CB 4.38Å; E281-Q286 VanDerWaalsContact CD-NE2 3.31Å; E281-Q286 HydrophobicContact CG-CB 4.02Å; E281-Q286 PolarHBondContact N-O 2.77Å; E281-Q286 PolarHBondContact OE1-NE2 3.05Å; E281-Q286 PolarHBondContact OE2-NE2 2.74Å
287	S	87.2	Confident	76.3	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.007	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	137.6	174.6	-175.9	0	0	0	0	110.8	V224 C225 F236 W238 N279 N280	V224-S287 CarbonylContact C-O 3.59Å; C225-S287 PolarHBondContact N-O 2.67Å; C225-S287 PolarHBondContact O-N 2.68Å; F236-S287 VanDerWaalsContact CG-CB 3.47Å; W238-S287 PolarHBondContact NE1-OG 3.13Å; N279-S287 CarbonylContact O-C 3.55Å; N279-S287 WeakPolarHBondContact O-CA 2.74Å; N280-S287 WeakPolarHBondContact OD1-CB 2.62Å; N280-S287 PolarHBondContact OD1-OG 3.17Å
288	N	87.6	Confident	76.3	Confident	49 Å²	49	59.7 Å²	59.7	26%	0.262	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	121	-177.6	-176.3	-16.7	0	0	0	110.5	S222 L223 V224 I278 N279	S222-N288 VanDerWaalsContact OG-CG 3.29Å; S222-N288 PolarHBondContact OG-ND2 3.02Å; S222-N288 VanDerWaalsContact OG-ND2 3.07Å; S222-N288 PolarHBondContact OG-OD1 2.71Å; L223-N288 WeakPolarHBondContact O-CA 2.95Å; V224-N288 HydrophobicContact CG2-CB 4.36Å; I278-N288 WeakPolarHBondContact CA-O 3.33Å; N279-N288 PolarHBondContact N-O 2.84Å; N279-N288 PolarHBondContact O-N 2.73Å
289	L	89.1	Confident	76.3	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	124.8	171.2	172.5	66.6	0	0	0	110.1	S222 L223 W238 I245 P276 I277 I278 I291 I302	S222-L289 CarbonylContact C-O 3.6Å; S222-L289 WeakPolarHBondContact CA-O 3.44Å; L223-L289 PolarHBondContact N-O 2.79Å; L223-L289 PolarHBondContact O-N 2.86Å; W238-L289 HydrophobicContact CB-CD2 4.29Å; W238-L289 HydrophobicContact CD2-CB 3.62Å; W238-L289 HydrophobicContact CD2-CD2 3.83Å; W238-L289 HydrophobicContact CD2-CG 4.28Å; W238-L289 HydrophobicContact CE3-CB 3.94Å; W238-L289 HydrophobicContact CE3-CD2 3.53Å; W238-L289 HydrophobicContact CE3-CG 4.37Å; W238-L289 HydrophobicContact CG-CB 4.08Å; W238-L289 HydrophobicContact CG-CD2 4.19Å; W238-L289 HydrophobicContact CH2-CB 3.97Å; W238-L289 HydrophobicContact CZ2-CB 3.68Å; W238-L289 HydrophobicContact CZ3-CB 4.11Å; W238-L289 HydrophobicContact CZ3-CD2 4.01Å; I245-L289 HydrophobicContact CD1-CD1 3.69Å; I245-L289 HydrophobicContact CD1-CD2 4.01Å; P276-L289 HydrophobicContact CB-CD1 3.95Å; I277-L289 CarbonylContact O-C 3.59Å; I277-L289 WeakPolarHBondContact O-CA 3.25Å; I278-L289 HydrophobicContact CG1-CD1 3.98Å; L289-I291 HydrophobicContact CD1-CG2 3.96Å; L289-I291 HydrophobicContact CD2-CD1 4.46Å; L289-I291 HydrophobicContact CG-CG2 4.24Å; L289-I302 HydrophobicContact CD2-CG2 4.02Å
290	S	85.4	Confident	76.9	Confident	22 Å²	22	56.8 Å²	56.8	15%	0.154	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	130.4	169.3	-170.9	0	0	0	0	112.1	I221 P276 I277	I221-S290 VanDerWaalsContact O-CA 3.27Å; I221-S290 WeakPolarHBondContact O-CA 3.4Å; I221-S290 WeakPolarHBondContact O-CB 3.19Å; I221-S290 PolarHBondContact O-OG 2.76Å; P276-S290 CarbonylContact C-O 3.59Å; P276-S290 WeakPolarHBondContact CA-O 3.16Å; I277-S290 PolarHBondContact N-O 2.87Å; I277-S290 PolarHBondContact O-N 3.4Å
291	I	85	Confident	77.6	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	153.2	-175.8	51	-175.4	0	0	0	111.1	R220 I221 I240 L274 P276 L289 L296 I302	R220-I291 VanDerWaalsContact CA-O 3.3Å; R220-I291 WeakPolarHBondContact CA-O 3.17Å; I221-I291 HydrophobicContact CD1-CD1 4.06Å; I221-I291 HydrophobicContact CD1-CG1 3.83Å; I221-I291 HydrophobicContact CG1-CD1 4.37Å; I221-I291 HydrophobicContact CG1-CG1 3.58Å; I221-I291 PolarHBondContact N-O 2.72Å; I221-I291 PolarHBondContact O-N 2.7Å; I240-I291 HydrophobicContact CD1-CD1 3.85Å; I240-I291 HydrophobicContact CD1-CG2 4.37Å; L274-I291 HydrophobicContact CB-CG2 4.35Å; L274-I291 HydrophobicContact CD2-CB 4.4Å; L274-I291 HydrophobicContact CD2-CD1 4.46Å; L274-I291 WeakPolarHBondContact O-CA 3.09Å; P276-I291 HydrophobicContact CB-CG2 3.7Å; L289-I291 HydrophobicContact CD1-CG2 3.96Å; L289-I291 HydrophobicContact CD2-CD1 4.46Å; L289-I291 HydrophobicContact CG-CG2 4.24Å; I291-L296 HydrophobicContact CD1-CD1 4.07Å; I291-L296 HydrophobicContact CD1-CD2 3.93Å; I291-L296 HydrophobicContact CD1-CG 4.34Å; I291-L296 HydrophobicContact CG1-CD1 4.39Å; I291-I302 HydrophobicContact CD1-CD1 3.94Å
292	L	76.7	Confident	78.9	Confident	23 Å²	23	51.8 Å²	51.8	12%	0.12	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	128	178.7	-73.5	168.7	0	0	0	111.7	L219 R220 L274 H275 A294 G295 Y1026	L219-L292 WeakPolarHBondContact O-CA 3.32Å; R220-L292 HydrophobicContact CG-CD2 3.91Å; R220-L292 HydrophobicContact CG-CG 4.42Å; L274-L292 PolarHBondContact O-N 2.88Å; H275-L292 HydrophobicContact CB-CD1 3.89Å; H275-L292 HydrophobicContact CB-CG 4.36Å; H275-L292 VanDerWaalsContact ND1-CD1 3.35Å; H275-L292 WeakPolarHBondContact ND1-CD1 2.97Å; L292-A294 VanDerWaalsContact C-N 3.27Å; L292-A294 PolarHBondContact O-N 2.99Å; L292-G295 PolarHBondContact O-N 3.06Å; L292-G295 VanDerWaalsContact O-N 3.11Å; L292-Y1026 HydrophobicContact CD2-CE2 4.29Å
293	K	74.3	Confident	80.6	Confident	11 Å²	11	42.9 Å²	42.9	5%	0.048	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-63.9	-33.2	-179.9	-166.7	-178	-173.7	-168.4	0	112.4	I212 S213 D216 I218 L219 I221 G295	I212-K293 HydrophobicContact CD1-CG 4.48Å; I212-K293 HydrophobicContact CG2-CD 4.26Å; I212-K293 VanDerWaalsContact CG2-CE 3.43Å; I212-K293 HydrophobicContact CG2-CG 3.85Å; S213-K293 WeakPolarHBondContact O-CE 3.29Å; S213-K293 PolarHBondContact O-NZ 3.37Å; S213-K293 PolarHBondContact OG-NZ 2.8Å; D216-K293 IonicContact OD1-NZ 3.18Å; D216-K293 IonicContact OD2-NZ 2.67Å; D216-K293 PolarHBondContact OD2-NZ 3.08Å; I218-K293 WeakPolarHBondContact O-CB 3.33Å; I218-K293 WeakPolarHBondContact O-CD 3.13Å; L219-K293 PolarHBondContact O-N 2.78Å; I221-K293 HydrophobicContact CG2-CG 4.41Å; K293-G295 VanDerWaalsContact C-N 3.27Å; K293-G295 PolarHBondContact O-N 3.23Å
294	A	67.5	Low	82.2	Confident	95 Å²	95	37.2 Å²	37.2	79%	0.785	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-76.3	-9.9	177.4	0	0	0	0	0	114.2	L292	L292-A294 VanDerWaalsContact C-N 3.27Å; L292-A294 PolarHBondContact O-N 2.99Å
295	G	72.1	Confident	83.3	Confident	7 Å²	7	31.9 Å²	31.9	7%	0.072	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-92.2	-5.1	177.4	0	0	0	0	0	114.5	K273 L274 L292 K293	K273-G295 WeakPolarHBondContact O-CA 3.42Å; L274-G295 VanDerWaalsContact CD2-O 3.31Å; L274-G295 WeakPolarHBondContact CD2-O 3.27Å; L292-G295 PolarHBondContact O-N 3.06Å; L292-G295 VanDerWaalsContact O-N 3.11Å; K293-G295 VanDerWaalsContact C-N 3.27Å; K293-G295 PolarHBondContact O-N 3.23Å
296	L	78	Confident	83.8	Confident	5 Å²	5	28.6 Å²	28.6	3%	0.026	18%	0.175	C	C	.	.			trans	-96.9	138.5	-177.7	-71.2	167.8	0	0	0	111.4	I212 I221 L274 I291 D300 I302 V328	I212-L296 HydrophobicContact CD1-CB 4.38Å; I212-L296 HydrophobicContact CD1-CD1 3.58Å; I221-L296 HydrophobicContact CD1-CD1 3.58Å; I221-L296 HydrophobicContact CG1-CD1 4.28Å; L274-L296 HydrophobicContact CD2-CD2 3.65Å; L274-L296 HydrophobicContact CD2-CG 3.82Å; I291-L296 HydrophobicContact CD1-CD1 4.07Å; I291-L296 HydrophobicContact CD1-CD2 3.93Å; I291-L296 HydrophobicContact CD1-CG 4.34Å; I291-L296 HydrophobicContact CG1-CD1 4.39Å; L296-D300 WeakPolarHBondContact CA-OD2 3.35Å; L296-D300 HydrophobicContact CD2-CB 4.33Å; L296-D300 WeakPolarHBondContact CD2-OD2 2.95Å; L296-I302 HydrophobicContact CD2-CD1 4.27Å; L296-V328 HydrophobicContact CB-CG1 4.41Å; L296-V328 HydrophobicContact CD1-CG2 4.49Å; L296-V328 HydrophobicContact CD2-CG2 4.3Å
297	E	80	Confident	83.9	Confident	105 Å²	105	26.6 Å²	26.6	49%	0.491	17%	0.166	S	C	.	.			trans	-114.2	161.9	-178.3	-69.6	175.5	-155.1	0	0	111.5	K273 G299 D300	K273-E297 IonicContact NZ-OE1 2.87Å; K273-E297 PolarHBondContact NZ-OE1 2.89Å; E297-G299 PolarHBondContact O-N 2.93Å; E297-G299 VanDerWaalsContact O-N 3.14Å; E297-D300 PolarHBondContact N-OD2 3.4Å; E297-D300 PolarHBondContact O-N 2.82Å
298	D	77.5	Confident	83.9	Confident	93 Å²	93	26.8 Å²	26.8	50%	0.497	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	109.4	-173.7	-155.5	45.4	0	0	0	110	V330 K365	D298-V330 HydrophobicContact CB-CB 4.48Å; D298-V330 HydrophobicContact CB-CG2 4.33Å; D298-V330 PolarHBondContact OD1-N 2.83Å; D298-K365 IonicContact OD1-NZ 2.86Å; D298-K365 PolarHBondContact OD1-NZ 3.39Å; D298-K365 WeakPolarHBondContact OD2-CE 3.49Å; D298-K365 IonicContact OD2-NZ 2.59Å; D298-K365 PolarHBondContact OD2-NZ 2.76Å
299	G	81.1	Confident	83.8	Confident	46 Å²	46	27.1 Å²	27.1	47%	0.474	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	103.9	2.9	-176.7	0	0	0	0	0	117.2	E297 E301 V328	E297-G299 PolarHBondContact O-N 2.93Å; E297-G299 VanDerWaalsContact O-N 3.14Å; G299-E301 PolarHBondContact O-N 2.85Å; G299-V328 WeakPolarHBondContact CA-O 3.34Å; G299-V328 PolarHBondContact N-O 2.8Å
300	D	87.4	Confident	83.7	Confident	17 Å²	17	28 Å²	28	9%	0.091	18%	0.181	C	C	.	.			trans	-55	129.4	178.8	-83.8	-27.7	0	0	0	113.2	N241 L296 E297 T327 V328	N241-D300 PolarHBondContact ND2-OD1 2.74Å; L296-D300 WeakPolarHBondContact CA-OD2 3.35Å; L296-D300 HydrophobicContact CD2-CB 4.33Å; L296-D300 WeakPolarHBondContact CD2-OD2 2.95Å; E297-D300 PolarHBondContact N-OD2 3.4Å; E297-D300 PolarHBondContact O-N 2.82Å; D300-T327 CarbonylContact O-C 3.58Å; D300-T327 WeakPolarHBondContact O-CA 3.06Å; D300-V328 HydrophobicContact CB-CB 4.13Å; D300-V328 HydrophobicContact CB-CG2 4Å; D300-V328 PolarHBondContact O-N 3.41Å
301	E	89	Confident	83.8	Confident	51 Å²	51	27.3 Å²	27.3	24%	0.238	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	109.2	173.1	-73.9	-170.9	147.7	0	0	110.5	I240 N241 R242 G299 T325	I240-E301 CarbonylContact C-O 3.57Å; I240-E301 VanDerWaalsContact CA-O 3.3Å; I240-E301 WeakPolarHBondContact CA-O 3.49Å; N241-E301 PolarHBondContact N-O 2.96Å; N241-E301 PolarHBondContact OD1-N 2.65Å; R242-E301 WeakPolarHBondContact CG-OE2 3.38Å; R242-E301 IonicContact CZ-OE1 2.66Å; R242-E301 IonicContact CZ-OE2 3.35Å; R242-E301 IonicContact NE-OE1 1.8Å; R242-E301 IonicContact NE-OE2 2.64Å; R242-E301 PolarHBondContact NE-OE2 2.74Å; R242-E301 IonicContact NH2-OE1 2.61Å; R242-E301 PolarHBondContact NH2-OE1 2.77Å; R242-E301 IonicContact NH2-OE2 3.04Å; R242-E301 PolarHBondContact NH2-OE2 3.03Å; G299-E301 PolarHBondContact O-N 2.85Å; E301-T325 HydrophobicContact CB-CG2 4.08Å; E301-T325 HydrophobicContact CG-CG2 4.22Å
302	I	91	Very high	83.7	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	128	171.5	-48.6	176.9	0	0	0	109.2	L223 W238 I240 L289 I291 L296 T325 I326 V328	L223-I302 HydrophobicContact CD1-CD1 3.73Å; L223-I302 HydrophobicContact CD1-CG2 4.12Å; W238-I302 HydrophobicContact CE3-CG2 4.27Å; W238-I302 HydrophobicContact CZ3-CG2 4.24Å; I240-I302 HydrophobicContact CG1-CB 4.49Å; I240-I302 HydrophobicContact CG1-CG1 4.23Å; I240-I302 HydrophobicContact CG1-CG2 4.15Å; L289-I302 HydrophobicContact CD2-CG2 4.02Å; I291-I302 HydrophobicContact CD1-CD1 3.94Å; L296-I302 HydrophobicContact CD2-CD1 4.27Å; I302-T325 CarbonylContact O-C 3.54Å; I302-T325 WeakPolarHBondContact O-CA 3.45Å; I302-I326 HydrophobicContact CB-CD1 4.26Å; I302-I326 HydrophobicContact CB-CG1 3.79Å; I302-I326 HydrophobicContact CD1-CD1 4.4Å; I302-I326 PolarHBondContact N-O 3.49Å; I302-I326 PolarHBondContact O-N 3.18Å; I302-V328 HydrophobicContact CD1-CG2 3.99Å; I302-V328 HydrophobicContact CG1-CG2 4.38Å
303	V	91.2	Very high	84	Confident	14 Å²	14	35.6 Å²	35.6	9%	0.085	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	130	-173.8	-167.2	0	0	0	0	111	W238 L239 I324 T325	W238-V303 WeakPolarHBondContact CA-O 3.09Å; L239-V303 HydrophobicContact CB-CB 4.14Å; L239-V303 HydrophobicContact CD1-CB 4.08Å; L239-V303 HydrophobicContact CD1-CG1 4.14Å; L239-V303 PolarHBondContact N-O 2.81Å; L239-V303 PolarHBondContact O-N 3.06Å; V303-I324 WeakPolarHBondContact CA-O 3.37Å; V303-T325 HydrophobicContact CG2-CG2 4.01Å
304	C	91.8	Very high	84.2	Confident	0 Å²	0	38 Å²	38	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	140.4	160.2	179.4	0	0	0	0	109.7	I198 C225 W238 S323 I324	I198-C304 HydrophobicContact CD1-CB 3.91Å; I198-C304 HydrophobicContact CG1-CB 3.94Å; C225-C304 HydrophobicContact CB-CB 3.66Å; C225-C304 WeakPolarHBondContact CB-SG 3.3Å; C225-C304 WeakPolarHBondContact SG-CB 3.06Å; C225-C304 CovalentContact SG-SG 2.02Å; C225-C304 PolarHBondContact SG-SG 2.73Å; W238-C304 HydrophobicContact CD2-CB 4.42Å; W238-C304 HydrophobicContact CE3-CB 4.03Å; W238-C304 HydrophobicContact CH2-CB 4.28Å; W238-C304 HydrophobicContact CZ3-CB 3.96Å; C304-S323 CarbonylContact O-C 3.51Å; C304-S323 WeakPolarHBondContact O-CA 3.37Å; C304-S323 VanDerWaalsContact O-CB 3.29Å; C304-S323 WeakPolarHBondContact O-CB 3.23Å; C304-I324 HydrophobicContact CB-CG2 4.08Å; C304-I324 PolarHBondContact N-O 2.95Å; C304-I324 PolarHBondContact O-N 2.95Å
305	S	90.3	Very high	84.7	Confident	12 Å²	12	41.8 Å²	41.8	8%	0.084	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	130.9	-177.8	-177.9	0	0	0	0	109.7	K237 L322	K237-S305 PolarHBondContact N-O 3.35Å; K237-S305 PolarHBondContact O-N 2.68Å; S305-L322 CarbonylContact C-O 3.51Å; S305-L322 WeakPolarHBondContact CA-O 3.46Å
306	V	90.6	Very high	84.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	134.9	-168.7	-177.6	0	0	0	0	111.2	P193 P196 A227 P234 T235 F236 N321 L322	P193-V306 HydrophobicContact CG-CG1 4.3Å; P196-V306 HydrophobicContact CB-CG2 3.82Å; P196-V306 HydrophobicContact CG-CG2 4.2Å; A227-V306 HydrophobicContact CB-CB 4.45Å; A227-V306 HydrophobicContact CB-CG1 3.92Å; A227-V306 HydrophobicContact CB-CG2 4.1Å; P234-V306 HydrophobicContact CB-CG1 3.41Å; P234-V306 VanDerWaalsContact CB-CG1 3.41Å; T235-V306 VanDerWaalsContact O-CA 3.29Å; T235-V306 WeakPolarHBondContact O-CA 3.2Å; F236-V306 HydrophobicContact CD1-CG2 3.57Å; F236-V306 HydrophobicContact CE1-CG1 4.45Å; F236-V306 HydrophobicContact CE1-CG2 3.71Å; F236-V306 HydrophobicContact CG-CG2 4.36Å; V306-N321 CarbonylContact O-C 3.53Å; V306-N321 WeakPolarHBondContact O-CA 3.38Å; V306-L322 PolarHBondContact N-O 2.9Å; V306-L322 PolarHBondContact O-N 2.8Å
307	S	89.1	Confident	84.6	Confident	8 Å²	8	48 Å²	48	6%	0.056	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	157	178.4	86.3	0	0	0	0	112.9	T235 T311 Q312 R320 N321	T235-S307 PolarHBondContact N-O 2.78Å; T235-S307 PolarHBondContact O-N 3.03Å; T235-S307 PolarHBondContact OG1-O 2.83Å; T235-S307 PolarHBondContact OG1-OG 3.36Å; T235-S307 VanDerWaalsContact OG1-OG 3.05Å; S307-T311 WeakPolarHBondContact CA-OG1 3.5Å; S307-Q312 PolarHBondContact OG-NE2 2.85Å; S307-R320 WeakPolarHBondContact CB-O 3.41Å; S307-N321 WeakPolarHBondContact CB-OD1 3.24Å
308	N	87.7	Confident	84	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.021	28%	0.283	C	S	.	.			trans	-146.3	-179.5	164.2	78.5	-10.2	0	0	0	110.7	I191 P232 A310 T311 Q312	I191-N308 PolarHBondContact O-ND2 2.92Å; P232-N308 PolarHBondContact O-ND2 3.49Å; N308-A310 PolarHBondContact O-N 3.44Å; N308-A310 VanDerWaalsContact O-N 3.13Å; N308-A310 WeakPolarHBondContact OD1-CA 3.09Å; N308-A310 WeakPolarHBondContact OD1-CB 3.43Å; N308-A310 PolarHBondContact OD1-N 3.05Å; N308-T311 PolarHBondContact N-OG1 2.89Å; N308-T311 PolarHBondContact O-N 3.19Å; N308-T311 PolarHBondContact O-OG1 3.12Å; N308-T311 VanDerWaalsContact O-OG1 3.05Å; N308-T311 PolarHBondContact OD1-N 2.87Å; N308-T311 VanDerWaalsContact OD1-N 3.07Å; N308-Q312 WeakPolarHBondContact O-CG 3.43Å; N308-Q312 PolarHBondContact O-N 3.47Å
309	S	86	Confident	83.8	Confident	56 Å²	56	52.3 Å²	52.3	39%	0.392	28%	0.284	S	S	.	.	H	α-helix	trans	-57.8	-28.7	-179.9	-46.7	0	0	0	0	113.6	P232 I313	P232-S309 WeakPolarHBondContact CG-OG 2.92Å; S309-I313 VanDerWaalsContact O-CD1 3.3Å; S309-I313 WeakPolarHBondContact O-CD1 3.21Å; S309-I313 VanDerWaalsContact O-CG1 3.3Å; S309-I313 WeakPolarHBondContact O-CG1 3.39Å
310	A	86.1	Confident	83.9	Confident	19 Å²	19	55 Å²	55	16%	0.157	28%	0.28	C	S	.	.	H	α-helix	trans	-74.2	-33.6	176.4	0	0	0	0	0	112.9	L190 I191 K192 N308	L190-A310 HydrophobicContact CB-CB 3.99Å; I191-A310 WeakPolarHBondContact O-CB 3.32Å; K192-A310 HydrophobicContact CB-CB 4.45Å; N308-A310 PolarHBondContact O-N 3.44Å; N308-A310 VanDerWaalsContact O-N 3.13Å; N308-A310 WeakPolarHBondContact OD1-CA 3.09Å; N308-A310 WeakPolarHBondContact OD1-CB 3.43Å; N308-A310 PolarHBondContact OD1-N 3.05Å
311	T	86.5	Confident	83.8	Confident	8 Å²	8	57.5 Å²	57.5	5%	0.049	29%	0.293	C	S	.	.	H	α-helix	trans	-78.7	-36.2	175	66	0	0	0	0	112	K192 P193 S307 N308 I313 N314 R320	K192-T311 HydrophobicContact CB-CG2 4.01Å; P193-T311 HydrophobicContact CG-CG2 4.44Å; S307-T311 WeakPolarHBondContact CA-OG1 3.5Å; N308-T311 PolarHBondContact N-OG1 2.89Å; N308-T311 PolarHBondContact O-N 3.19Å; N308-T311 PolarHBondContact O-OG1 3.12Å; N308-T311 VanDerWaalsContact O-OG1 3.05Å; N308-T311 PolarHBondContact OD1-N 2.87Å; N308-T311 VanDerWaalsContact OD1-N 3.07Å; T311-I313 VanDerWaalsContact C-N 3.25Å; T311-I313 PolarHBondContact O-N 2.88Å; T311-N314 WeakPolarHBondContact O-CB 3.49Å; T311-N314 PolarHBondContact O-N 3.14Å; T311-R320 WeakPolarHBondContact CB-O 3.45Å; T311-R320 WeakPolarHBondContact O-CA 3.11Å; T311-R320 PolarHBondContact OG1-O 2.82Å
312	Q	84.5	Confident	83.7	Confident	111 Å²	111	57 Å²	57	52%	0.519	29%	0.292	S	S	.	.	H	α-helix	trans	-65.3	-24.9	-179.1	-70.5	-175	22.4	0	0	113.9	S307 N308 N314	S307-Q312 PolarHBondContact OG-NE2 2.85Å; N308-Q312 WeakPolarHBondContact O-CG 3.43Å; N308-Q312 PolarHBondContact O-N 3.47Å; Q312-N314 PolarHBondContact O-N 3.39Å
313	I	82	Confident	83.6	Confident	86 Å²	86	60.7 Å²	60.7	44%	0.441	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-15.7	173.4	-71.6	165	0	0	0	112.4	P101 L190 S309 T311 H315	P101-I313 HydrophobicContact CG-CD1 3.77Å; P101-I313 HydrophobicContact CG-CG2 4.23Å; L190-I313 HydrophobicContact CD1-CD1 3.64Å; S309-I313 VanDerWaalsContact O-CD1 3.3Å; S309-I313 WeakPolarHBondContact O-CD1 3.21Å; S309-I313 VanDerWaalsContact O-CG1 3.3Å; S309-I313 WeakPolarHBondContact O-CG1 3.39Å; T311-I313 VanDerWaalsContact C-N 3.25Å; T311-I313 PolarHBondContact O-N 2.88Å; I313-H315 PolarHBondContact O-N 2.91Å
314	N	79.3	Confident	83.5	Confident	61 Å²	61	60.8 Å²	60.8	33%	0.326	32%	0.317	S	S	.	.			trans	-64.8	132.3	-178.5	-158	-30.5	0	0	0	112.5	T311 Q312 D316 K319 R320	T311-N314 WeakPolarHBondContact O-CB 3.49Å; T311-N314 PolarHBondContact O-N 3.14Å; Q312-N314 PolarHBondContact O-N 3.39Å; N314-D316 VanDerWaalsContact C-N 3.28Å; N314-D316 PolarHBondContact O-N 3.42Å; N314-D316 PolarHBondContact OD1-N 3.48Å; N314-D316 VanDerWaalsContact OD1-N 3.09Å; N314-K319 WeakPolarHBondContact ND2-CB 3.17Å; N314-R320 HydrophobicContact CB-CG 4.37Å; N314-R320 PolarHBondContact O-NE 2.8Å; N314-R320 PolarHBondContact O-NH2 3.46Å; N314-R320 VanDerWaalsContact O-NH2 3.17Å
315	H	76.6	Confident	83.3	Confident	175 Å²	175	62.9 Å²	62.9	81%	0.81	33%	0.331	S	S	*	.	S	Bend	trans	-65.5	-32.1	175.3	-67.1	-64.8	0	0	0	112.5	I313 P317	I313-H315 PolarHBondContact O-N 2.91Å; H315-P317 WeakPolarHBondContact O-CD 3.34Å
316	D	76.4	Confident	83.3	Confident	50 Å²	50	62.5 Å²	62.5	27%	0.267	33%	0.328	S	S	.	.	S	Bend	trans	-78.4	114.8	178.1	-179.7	-10.3	0	0	0	110.8	N314 M318 K319 R320	N314-D316 VanDerWaalsContact C-N 3.28Å; N314-D316 PolarHBondContact O-N 3.42Å; N314-D316 PolarHBondContact OD1-N 3.48Å; N314-D316 VanDerWaalsContact OD1-N 3.09Å; D316-M318 VanDerWaalsContact C-N 3.25Å; D316-M318 PolarHBondContact O-N 2.75Å; D316-M318 WeakPolarHBondContact OD1-CB 3.41Å; D316-M318 PolarHBondContact OD1-N 3.27Å; D316-K319 HydrophobicContact CB-CB 4.18Å; D316-K319 HydrophobicContact CB-CD 4.36Å; D316-K319 HydrophobicContact CB-CG 4.25Å; D316-K319 PolarHBondContact O-N 3.33Å; D316-K319 WeakPolarHBondContact OD2-CG 3.43Å; D316-K319 IonicContact OD2-NZ 2.7Å; D316-K319 PolarHBondContact OD2-NZ 2.84Å; D316-R320 PolarHBondContact O-N 2.87Å
317	P	73.3	Confident	83.2	Confident	93 Å²	93	65.2 Å²	65.2	60%	0.604	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-64.4	-27.1	-178.9	27.8	-34.9	0	0	0	113.2	H315 K319 R320	H315-P317 WeakPolarHBondContact O-CD 3.34Å; P317-K319 PolarHBondContact O-N 2.76Å; P317-R320 PolarHBondContact O-N 2.67Å
318	M	66.8	Low	83	Confident	170 Å²	170	65 Å²	65	84%	0.837	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-73.3	-11.6	175	-68.1	-172.4	168.1	0	0	113	D316	D316-M318 VanDerWaalsContact C-N 3.25Å; D316-M318 PolarHBondContact O-N 2.75Å; D316-M318 WeakPolarHBondContact OD1-CB 3.41Å; D316-M318 PolarHBondContact OD1-N 3.27Å
319	K	73.1	Confident	82.7	Confident	118 Å²	118	67.1 Å²	67.1	51%	0.513	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-111.6	7.6	178.1	-63.1	-173.7	-178.9	84.2	0	113.9	N314 D316 P317	N314-K319 WeakPolarHBondContact ND2-CB 3.17Å; D316-K319 HydrophobicContact CB-CB 4.18Å; D316-K319 HydrophobicContact CB-CD 4.36Å; D316-K319 HydrophobicContact CB-CG 4.25Å; D316-K319 PolarHBondContact O-N 3.33Å; D316-K319 WeakPolarHBondContact OD2-CG 3.43Å; D316-K319 IonicContact OD2-NZ 2.7Å; D316-K319 PolarHBondContact OD2-NZ 2.84Å; P317-K319 PolarHBondContact O-N 2.76Å
320	R	84.1	Confident	82.3	Confident	103 Å²	103	65.3 Å²	65.3	39%	0.389	34%	0.34	S	S	.	.	S	Bend	trans	-77	-30.7	172.1	-69.7	-177.9	-176.4	166.2	5	112.8	S307 T311 N314 D316 P317	S307-R320 WeakPolarHBondContact CB-O 3.41Å; T311-R320 WeakPolarHBondContact CB-O 3.45Å; T311-R320 WeakPolarHBondContact O-CA 3.11Å; T311-R320 PolarHBondContact OG1-O 2.82Å; N314-R320 HydrophobicContact CB-CG 4.37Å; N314-R320 PolarHBondContact O-NE 2.8Å; N314-R320 PolarHBondContact O-NH2 3.46Å; N314-R320 VanDerWaalsContact O-NH2 3.17Å; D316-R320 PolarHBondContact O-N 2.87Å; P317-R320 PolarHBondContact O-N 2.67Å
321	N	84.6	Confident	81.9	Confident	68 Å²	68	65 Å²	65	36%	0.364	34%	0.336	S	S	.	.	S	Bend	trans	-120.4	130	175.7	-55.5	-16.2	0	0	0	108	V306 S307	V306-N321 CarbonylContact O-C 3.53Å; V306-N321 WeakPolarHBondContact O-CA 3.38Å; S307-N321 WeakPolarHBondContact CB-OD1 3.24Å
322	L	87.4	Confident	81.2	Confident	41 Å²	41	67.1 Å²	67.1	22%	0.215	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	131.7	169	-54.4	-179.7	0	0	0	107.8	P193 N194 P196 S305 V306	P193-L322 HydrophobicContact CG-CD1 4.13Å; N194-L322 WeakPolarHBondContact O-CD1 3.5Å; P196-L322 HydrophobicContact CG-CB 4.3Å; S305-L322 CarbonylContact C-O 3.51Å; S305-L322 WeakPolarHBondContact CA-O 3.46Å; V306-L322 PolarHBondContact N-O 2.9Å; V306-L322 PolarHBondContact O-N 2.8Å
323	S	87.8	Confident	80.5	Confident	78 Å²	78	63.3 Å²	63.3	55%	0.545	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	152.8	-176.8	60.6	0	0	0	0	114.3	C304	C304-S323 CarbonylContact O-C 3.51Å; C304-S323 WeakPolarHBondContact O-CA 3.37Å; C304-S323 VanDerWaalsContact O-CB 3.29Å; C304-S323 WeakPolarHBondContact O-CB 3.23Å
324	I	88.9	Confident	80.1	Confident	15 Å²	15	59.6 Å²	59.6	8%	0.077	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	132.7	175.9	-176.6	169.9	0	0	0	109.5	P196 I198 V303 C304	P196-I324 HydrophobicContact CB-CG2 4.01Å; P196-I324 HydrophobicContact CG-CB 4.4Å; P196-I324 HydrophobicContact CG-CG2 3.96Å; P196-I324 WeakPolarHBondContact O-CD1 3.27Å; P196-I324 WeakPolarHBondContact O-CG2 3.4Å; I198-I324 HydrophobicContact CD1-CG2 3.86Å; I198-I324 HydrophobicContact CG1-CG2 3.8Å; V303-I324 WeakPolarHBondContact CA-O 3.37Å; C304-I324 HydrophobicContact CB-CG2 4.08Å; C304-I324 PolarHBondContact N-O 2.95Å; C304-I324 PolarHBondContact O-N 2.95Å
325	T	88.8	Confident	79.9	Confident	45 Å²	45	57.1 Å²	57.1	28%	0.276	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	141.8	177.7	-52.7	0	0	0	0	110.3	R208 E301 I302 V303	R208-T325 WeakPolarHBondContact CD-O 3.39Å; E301-T325 HydrophobicContact CB-CG2 4.08Å; E301-T325 HydrophobicContact CG-CG2 4.22Å; I302-T325 CarbonylContact O-C 3.54Å; I302-T325 WeakPolarHBondContact O-CA 3.45Å; V303-T325 HydrophobicContact CG2-CG2 4.01Å
326	I	90.7	Very high	80	Confident	4 Å²	4	52.4 Å²	52.4	2%	0.021	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	157.2	165.1	64.1	167.5	0	0	0	110	I198 L205 R208 L210 L223 I302	I198-I326 HydrophobicContact CB-CG2 4.28Å; I198-I326 HydrophobicContact CD1-CG1 4.34Å; I198-I326 HydrophobicContact CD1-CG2 4.17Å; I198-I326 HydrophobicContact CG2-CD1 4.01Å; I198-I326 HydrophobicContact CG2-CG2 4.45Å; L205-I326 HydrophobicContact CD1-CB 4.39Å; L205-I326 HydrophobicContact CD1-CD1 3.54Å; L205-I326 HydrophobicContact CD1-CG2 4.12Å; R208-I326 HydrophobicContact CB-CG2 4.13Å; R208-I326 CarbonylContact O-C 3.58Å; R208-I326 WeakPolarHBondContact O-CA 3.47Å; R208-I326 VanDerWaalsContact O-CB 3.24Å; R208-I326 WeakPolarHBondContact O-CB 3.42Å; L210-I326 HydrophobicContact CB-CD1 4.35Å; L223-I326 HydrophobicContact CD1-CD1 4.02Å; L223-I326 HydrophobicContact CD2-CD1 4.13Å; I302-I326 HydrophobicContact CB-CD1 4.26Å; I302-I326 HydrophobicContact CB-CG1 3.79Å; I302-I326 HydrophobicContact CD1-CD1 4.4Å; I302-I326 PolarHBondContact N-O 3.49Å; I302-I326 PolarHBondContact O-N 3.18Å
327	T	86.9	Confident	80.5	Confident	56 Å²	56	50.6 Å²	50.6	34%	0.344	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	140.2	178.5	55.4	0	0	0	0	111.8	R208 K209 L210 D300	R208-T327 PolarHBondContact O-N 3.27Å; K209-T327 CarbonylContact C-O 3.53Å; K209-T327 VanDerWaalsContact CA-O 3.32Å; K209-T327 WeakPolarHBondContact CA-O 3.49Å; L210-T327 PolarHBondContact N-O 2.64Å; D300-T327 CarbonylContact O-C 3.58Å; D300-T327 WeakPolarHBondContact O-CA 3.06Å
328	V	85.6	Confident	81	Confident	5 Å²	5	52.8 Å²	52.8	3%	0.03	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	142.8	178.1	178.5	0	0	0	0	112.2	L210 I212 L296 G299 D300 I302 V330	L210-V328 HydrophobicContact CD2-CG2 4.44Å; I212-V328 HydrophobicContact CB-CG1 4.44Å; I212-V328 HydrophobicContact CD1-CG1 3.62Å; I212-V328 HydrophobicContact CG1-CG1 4.08Å; L296-V328 HydrophobicContact CB-CG1 4.41Å; L296-V328 HydrophobicContact CD1-CG2 4.49Å; L296-V328 HydrophobicContact CD2-CG2 4.3Å; G299-V328 WeakPolarHBondContact CA-O 3.34Å; G299-V328 PolarHBondContact N-O 2.8Å; D300-V328 HydrophobicContact CB-CB 4.13Å; D300-V328 HydrophobicContact CB-CG2 4Å; D300-V328 PolarHBondContact O-N 3.41Å; I302-V328 HydrophobicContact CD1-CG2 3.99Å; I302-V328 HydrophobicContact CG1-CG2 4.38Å; V328-V330 HydrophobicContact CG1-CG2 4.07Å
329	D	81.6	Confident	81.7	Confident	48 Å²	48	46.2 Å²	46.2	26%	0.257	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	119.5	178.5	-167.8	-26.1	0	0	0	109.7	L210 I211 I212 H331	L210-D329 PolarHBondContact O-N 2.8Å; I211-D329 CarbonylContact C-O 3.59Å; I211-D329 WeakPolarHBondContact CA-O 3.13Å; I211-D329 HydrophobicContact CG1-CB 4.47Å; I212-D329 PolarHBondContact N-O 3.41Å; D329-H331 IonicContact OD1-CD2 3.34Å; D329-H331 PolarHBondContact OD1-CD2 3.03Å; D329-H331 IonicContact OD1-NE2 2.78Å
330	V	77.9	Confident	81.9	Confident	17 Å²	17	44.4 Å²	44.4	10%	0.103	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	115.5	-169.1	-174.3	0	0	0	0	111.9	I212 Q214 D298 V328 K365	I212-V330 HydrophobicContact CB-CG2 4.42Å; I212-V330 HydrophobicContact CG2-CG1 4.45Å; I212-V330 HydrophobicContact CG2-CG2 4.28Å; I212-V330 CarbonylContact O-C 3.55Å; I212-V330 WeakPolarHBondContact O-CA 3.16Å; Q214-V330 HydrophobicContact CG-CG1 4.05Å; D298-V330 HydrophobicContact CB-CB 4.48Å; D298-V330 HydrophobicContact CB-CG2 4.33Å; D298-V330 PolarHBondContact OD1-N 2.83Å; V328-V330 HydrophobicContact CG1-CG2 4.07Å; V330-K365 PolarHBondContact O-NZ 2.83Å
331	H	76.5	Confident	80.9	Confident	14 Å²	14	41.1 Å²	41.1	7%	0.065	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	138.7	-174.7	-79.8	-149.3	0	0	0	112.8	I211 I212 S213 Q214 D329 K365 V484	I211-H331 HydrophobicContact CG2-CB 4.43Å; I212-H331 PolarHBondContact O-N 2.82Å; S213-H331 CarbonylContact C-O 3.55Å; S213-H331 WeakPolarHBondContact CA-O 3.47Å; Q214-H331 PolarHBondContact N-O 2.74Å; D329-H331 IonicContact OD1-CD2 3.34Å; D329-H331 PolarHBondContact OD1-CD2 3.03Å; D329-H331 IonicContact OD1-NE2 2.78Å; H331-K365 CarbonylContact C-O 3.53Å; H331-K365 WeakPolarHBondContact CA-O 3.44Å; H331-V484 HydrophobicContact CB-CG1 3.74Å
332	T	73.7	Confident	79.6	Confident	52 Å²	52	42.3 Å²	42.3	32%	0.319	25%	0.25	S	S	.	.	B	Isolated β-bridge	trans	-129.4	135.2	174.3	65.2	0	0	0	0	112.1	Q214 G364 K365 H482	Q214-T332 HydrophobicContact CB-CG2 4.39Å; Q214-T332 WeakPolarHBondContact O-CA 3.47Å; T332-G364 CarbonylContact O-C 3.6Å; T332-G364 WeakPolarHBondContact O-CA 3.45Å; T332-K365 PolarHBondContact N-O 3.23Å; T332-K365 PolarHBondContact O-N 2.74Å; T332-K365 PolarHBondContact OG1-N 3.05Å; T332-H482 PolarHBondContact O-CE1 3.05Å; T332-H482 PolarHBondContact O-NE2 3.08Å
333	P	69	Low	78.3	Confident	31 Å²	31	43.8 Å²	43.8	20%	0.201	26%	0.256	C	S	.	.			trans	-80.7	161	-174.1	31.4	-34.9	0	0	0	114.9	Q214 S486	Q214-P333 VanDerWaalsContact O-CD 3.29Å; Q214-P333 WeakPolarHBondContact O-CD 3.28Å; P333-S486 WeakPolarHBondContact CB-OG 3.4Å
334	P	73.3	Confident	76.8	Confident	7 Å²	7	45.3 Å²	45.3	5%	0.045	27%	0.267	C	S	.	.			trans	-75.4	158.8	175.1	-10.9	26.8	0	0	0	113.5	P362 P363 L458 H482	P334-P362 CarbonylContact C-O 3.58Å; P334-P362 WeakPolarHBondContact CA-O 3.44Å; P334-P363 WeakPolarHBondContact CG-O 3.3Å; P334-L458 HydrophobicContact CB-CD1 4.22Å; P334-L458 HydrophobicContact CG-CD1 4.41Å; P334-H482 HydrophobicContact CG-CB 4.15Å
335	G	74.2	Confident	75.5	Confident	9 Å²	9	50.6 Å²	50.6	9%	0.093	30%	0.295	C	S	.	.			trans	-74.1	174.1	173.7	0	0	0	0	0	114.7	S360 P362	G335-S360 PolarHBondContact O-OG 2.74Å; G335-P362 PolarHBondContact N-O 2.71Å
336	P	80.2	Confident	74.7	Confident	77 Å²	77	50.8 Å²	50.8	50%	0.5	29%	0.293	S	S	.	.			trans	-73.4	142.1	-176.1	29.4	-35.2	0	0	0	113.6	H488	P336-H488 HydrophobicContact CB-CB 4.13Å
337	P	85.8	Confident	73.7	Confident	11 Å²	11	54 Å²	54	7%	0.071	31%	0.313	C	S	.	.			trans	-78.2	151.5	-176.5	30.6	-33.7	0	0	0	113.8	V359 L370 T480 H488 T490	P337-V359 CarbonylContact C-O 3.53Å; P337-V359 VanDerWaalsContact CA-O 3.28Å; P337-V359 WeakPolarHBondContact CA-O 3.48Å; P337-L370 HydrophobicContact CB-CD2 3.91Å; P337-T480 HydrophobicContact CB-CG2 4.12Å; P337-T480 HydrophobicContact CG-CG2 4.11Å; P337-H488 HydrophobicContact CG-CB 4.34Å; P337-H488 WeakPolarHBondContact CG-O 3.47Å; P337-T490 HydrophobicContact CB-CG2 4.27Å; P337-T490 HydrophobicContact CG-CG2 4.21Å
338	K	83.4	Confident	73.1	Confident	139 Å²	139	52 Å²	52	60%	0.604	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133	128.7	175.1	-61.3	173.8	-174.3	171	0	110	C358 V359	K338-C358 CarbonylContact O-C 3.53Å; K338-C358 VanDerWaalsContact O-CA 3.32Å; K338-C358 WeakPolarHBondContact O-CA 3.11Å; K338-V359 HydrophobicContact CB-CG2 4.07Å; K338-V359 PolarHBondContact N-O 2.76Å; K338-V359 PolarHBondContact O-N 3.1Å
339	I	82.7	Confident	72.4	Confident	32 Å²	32	55.8 Å²	55.8	16%	0.164	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	133.4	171.1	-69.3	164.6	0	0	0	109.3	V357 W372 C478 T490 I492	I339-V357 CarbonylContact C-O 3.59Å; I339-V357 WeakPolarHBondContact CA-O 3.39Å; I339-W372 HydrophobicContact CD1-CH2 4.22Å; I339-W372 HydrophobicContact CD1-CZ3 3.8Å; I339-W372 HydrophobicContact CG1-CH2 3.82Å; I339-W372 HydrophobicContact CG1-CZ3 3.92Å; I339-W372 HydrophobicContact CG2-CH2 4.17Å; I339-C478 HydrophobicContact CD1-CB 4.01Å; I339-C478 HydrophobicContact CG1-CB 3.88Å; I339-T490 HydrophobicContact CD1-CG2 3.91Å; I339-T490 HydrophobicContact CG1-CG2 3.79Å; I339-I492 HydrophobicContact CD1-CG2 4.46Å; I339-I492 HydrophobicContact CG2-CD1 4.39Å; I339-I492 HydrophobicContact CG2-CG2 4.15Å
340	V	76.3	Confident	71.8	Confident	81 Å²	81	56.7 Å²	56.7	49%	0.491	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	104.8	176.5	-174.8	0	0	0	0	107.6	V357 V359	V340-V357 HydrophobicContact CB-CB 4.42Å; V340-V357 PolarHBondContact N-O 2.95Å; V340-V357 WeakPolarHBondContact O-CB 3.44Å; V340-V357 PolarHBondContact O-N 2.85Å; V340-V359 HydrophobicContact CG2-CG2 4.39Å
341	S	63.6	Low	71.3	Confident	33 Å²	33	56.9 Å²	56.9	23%	0.231	33%	0.329	C	S	.	.			trans	-99.3	136.3	170.4	179.1	0	0	0	0	109.5	E343	S341-E343 VanDerWaalsContact C-N 3.3Å; S341-E343 PolarHBondContact OG-N 2.9Å; S341-E343 VanDerWaalsContact OG-N 3.15Å; S341-E343 PolarHBondContact OG-O 2.81Å; S341-E343 VanDerWaalsContact OG-O 3.12Å
342	P	57.6	Low	71.2	Confident	93 Å²	93	60.2 Å²	60.2	60%	0.604	34%	0.344	S	S	*	.	S	Bend	trans	-76.8	-18	169.6	33.1	-34.1	0	0	0	112.7	R355	P342-R355 WeakPolarHBondContact CD-O 3.37Å
343	E	60.5	Low	71.2	Confident	73 Å²	73	62.3 Å²	62.3	34%	0.341	35%	0.35	S	S	.	.	S	Bend	trans	-99.6	118.1	-174.4	-72.4	142.4	-153.8	0	0	110.4	S341 N345 Y348	S341-E343 VanDerWaalsContact C-N 3.3Å; S341-E343 PolarHBondContact OG-N 2.9Å; S341-E343 VanDerWaalsContact OG-N 3.15Å; S341-E343 PolarHBondContact OG-O 2.81Å; S341-E343 VanDerWaalsContact OG-O 3.12Å; E343-N345 PolarHBondContact O-N 2.89Å; E343-Y348 VanDerWaalsContact OE2-CE1 3.23Å; E343-Y348 WeakPolarHBondContact OE2-CE1 3.1Å; E343-Y348 VanDerWaalsContact OE2-CZ 3.31Å; E343-Y348 PolarHBondContact OE2-OH 2.99Å
344	S	55.2	Low	71.4	Confident	110 Å²	110	60.9 Å²	60.9	77%	0.769	34%	0.341	S	S	*	.	S	Bend	trans	-78.8	-10.2	-160.7	52.6	0	0	0	0	116.7
345	N	61.4	Low	71.7	Confident	125 Å²	125	65.4 Å²	65.4	67%	0.668	36%	0.357	S	S	*	.	S	Bend	trans	-126.2	-11.2	-171.3	-75.2	-31.2	0	0	0	115.9	E343 V347	E343-N345 PolarHBondContact O-N 2.89Å; N345-V347 VanDerWaalsContact C-N 3.27Å; N345-V347 PolarHBondContact O-N 2.87Å
346	H	71.9	Confident	71.8	Confident	50 Å²	50	65 Å²	65	23%	0.231	35%	0.353	C	S	.	.			trans	56.8	29.5	-178.1	-43.6	101.4	0	0	0	116	T493 I494 F495	H346-T493 WeakPolarHBondContact CB-O 3.29Å; H346-I494 HydrophobicContact CB-CD1 4.22Å; H346-F495 PolarHBondContact O-N 2.9Å
347	V	71	Confident	71.9	Confident	72 Å²	72	62.5 Å²	62.5	44%	0.436	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	130.3	177.1	-176.9	0	0	0	0	109.4	N345 F495	N345-V347 VanDerWaalsContact C-N 3.27Å; N345-V347 PolarHBondContact O-N 2.87Å; V347-F495 HydrophobicContact CG1-CB 4.45Å; V347-F495 HydrophobicContact CG2-CB 4.27Å; V347-F495 HydrophobicContact CG2-CD2 4.39Å
348	Y	73.5	Confident	71.7	Confident	12 Å²	12	62 Å²	62	5%	0.047	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	161.7	-174.5	-60.5	-88.8	0	0	0	111.9	E343 E352 L354 I494 F495 V496 K497	E343-Y348 VanDerWaalsContact OE2-CE1 3.23Å; E343-Y348 WeakPolarHBondContact OE2-CE1 3.1Å; E343-Y348 VanDerWaalsContact OE2-CZ 3.31Å; E343-Y348 PolarHBondContact OE2-OH 2.99Å; Y348-E352 VanDerWaalsContact CA-OE2 3.27Å; Y348-E352 WeakPolarHBondContact CA-OE2 3.02Å; Y348-E352 HydrophobicContact CD1-CB 4.23Å; Y348-L354 HydrophobicContact CD2-CD1 4.49Å; Y348-L354 HydrophobicContact CE1-CB 4.05Å; Y348-L354 HydrophobicContact CE1-CG 4.43Å; Y348-L354 HydrophobicContact CE2-CD1 3.74Å; Y348-L354 HydrophobicContact CE2-CG 4.27Å; Y348-I494 HydrophobicContact CD2-CG2 3.72Å; Y348-I494 HydrophobicContact CE2-CD1 4.43Å; Y348-I494 HydrophobicContact CE2-CG2 3.96Å; Y348-F495 PolarHBondContact N-O 2.85Å; Y348-V496 CarbonylContact O-C 3.53Å; Y348-V496 WeakPolarHBondContact O-CA 3.3Å; Y348-K497 PolarHBondContact O-N 2.96Å; Y348-K497 VanDerWaalsContact O-N 3.13Å
349	L	72.1	Confident	71.8	Confident	85 Å²	85	56.7 Å²	56.7	45%	0.445	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	152.9	164	-54.7	180	0	0	0	110.2	G351 E352 K497	L349-G351 PolarHBondContact O-N 3.21Å; L349-G351 VanDerWaalsContact O-N 3.08Å; L349-E352 HydrophobicContact CB-CG 3.99Å; L349-E352 PolarHBondContact N-OE2 2.85Å; L349-E352 PolarHBondContact O-N 2.93Å; L349-K497 HydrophobicContact CD2-CB 4.1Å; L349-K497 HydrophobicContact CD2-CD 3.93Å; L349-K497 HydrophobicContact CD2-CG 4.41Å
350	D	67.3	Low	71.7	Confident	68 Å²	68	55.3 Å²	55.3	36%	0.364	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	115.4	175.9	-162.5	-35.8	0	0	0	110.5	V467 T468 R469 V496 K497 H498	D350-V467 WeakPolarHBondContact CA-O 3.13Å; D350-T468 WeakPolarHBondContact OD1-CA 3.16Å; D350-R469 VanDerWaalsContact OD2-CB 3.3Å; D350-R469 WeakPolarHBondContact OD2-CB 3.48Å; D350-R469 PolarHBondContact OD2-N 2.93Å; D350-V496 HydrophobicContact CB-CG1 4.21Å; D350-K497 WeakPolarHBondContact CB-O 3.31Å; D350-K497 PolarHBondContact N-O 2.84Å; D350-H498 HydrophobicContact CB-CB 4.11Å
351	G	67.3	Low	71.8	Confident	21 Å²	21	54 Å²	54	22%	0.216	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	101.4	-4.6	-177.9	0	0	0	0	0	116.2	L349 V467	L349-G351 PolarHBondContact O-N 3.21Å; L349-G351 VanDerWaalsContact O-N 3.08Å; G351-V467 PolarHBondContact N-O 2.7Å
352	E	74.1	Confident	72.4	Confident	83 Å²	83	55.9 Å²	55.9	39%	0.388	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-70.1	157.9	173.1	-81.3	178.6	165.8	0	0	112.7	Y348 L349 R466 V467	Y348-E352 VanDerWaalsContact CA-OE2 3.27Å; Y348-E352 WeakPolarHBondContact CA-OE2 3.02Å; Y348-E352 HydrophobicContact CD1-CB 4.23Å; L349-E352 HydrophobicContact CB-CG 3.99Å; L349-E352 PolarHBondContact N-OE2 2.85Å; L349-E352 PolarHBondContact O-N 2.93Å; E352-R466 CarbonylContact O-C 3.51Å; E352-R466 WeakPolarHBondContact O-CA 3.2Å; E352-V467 PolarHBondContact O-N 2.8Å
353	Q	74.4	Confident	73.1	Confident	96 Å²	96	51.8 Å²	51.8	45%	0.449	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-89.8	131.1	179	-178.9	-175.7	-18.8	0	0	110.8	I463 I464	Q353-I463 HydrophobicContact CG-CG2 4.02Å; Q353-I463 VanDerWaalsContact NE2-CG2 3.3Å; Q353-I464 CarbonylContact C-O 3.26Å; Q353-I464 WeakPolarHBondContact CA-O 3.43Å; Q353-I464 WeakPolarHBondContact CG-O 3.38Å
354	L	73.2	Confident	73.6	Confident	2 Å²	2	49 Å²	49	1%	0.01	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	136.1	171.1	176.4	156.8	0	0	0	110.4	Y348 A356 L462 I463 I464 V467 I494	Y348-L354 HydrophobicContact CD2-CD1 4.49Å; Y348-L354 HydrophobicContact CE1-CB 4.05Å; Y348-L354 HydrophobicContact CE1-CG 4.43Å; Y348-L354 HydrophobicContact CE2-CD1 3.74Å; Y348-L354 HydrophobicContact CE2-CG 4.27Å; L354-A356 HydrophobicContact CD2-CB 4.24Å; L354-L462 HydrophobicContact CD2-CD2 4.4Å; L354-I463 WeakPolarHBondContact O-CA 3.46Å; L354-I464 HydrophobicContact CB-CB 4.18Å; L354-I464 HydrophobicContact CB-CD1 4.05Å; L354-I464 HydrophobicContact CB-CG1 4.23Å; L354-I464 HydrophobicContact CD1-CD1 3.98Å; L354-I464 HydrophobicContact CD2-CD1 3.91Å; L354-I464 HydrophobicContact CD2-CG1 4.04Å; L354-I464 HydrophobicContact CG-CD1 4.21Å; L354-I464 PolarHBondContact N-O 2.88Å; L354-I464 PolarHBondContact O-N 2.89Å; L354-V467 HydrophobicContact CB-CG2 3.56Å; L354-V467 HydrophobicContact CD1-CG2 4.5Å; L354-I494 HydrophobicContact CD1-CD1 3.53Å; L354-I494 HydrophobicContact CD1-CG1 3.93Å; L354-I494 HydrophobicContact CD1-CG2 4.14Å
355	R	79.2	Confident	74.4	Confident	101 Å²	101	47.7 Å²	47.7	38%	0.381	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	113.3	176.8	-173.3	179.9	-162	-67.2	-3	112	P342 T461 I463	P342-R355 WeakPolarHBondContact CD-O 3.37Å; R355-T461 HydrophobicContact CG-CG2 4.31Å; R355-I463 HydrophobicContact CG-CG1 4.3Å
356	A	76.9	Confident	74.7	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.008	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	133.6	177.6	0	0	0	0	0	111.3	L354 W372 T461 L462 L476	L354-A356 HydrophobicContact CD2-CB 4.24Å; A356-W372 HydrophobicContact CB-CH2 3.49Å; A356-W372 VanDerWaalsContact CB-CH2 3.49Å; A356-W372 HydrophobicContact CB-CZ2 4.09Å; A356-W372 HydrophobicContact CB-CZ3 4.12Å; A356-W372 WeakPolarHBondContact O-CZ2 3.41Å; A356-T461 CarbonylContact O-C 3.58Å; A356-T461 WeakPolarHBondContact O-CA 3.36Å; A356-L462 PolarHBondContact N-O 3.47Å; A356-L462 PolarHBondContact O-N 2.9Å; A356-L476 HydrophobicContact CB-CD2 4.4Å
357	V	82.5	Confident	74.5	Confident	24 Å²	24	43.6 Å²	43.6	15%	0.145	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	144.5	176.7	-172.6	0	0	0	0	109.1	I339 V340 V359 V459 T461	I339-V357 CarbonylContact C-O 3.59Å; I339-V357 WeakPolarHBondContact CA-O 3.39Å; V340-V357 HydrophobicContact CB-CB 4.42Å; V340-V357 PolarHBondContact N-O 2.95Å; V340-V357 WeakPolarHBondContact O-CB 3.44Å; V340-V357 PolarHBondContact O-N 2.85Å; V357-V359 HydrophobicContact CG1-CG1 4.1Å; V357-V459 HydrophobicContact CG1-CG1 3.75Å; V357-T461 HydrophobicContact CG2-CG2 4.13Å
358	C	82.1	Confident	74.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	136.9	171	-172.8	0	0	0	0	110	K338 L370 W372 V459 N460 C478	K338-C358 CarbonylContact O-C 3.53Å; K338-C358 VanDerWaalsContact O-CA 3.32Å; K338-C358 WeakPolarHBondContact O-CA 3.11Å; C358-L370 WeakPolarHBondContact O-CD1 3.41Å; C358-W372 HydrophobicContact CB-CH2 4.05Å; C358-W372 HydrophobicContact CB-CZ2 3.49Å; C358-W372 VanDerWaalsContact CB-CZ2 3.49Å; C358-V459 CarbonylContact O-C 3.51Å; C358-V459 WeakPolarHBondContact O-CA 3.28Å; C358-N460 PolarHBondContact N-O 3.4Å; C358-N460 PolarHBondContact O-N 3.06Å; C358-C478 HydrophobicContact CB-CB 3.79Å; C358-C478 WeakPolarHBondContact CB-SG 3.45Å; C358-C478 WeakPolarHBondContact SG-CB 3.41Å; C358-C478 CovalentContact SG-SG 2.03Å; C358-C478 PolarHBondContact SG-SG 2.85Å
359	V	85.4	Confident	73.9	Confident	29 Å²	29	39.7 Å²	39.7	18%	0.176	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	144	-175.5	-57.1	0	0	0	0	112.1	P337 K338 V340 V357 L458 V459	P337-V359 CarbonylContact C-O 3.53Å; P337-V359 VanDerWaalsContact CA-O 3.28Å; P337-V359 WeakPolarHBondContact CA-O 3.48Å; K338-V359 HydrophobicContact CB-CG2 4.07Å; K338-V359 PolarHBondContact N-O 2.76Å; K338-V359 PolarHBondContact O-N 3.1Å; V340-V359 HydrophobicContact CG2-CG2 4.39Å; V357-V359 HydrophobicContact CG1-CG1 4.1Å; V359-L458 CarbonylContact C-O 3.53Å; V359-L458 WeakPolarHBondContact CA-O 3.38Å; V359-V459 HydrophobicContact CG1-CG1 4.17Å; V359-V459 HydrophobicContact CG1-CG2 4.04Å
360	S	79.9	Confident	73.9	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.014	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	140.4	174	165.7	0	0	0	0	110.2	G335 Q457 L458	G335-S360 PolarHBondContact O-OG 2.74Å; S360-Q457 CarbonylContact O-C 3.39Å; S360-Q457 VanDerWaalsContact O-CA 3.25Å; S360-Q457 WeakPolarHBondContact O-CA 3.38Å; S360-Q457 WeakPolarHBondContact O-CB 3.21Å; S360-L458 PolarHBondContact N-O 3.38Å; S360-L458 PolarHBondContact O-N 2.76Å
361	S	78	Confident	74	Confident	53 Å²	53	35.1 Å²	35.1	37%	0.371	19%	0.189	S	C	.	.	S	Bend	trans	-153.9	135.9	178.8	-173.7	0	0	0	0	109.3	D456	S361-D456 PolarHBondContact OG-O 2.87Å
362	P	76.5	Confident	74.1	Confident	73 Å²	73	35.1 Å²	35.1	47%	0.474	18%	0.183	S	C	.	.	S	Bend	cis	-65.8	165.4	-4.4	31.1	-37.3	0	0	0	112.5	P334 G335	P334-P362 CarbonylContact C-O 3.58Å; P334-P362 WeakPolarHBondContact CA-O 3.44Å; G335-P362 PolarHBondContact N-O 2.71Å
363	P	73.4	Confident	73.6	Confident	8 Å²	8	34.2 Å²	34.2	5%	0.052	18%	0.176	C	C	.	.			trans	-87.1	-9	-172.8	35.3	-37.9	0	0	0	115.3	P334 L367 G368 L451 D456 L458	P334-P363 WeakPolarHBondContact CG-O 3.3Å; P363-L367 HydrophobicContact CB-CD2 3.86Å; P363-L367 HydrophobicContact CG-CD2 4.03Å; P363-G368 PolarHBondContact O-N 2.93Å; P363-L451 HydrophobicContact CB-CD1 4.16Å; P363-L451 HydrophobicContact CG-CD1 4.2Å; P363-D456 WeakPolarHBondContact CD-OD2 3.07Å; P363-D456 VanDerWaalsContact CG-OD1 3.32Å; P363-D456 WeakPolarHBondContact CG-OD1 3.49Å; P363-L458 HydrophobicContact CB-CD1 4.44Å; P363-L458 HydrophobicContact CB-CD2 3.94Å; P363-L458 HydrophobicContact CB-CG 3.7Å
364	G	71.4	Confident	72.9	Confident	13 Å²	13	30.9 Å²	30.9	13%	0.134	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	159.9	-176.4	0	0	0	0	0	114.8	T332 P366	T332-G364 CarbonylContact O-C 3.6Å; T332-G364 WeakPolarHBondContact O-CA 3.45Å; G364-P366 CarbonylContact C-O 3.56Å; G364-P366 VanDerWaalsContact C-O 3.25Å; G364-P366 CarbonylContact O-C 3.52Å
365	K	71	Confident	72.1	Confident	84 Å²	84	35.1 Å²	35.1	37%	0.365	18%	0.182	S	C	.	.	B	Isolated β-bridge	trans	-126.8	120.8	171.8	177.3	-174.5	179.2	-77.3	0	108.6	D298 V330 H331 T332 H482	D298-K365 IonicContact OD1-NZ 2.86Å; D298-K365 PolarHBondContact OD1-NZ 3.39Å; D298-K365 WeakPolarHBondContact OD2-CE 3.49Å; D298-K365 IonicContact OD2-NZ 2.59Å; D298-K365 PolarHBondContact OD2-NZ 2.76Å; V330-K365 PolarHBondContact O-NZ 2.83Å; H331-K365 CarbonylContact C-O 3.53Å; H331-K365 WeakPolarHBondContact CA-O 3.44Å; T332-K365 PolarHBondContact N-O 3.23Å; T332-K365 PolarHBondContact O-N 2.74Å; T332-K365 PolarHBondContact OG1-N 3.05Å; K365-H482 PolarHBondContact O-NE2 2.96Å
366	P	68.1	Low	70.8	Confident	44 Å²	44	34.6 Å²	34.6	29%	0.286	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	cis	-57.2	167.5	-17.2	29.3	-36.7	0	0	0	111.5	G364 G368 H482 P483	G364-P366 CarbonylContact C-O 3.56Å; G364-P366 VanDerWaalsContact C-O 3.25Å; G364-P366 CarbonylContact O-C 3.52Å; P366-G368 PolarHBondContact O-N 3.15Å; P366-H482 PolarHBondContact O-CD2 2.83Å; P366-H482 VanDerWaalsContact O-CD2 3.31Å; P366-H482 PolarHBondContact O-NE2 3.33Å; P366-P483 HydrophobicContact CG-CG 4.26Å
367	L	66.6	Low	69.2	Low	45 Å²	45	43.9 Å²	43.9	24%	0.236	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	129.3	-175.8	-67	170.8	0	0	0	112.1	P363 L410 L451	P363-L367 HydrophobicContact CB-CD2 3.86Å; P363-L367 HydrophobicContact CG-CD2 4.03Å; L367-L410 HydrophobicContact CD1-CD1 4.47Å; L367-L451 HydrophobicContact CD1-CD2 4.08Å; L367-L451 HydrophobicContact CD2-CD1 3.99Å; L367-L451 HydrophobicContact CD2-CD2 4.32Å
368	G	67.9	Low	66.8	Low	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.257	C	S	.	.			trans	-71.3	175.5	171.8	0	0	0	0	0	113.5	P363 P366 L458 G481	P363-G368 PolarHBondContact O-N 2.93Å; P366-G368 PolarHBondContact O-N 3.15Å; G368-L458 WeakPolarHBondContact O-CD1 3.18Å; G368-L458 WeakPolarHBondContact O-CD2 3.27Å; G368-G481 VanDerWaalsContact CA-O 3.27Å; G368-G481 WeakPolarHBondContact CA-O 3.2Å
369	G	65.2	Low	64.5	Low	2 Å²	2	53.4 Å²	53.4	2%	0.021	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	153.4	173.4	0	0	0	0	0	112.3	Y403 T480 G481	G369-Y403 PolarHBondContact N-OH 2.89Å; G369-T480 WeakPolarHBondContact O-CA 3.38Å; G369-G481 PolarHBondContact N-O 3Å; G369-G481 PolarHBondContact O-N 3.48Å
370	L	72	Confident	62.4	Low	2 Å²	2	56.2 Å²	56.2	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	132.2	164.8	-80	175.3	0	0	0	109.5	P337 C358 L458 N460 E479 T480	P337-L370 HydrophobicContact CB-CD2 3.91Å; C358-L370 WeakPolarHBondContact O-CD1 3.41Å; L370-L458 HydrophobicContact CD1-CB 3.66Å; L370-L458 VanDerWaalsContact CD1-O 3.29Å; L370-L458 WeakPolarHBondContact CD1-O 3.49Å; L370-L458 HydrophobicContact CG-CB 3.96Å; L370-L458 HydrophobicContact CG-CD1 4.45Å; L370-N460 HydrophobicContact CB-CB 3.66Å; L370-N460 HydrophobicContact CD1-CB 4.34Å; L370-N460 PolarHBondContact O-ND2 3.31Å; L370-E479 WeakPolarHBondContact CA-O 3.34Å; L370-T480 HydrophobicContact CD2-CG2 3.49Å; L370-T480 VanDerWaalsContact CD2-CG2 3.49Å
371	F	69.2	Low	60.5	Low	55 Å²	55	60 Å²	60	24%	0.241	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	149	-172.1	-53.7	-85.8	0	0	0	110.9	A398 C478 E479	F371-A398 HydrophobicContact CE1-CB 4.02Å; F371-C478 CarbonylContact O-C 3.59Å; F371-C478 VanDerWaalsContact O-CA 3.27Å; F371-C478 WeakPolarHBondContact O-CA 3.4Å; F371-E479 PolarHBondContact N-O 2.65Å; F371-E479 PolarHBondContact O-N 2.93Å
372	W	68.3	Low	58.5	Low	20 Å²	20	65 Å²	65	8%	0.076	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	143.3	173.8	-69	88.9	0	0	0	110.7	I339 A356 C358 P446 N460 L462 L476 I477 C478	I339-W372 HydrophobicContact CD1-CH2 4.22Å; I339-W372 HydrophobicContact CD1-CZ3 3.8Å; I339-W372 HydrophobicContact CG1-CH2 3.82Å; I339-W372 HydrophobicContact CG1-CZ3 3.92Å; I339-W372 HydrophobicContact CG2-CH2 4.17Å; A356-W372 HydrophobicContact CB-CH2 3.49Å; A356-W372 VanDerWaalsContact CB-CH2 3.49Å; A356-W372 HydrophobicContact CB-CZ2 4.09Å; A356-W372 HydrophobicContact CB-CZ3 4.12Å; A356-W372 WeakPolarHBondContact O-CZ2 3.41Å; C358-W372 HydrophobicContact CB-CH2 4.05Å; C358-W372 HydrophobicContact CB-CZ2 3.49Å; C358-W372 VanDerWaalsContact CB-CZ2 3.49Å; W372-P446 HydrophobicContact CB-CG 4.26Å; W372-P446 HydrophobicContact CG-CG 4.08Å; W372-N460 VanDerWaalsContact CD1-OD1 3.23Å; W372-N460 PolarHBondContact NE1-OD1 2.64Å; W372-L462 HydrophobicContact CB-CD1 4.25Å; W372-L462 HydrophobicContact CD2-CB 4.02Å; W372-L462 HydrophobicContact CD2-CD2 4.46Å; W372-L462 HydrophobicContact CE3-CD2 4.39Å; W372-L462 HydrophobicContact CG-CB 4.3Å; W372-L462 HydrophobicContact CG-CD1 4.22Å; W372-L462 HydrophobicContact CZ2-CB 4.09Å; W372-L476 HydrophobicContact CE3-CD1 3.98Å; W372-L476 HydrophobicContact CE3-CD2 3.86Å; W372-L476 HydrophobicContact CE3-CG 3.75Å; W372-L476 HydrophobicContact CZ3-CD2 3.65Å; W372-L476 HydrophobicContact CZ3-CG 3.87Å; W372-I477 CarbonylContact C-O 3.53Å; W372-I477 VanDerWaalsContact CA-O 3.29Å; W372-I477 WeakPolarHBondContact CA-O 3.36Å; W372-C478 HydrophobicContact CD2-CB 4.22Å; W372-C478 HydrophobicContact CE3-CB 4Å; W372-C478 HydrophobicContact CH2-CB 4.47Å; W372-C478 HydrophobicContact CZ3-CB 4.12Å
373	R	63.6	Low	56.7	Low	64 Å²	64	65.2 Å²	65.2	24%	0.242	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	143.9	173.9	52.3	-176.9	157.5	86.9	-8.3	112.4	I477 E479	R373-I477 HydrophobicContact CG-CB 3.96Å; R373-I477 HydrophobicContact CG-CG2 4.3Å; R373-I477 PolarHBondContact N-O 3.19Å; R373-I477 WeakPolarHBondContact O-CA 3.1Å; R373-I477 WeakPolarHBondContact O-CB 3.38Å; R373-I477 PolarHBondContact O-N 2.72Å; R373-E479 IonicContact CZ-OE1 3.51Å; R373-E479 IonicContact CZ-OE2 2.64Å; R373-E479 VanDerWaalsContact CZ-OE2 3.28Å; R373-E479 IonicContact NE-OE1 3.57Å; R373-E479 IonicContact NE-OE2 3.19Å; R373-E479 PolarHBondContact NE-OE2 3.14Å; R373-E479 IonicContact NH2-OE1 2.69Å; R373-E479 PolarHBondContact NH2-OE1 2.91Å; R373-E479 IonicContact NH2-OE2 2.74Å; R373-E479 PolarHBondContact NH2-OE2 2.91Å
374	W	61	Low	55	Low	26 Å²	26	70.6 Å²	70.6	10%	0.098	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	164.2	172.1	-69.6	109	0	0	0	112.3	I376 D443 I464 Y471 A474 K475 L476 I494	W374-I376 HydrophobicContact CB-CG1 4.44Å; W374-D443 PolarHBondContact NE1-OD1 2.86Å; W374-I464 HydrophobicContact CH2-CD1 3.66Å; W374-I464 HydrophobicContact CZ2-CD1 3.48Å; W374-I464 VanDerWaalsContact CZ2-CD1 3.48Å; W374-I464 HydrophobicContact CZ2-CG1 4.45Å; W374-Y471 AromaticContact CH2-CD1 3.76Å; W374-Y471 HydrophobicContact CH2-CD1 3.76Å; W374-Y471 HydrophobicContact CH2-CE1 4.07Å; W374-Y471 AromaticContact CZ2-CD1 3.76Å; W374-Y471 HydrophobicContact CZ2-CD1 3.76Å; W374-Y471 AromaticContact CZ2-CE1 3.57Å; W374-Y471 HydrophobicContact CZ2-CE1 3.57Å; W374-Y471 HydrophobicContact CZ3-CD1 4.38Å; W374-A474 HydrophobicContact CE3-CB 4.01Å; W374-A474 HydrophobicContact CZ3-CB 3.83Å; W374-K475 CarbonylContact C-O 3.55Å; W374-K475 WeakPolarHBondContact CA-O 3.37Å; W374-L476 HydrophobicContact CD2-CD1 3.92Å; W374-L476 HydrophobicContact CE3-CB 3.98Å; W374-L476 HydrophobicContact CE3-CD1 4.03Å; W374-L476 HydrophobicContact CG-CD1 4.47Å; W374-L476 HydrophobicContact CH2-CD1 4.42Å; W374-L476 HydrophobicContact CZ2-CD1 4.33Å; W374-L476 HydrophobicContact CZ3-CB 3.9Å; W374-L476 HydrophobicContact CZ3-CD1 4.27Å; W374-I494 HydrophobicContact CH2-CG1 4.45Å; W374-I494 HydrophobicContact CZ3-CG1 4.22Å
375	L	56.6	Low	53.5	Low	92 Å²	92	76.2 Å²	76.2	48%	0.482	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	97.3	165.3	-167.1	150.8	0	0	0	108	K475 I477	L375-K475 HydrophobicContact CB-CB 4.36Å; L375-K475 PolarHBondContact N-O 3.33Å; L375-K475 WeakPolarHBondContact O-CB 3.48Å; L375-K475 PolarHBondContact O-N 3.28Å; L375-I477 HydrophobicContact CB-CD1 4.13Å; L375-I477 HydrophobicContact CD1-CD1 4.24Å
376	I	51.1	Low	51.8	Low	90 Å²	90	76 Å²	76	46%	0.462	40%	0.395	S	S	.	.			trans	-97	137.1	178.3	-55.4	174.1	0	0	0	107.8	W374 A474	W374-I376 HydrophobicContact CB-CG1 4.44Å; I376-A474 HydrophobicContact CG1-CB 4.36Å
377	R	44.3	Very low	49.9	Very low	196 Å²	196	80.8 Å²	80.8	74%	0.74	41%	0.414	S	S	*	.			trans	-86.1	123.3	176.5	-81.4	-167.4	-82.8	-174.2	-1.8	110.4	S379	R377-S379 PolarHBondContact O-N 2.85Å
378	P	31.1	Very low	48.3	Very low	140 Å²	140	87.5 Å²	87.5	91%	0.909	44%	0.441	S	S	*	.	S	Bend	trans	-73.3	38.3	-174.8	-20.4	34.9	0	0	0	116.4
379	S	33.9	Very low	46.4	Very low	84 Å²	84	93.4 Å²	93.4	59%	0.587	47%	0.472	S	S	*	.			trans	-132	19.1	-164.5	67.4	0	0	0	0	115.7	R377	R377-S379 PolarHBondContact O-N 2.85Å
380	Q	42.5	Very low	44.5	Very low	87 Å²	87	98.7 Å²	98.7	41%	0.407	51%	0.509	S	S	.	.	S	Bend	trans	-142.7	150.2	-179.9	-69.2	179.3	-20.5	0	0	110.6	E579	Q380-E579 PolarHBondContact NE2-OE2 3.13Å
381	V	39	Very low	42.3	Very low	82 Å²	82	100.9 Å²	100.9	50%	0.497	53%	0.531	S	S	.	.			trans	72.6	108.2	-175	-169	0	0	0	0	115.5	D383 I386 Y542	V381-D383 HydrophobicContact CG1-CB 3.92Å; V381-D383 PolarHBondContact O-N 2.85Å; V381-I386 HydrophobicContact CG1-CD1 4.3Å; V381-Y542 HydrophobicContact CG2-CE2 4.17Å; V381-Y542 PolarHBondContact N-OH 3.4Å
382	D	36.7	Very low	40.3	Very low	158 Å²	158	105.1 Å²	105.1	85%	0.845	56%	0.555	S	S	*	*			trans	-94.9	64.1	-178.5	-165.8	22	0	0	0	111.1
383	D	38.9	Very low	38.2	Very low	78 Å²	78	106.1 Å²	106.1	42%	0.417	57%	0.572	S	S	.	*			trans	-116.1	120.9	-175.1	-165	-16.3	0	0	0	111.6	V381 D385 I386	V381-D383 HydrophobicContact CG1-CB 3.92Å; V381-D383 PolarHBondContact O-N 2.85Å; D383-D385 VanDerWaalsContact C-N 3.34Å; D383-D385 PolarHBondContact O-N 2.9Å; D383-I386 HydrophobicContact CB-CD1 3.94Å; D383-I386 HydrophobicContact CB-CG1 4.13Å; D383-I386 WeakPolarHBondContact O-CB 3.27Å; D383-I386 PolarHBondContact O-N 2.84Å; D383-I386 VanDerWaalsContact O-N 3.14Å
384	N	37.3	Very low	36.3	Very low	121 Å²	121	106.4 Å²	106.4	65%	0.647	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-70.4	-25.2	-167.4	-77.9	-72.1	0	0	0	113.8	I386	N384-I386 PolarHBondContact O-N 2.9Å
385	D	38.7	Very low	34.8	Very low	131 Å²	131	116.3 Å²	116.3	70%	0.701	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-73.4	-17.1	175.5	-85.3	-47.8	0	0	0	112.9	D383 Q387	D383-D385 VanDerWaalsContact C-N 3.34Å; D383-D385 PolarHBondContact O-N 2.9Å; D385-Q387 PolarHBondContact O-N 2.82Å
386	I	35.3	Very low	33.3	Very low	78 Å²	78	114.7 Å²	114.7	40%	0.4	64%	0.638	S	S	.	*	G	3₁₀ helix	trans	-77	-7.7	179.4	-61.1	-175.4	0	0	0	112.3	V381 D383 N384 K388 I389	V381-I386 HydrophobicContact CG1-CD1 4.3Å; D383-I386 HydrophobicContact CB-CD1 3.94Å; D383-I386 HydrophobicContact CB-CG1 4.13Å; D383-I386 WeakPolarHBondContact O-CB 3.27Å; D383-I386 PolarHBondContact O-N 2.84Å; D383-I386 VanDerWaalsContact O-N 3.14Å; N384-I386 PolarHBondContact O-N 2.9Å; I386-K388 PolarHBondContact O-N 2.88Å; I386-I389 HydrophobicContact CG2-CB 4.25Å; I386-I389 HydrophobicContact CG2-CD1 4.2Å; I386-I389 HydrophobicContact CG2-CG1 4.24Å; I386-I389 PolarHBondContact O-N 3.26Å
387	Q	28.4	Very low	32	Very low	145 Å²	145	112.4 Å²	112.4	68%	0.678	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-63.5	-4.8	173.7	-63.9	-168.1	12.8	0	0	114.5	D385	D385-Q387 PolarHBondContact O-N 2.82Å
388	K	33	Very low	31.3	Very low	186 Å²	186	105.8 Å²	105.8	81%	0.809	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-87.8	-8	167.1	-73.4	171.8	-176.9	156.7	0	114.5	I386	I386-K388 PolarHBondContact O-N 2.88Å
389	I	29.3	Very low	31.3	Very low	124 Å²	124	106.7 Å²	106.7	64%	0.636	61%	0.609	S	S	*	*			trans	-103.9	24	-178.1	-35	-174.2	0	0	0	111.3	I386 G391	I386-I389 HydrophobicContact CG2-CB 4.25Å; I386-I389 HydrophobicContact CG2-CD1 4.2Å; I386-I389 HydrophobicContact CG2-CG1 4.24Å; I386-I389 PolarHBondContact O-N 3.26Å; I389-G391 PolarHBondContact O-N 2.04Å
390	S	24.6	Very low	31.2	Very low	114 Å²	114	107.6 Å²	107.6	80%	0.797	61%	0.606	S	S	*	*	S	Bend	trans	-77	58.6	172.8	67.4	0	0	0	0	111.9
391	G	24.9	Very low	30.8	Very low	47 Å²	47	106.9 Å²	106.9	49%	0.485	61%	0.611	S	S	.	*	S	Bend	trans	170	178.1	179	0	0	0	0	0	114.9	I389 G393	I389-G391 PolarHBondContact O-N 2.04Å; G391-G393 VanDerWaalsContact C-N 3.28Å; G391-G393 PolarHBondContact O-N 2.81Å; G391-G393 VanDerWaalsContact O-N 3.08Å
392	I	27.1	Very low	30.6	Very low	144 Å²	144	106.3 Å²	106.3	74%	0.738	61%	0.605	S	S	*	*			trans	75.4	-30.6	172.1	-54.3	172	0	0	0	116.6	G394 R395	I392-G394 PolarHBondContact O-N 2.99Å; I392-R395 PolarHBondContact O-N 3.41Å
393	G	24.2	Very low	30.6	Very low	42 Å²	42	100.6 Å²	100.6	43%	0.433	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.1	25.6	-180	0	0	0	0	0	118.3	G391	G391-G393 VanDerWaalsContact C-N 3.28Å; G391-G393 PolarHBondContact O-N 2.81Å; G391-G393 VanDerWaalsContact O-N 3.08Å
394	G	24.9	Very low	30.4	Very low	70 Å²	70	102.3 Å²	102.3	72%	0.722	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-163.6	19.9	-180	0	0	0	0	0	114.9	I392	I392-G394 PolarHBondContact O-N 2.99Å
395	R	28.8	Very low	30.2	Very low	233 Å²	233	100.1 Å²	100.1	88%	0.879	58%	0.58	S	S	*	*			trans	-122	21.6	-179.9	-71.9	-172.1	174.8	176.6	0	114.6	I392	I392-R395 PolarHBondContact O-N 3.41Å
396	G	24.6	Very low	30.1	Very low	59 Å²	59	95.5 Å²	95.5	61%	0.608	56%	0.556	S	S	*	*			trans	-83.5	-11	-177.9	0	0	0	0	0	116.3
397	G	25.6	Very low	30.1	Very low	41 Å²	41	96.1 Å²	96.1	42%	0.423	56%	0.558	S	S	.	*	S	Bend	trans	-78.4	124.4	172.4	0	0	0	0	0	110.8
398	A	27.7	Very low	30.3	Very low	58 Å²	58	92.3 Å²	92.3	48%	0.479	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-59.9	143.9	172.8	0	0	0	0	0	110.4	F371	F371-A398 HydrophobicContact CE1-CB 4.02Å
399	R	31.6	Very low	30.4	Very low	158 Å²	158	90 Å²	90	60%	0.596	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-69.7	150.3	171.7	-83.6	178	153.9	-165	-7.2	108.5	S401 D402	R399-S401 WeakPolarHBondContact CB-OG 3.48Å; R399-S401 PolarHBondContact O-N 2.81Å; R399-D402 PolarHBondContact N-OD2 2.8Å; R399-D402 WeakPolarHBondContact O-CB 3.44Å; R399-D402 PolarHBondContact O-N 2.93Å
400	L	32.9	Very low	30.8	Very low	103 Å²	103	86.8 Å²	86.8	54%	0.539	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-54.7	-20.1	168.5	-103.7	73.4	0	0	0	113.1	D402	L400-D402 PolarHBondContact O-N 2.59Å
401	S	32.8	Very low	31.4	Very low	72 Å²	72	88 Å²	88	50%	0.503	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-64.1	-19.4	173.4	55.9	0	0	0	0	115.1	R399	R399-S401 WeakPolarHBondContact CB-OG 3.48Å; R399-S401 PolarHBondContact O-N 2.81Å
402	D	36.4	Very low	32	Very low	70 Å²	70	89.2 Å²	89.2	37%	0.374	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-93.6	-2.6	-164	-52.3	-24.8	0	0	0	112.5	R399 L400 T404 S405	R399-D402 PolarHBondContact N-OD2 2.8Å; R399-D402 WeakPolarHBondContact O-CB 3.44Å; R399-D402 PolarHBondContact O-N 2.93Å; L400-D402 PolarHBondContact O-N 2.59Å; D402-T404 PolarHBondContact O-N 2.79Å; D402-T404 VanDerWaalsContact O-N 3.08Å; D402-S405 WeakPolarHBondContact O-CB 3.27Å; D402-S405 PolarHBondContact O-N 3.39Å; D402-S405 PolarHBondContact O-OG 2.77Å
403	Y	36.6	Very low	32.4	Very low	39 Å²	39	86.2 Å²	86.2	15%	0.153	50%	0.495	C	S	.	.	G	3₁₀ helix	trans	-54.8	-27.1	-178.7	-104.8	-75.9	0	0	0	115.3	G369 S405 V406 G481 H482 P483	G369-Y403 PolarHBondContact N-OH 2.89Å; Y403-S405 PolarHBondContact O-N 2.84Å; Y403-V406 WeakPolarHBondContact O-CB 3.35Å; Y403-V406 PolarHBondContact O-N 2.83Å; Y403-V406 VanDerWaalsContact O-N 3.08Å; Y403-G481 PolarHBondContact OH-O 3.15Å; Y403-H482 WeakPolarHBondContact OH-CA 3.29Å; Y403-H482 PolarHBondContact OH-N 2.83Å; Y403-P483 HydrophobicContact CD1-CG 3.68Å; Y403-P483 HydrophobicContact CD2-CG 4.04Å; Y403-P483 HydrophobicContact CE1-CG 3.93Å; Y403-P483 HydrophobicContact CE2-CG 4.27Å; Y403-P483 HydrophobicContact CG-CG 3.76Å
404	T	33.4	Very low	33	Very low	113 Å²	113	90.3 Å²	90.3	69%	0.693	51%	0.507	S	S	*	.	H	α-helix	trans	-61.8	-22.2	176.8	50.7	0	0	0	0	113.5	D402 A408	D402-T404 PolarHBondContact O-N 2.79Å; D402-T404 VanDerWaalsContact O-N 3.08Å; T404-A408 PolarHBondContact O-N 2.86Å
405	S	34.4	Very low	33.4	Very low	75 Å²	75	92 Å²	92	52%	0.524	51%	0.508	S	S	.	.	H	α-helix	trans	-75.7	-29	174.5	64.7	0	0	0	0	113.6	D402 Y403 A408 Y409	D402-S405 WeakPolarHBondContact O-CB 3.27Å; D402-S405 PolarHBondContact O-N 3.39Å; D402-S405 PolarHBondContact O-OG 2.77Å; Y403-S405 PolarHBondContact O-N 2.84Å; S405-A408 PolarHBondContact O-N 2.86Å; S405-Y409 PolarHBondContact O-N 2.8Å; S405-Y409 VanDerWaalsContact O-N 3.08Å
406	V	34.9	Very low	33.6	Very low	35 Å²	35	85 Å²	85	21%	0.212	49%	0.494	C	S	.	.	H	α-helix	trans	-71.7	-46.3	-179.6	170.4	0	0	0	0	110.9	Y403 A408 Y409 L410 Y449	Y403-V406 WeakPolarHBondContact O-CB 3.35Å; Y403-V406 PolarHBondContact O-N 2.83Å; Y403-V406 VanDerWaalsContact O-N 3.08Å; V406-A408 VanDerWaalsContact C-N 3.3Å; V406-A408 PolarHBondContact O-N 2.9Å; V406-Y409 PolarHBondContact O-N 2.8Å; V406-L410 HydrophobicContact CG1-CD1 3.95Å; V406-L410 HydrophobicContact CG1-CG 4.45Å; V406-L410 WeakPolarHBondContact O-CG 3.24Å; V406-L410 PolarHBondContact O-N 3.01Å; V406-Y449 WeakPolarHBondContact CG1-OH 3.47Å
407	E	36.7	Very low	33.9	Very low	91 Å²	91	89.2 Å²	89.2	43%	0.425	50%	0.503	S	S	.	.	H	α-helix	trans	-61.5	-38.8	173.3	-78.4	-146.4	97.3	0	0	112.4	Y409 L410 R411	E407-Y409 VanDerWaalsContact C-N 3.29Å; E407-Y409 PolarHBondContact O-N 2.85Å; E407-L410 PolarHBondContact O-N 2.71Å; E407-R411 VanDerWaalsContact O-CB 3.27Å; E407-R411 WeakPolarHBondContact O-CB 3.44Å; E407-R411 WeakPolarHBondContact O-CG 3.39Å; E407-R411 PolarHBondContact O-N 3.08Å; E407-R411 IonicContact OE1-CZ 3.57Å; E407-R411 IonicContact OE1-NE 3.72Å; E407-R411 PolarHBondContact OE1-NE 3.14Å; E407-R411 IonicContact OE1-NH2 3.93Å; E407-R411 PolarHBondContact OE1-NH2 2.87Å; E407-R411 IonicContact OE2-CZ 1.94Å; E407-R411 IonicContact OE2-NH2 2.65Å; E407-R411 PolarHBondContact OE2-NH2 2.87Å
408	A	32.3	Very low	34	Very low	64 Å²	64	90.9 Å²	90.9	53%	0.529	52%	0.52	S	S	.	.	H	α-helix	trans	-62	-38.6	176.5	0	0	0	0	0	111.9	T404 S405 V406 S412	T404-A408 PolarHBondContact O-N 2.86Å; S405-A408 PolarHBondContact O-N 2.86Å; V406-A408 VanDerWaalsContact C-N 3.3Å; V406-A408 PolarHBondContact O-N 2.9Å; A408-S412 PolarHBondContact O-N 3.27Å
409	Y	34.5	Very low	34	Very low	138 Å²	138	92.3 Å²	92.3	54%	0.541	54%	0.541	S	S	.	.	H	α-helix	trans	-69.9	-47.5	175.1	-177.2	-111.3	0	0	0	112.5	S405 V406 E407 S412 L413	S405-Y409 PolarHBondContact O-N 2.8Å; S405-Y409 VanDerWaalsContact O-N 3.08Å; V406-Y409 PolarHBondContact O-N 2.8Å; E407-Y409 VanDerWaalsContact C-N 3.29Å; E407-Y409 PolarHBondContact O-N 2.85Å; Y409-S412 WeakPolarHBondContact O-CB 3.49Å; Y409-S412 PolarHBondContact O-N 2.75Å; Y409-S412 VanDerWaalsContact O-N 3.09Å; Y409-S412 PolarHBondContact O-OG 2.85Å; Y409-L413 HydrophobicContact CD1-CD1 4.04Å; Y409-L413 HydrophobicContact CE1-CD1 3.61Å; Y409-L413 PolarHBondContact O-N 3.15Å
410	L	37	Very low	33.8	Very low	56 Å²	56	88.5 Å²	88.5	29%	0.293	55%	0.55	S	S	.	*	H	α-helix	trans	-64.5	-42.4	179.2	-68.2	173.9	0	0	0	112.2	L367 V406 E407 S412 L413 D414	L367-L410 HydrophobicContact CD1-CD1 4.47Å; V406-L410 HydrophobicContact CG1-CD1 3.95Å; V406-L410 HydrophobicContact CG1-CG 4.45Å; V406-L410 WeakPolarHBondContact O-CG 3.24Å; V406-L410 PolarHBondContact O-N 3.01Å; E407-L410 PolarHBondContact O-N 2.71Å; L410-S412 PolarHBondContact O-N 2.82Å; L410-L413 HydrophobicContact CD2-CD1 4.47Å; L410-L413 WeakPolarHBondContact O-CB 3.45Å; L410-L413 PolarHBondContact O-N 2.75Å; L410-D414 PolarHBondContact O-N 2.98Å
411	R	38.4	Very low	33.6	Very low	140 Å²	140	89.7 Å²	89.7	53%	0.528	57%	0.567	S	S	.	*	H	α-helix	trans	-63.8	-25.6	173.6	-67	173.5	-170.4	174.8	5.5	112.5	E407 L413 S415	E407-R411 VanDerWaalsContact O-CB 3.27Å; E407-R411 WeakPolarHBondContact O-CB 3.44Å; E407-R411 WeakPolarHBondContact O-CG 3.39Å; E407-R411 PolarHBondContact O-N 3.08Å; E407-R411 IonicContact OE1-CZ 3.57Å; E407-R411 IonicContact OE1-NE 3.72Å; E407-R411 PolarHBondContact OE1-NE 3.14Å; E407-R411 IonicContact OE1-NH2 3.93Å; E407-R411 PolarHBondContact OE1-NH2 2.87Å; E407-R411 IonicContact OE2-CZ 1.94Å; E407-R411 IonicContact OE2-NH2 2.65Å; E407-R411 PolarHBondContact OE2-NH2 2.87Å; R411-L413 VanDerWaalsContact C-N 3.34Å; R411-S415 WeakPolarHBondContact O-CB 3.39Å; R411-S415 PolarHBondContact O-N 2.88Å; R411-S415 PolarHBondContact O-OG 3.23Å
412	S	37.2	Very low	33.6	Very low	73 Å²	73	91.7 Å²	91.7	51%	0.51	58%	0.578	S	S	.	*	H	α-helix	trans	-73.7	-23.8	171.9	82.2	0	0	0	0	113.6	A408 Y409 L410	A408-S412 PolarHBondContact O-N 3.27Å; Y409-S412 WeakPolarHBondContact O-CB 3.49Å; Y409-S412 PolarHBondContact O-N 2.75Å; Y409-S412 VanDerWaalsContact O-N 3.09Å; Y409-S412 PolarHBondContact O-OG 2.85Å; L410-S412 PolarHBondContact O-N 2.82Å
413	L	35.6	Very low	33.1	Very low	80 Å²	80	94.1 Å²	94.1	42%	0.419	60%	0.601	S	S	.	*	H	α-helix	trans	-85.1	-47.7	176	-74.8	160.8	0	0	0	112.1	Y409 L410 R411 S415 S416	Y409-L413 HydrophobicContact CD1-CD1 4.04Å; Y409-L413 HydrophobicContact CE1-CD1 3.61Å; Y409-L413 PolarHBondContact O-N 3.15Å; L410-L413 HydrophobicContact CD2-CD1 4.47Å; L410-L413 WeakPolarHBondContact O-CB 3.45Å; L410-L413 PolarHBondContact O-N 2.75Å; R411-L413 VanDerWaalsContact C-N 3.34Å; L413-S415 PolarHBondContact O-N 2.81Å; L413-S416 WeakPolarHBondContact O-CB 3.26Å; L413-S416 PolarHBondContact O-N 2.84Å; L413-S416 VanDerWaalsContact O-N 3.11Å; L413-S416 PolarHBondContact O-OG 2.93Å
414	D	35.8	Very low	32.7	Very low	129 Å²	129	100.6 Å²	100.6	69%	0.69	63%	0.632	S	S	*	*	H	α-helix	trans	-69	-17.3	-179.2	-71.3	-41.2	0	0	0	113	L410 S416	L410-D414 PolarHBondContact O-N 2.98Å; D414-S416 PolarHBondContact O-N 2.78Å; D414-S416 VanDerWaalsContact O-N 3.13Å
415	S	34.6	Very low	32.5	Very low	106 Å²	106	105.5 Å²	105.5	74%	0.741	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-3.8	170.3	-65.1	0	0	0	0	114.5	R411 L413	R411-S415 WeakPolarHBondContact O-CB 3.39Å; R411-S415 PolarHBondContact O-N 2.88Å; R411-S415 PolarHBondContact O-OG 3.23Å; L413-S415 PolarHBondContact O-N 2.81Å
416	S	32.7	Very low	32.2	Very low	85 Å²	85	108.2 Å²	108.2	59%	0.594	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	0.2	-172.1	89.4	0	0	0	0	116.3	L413 D414	L413-S416 WeakPolarHBondContact O-CB 3.26Å; L413-S416 PolarHBondContact O-N 2.84Å; L413-S416 VanDerWaalsContact O-N 3.11Å; L413-S416 PolarHBondContact O-OG 2.93Å; D414-S416 PolarHBondContact O-N 2.78Å; D414-S416 VanDerWaalsContact O-N 3.13Å
417	N	30	Very low	31.8	Very low	147 Å²	147	114.4 Å²	114.4	79%	0.786	68%	0.683	S	S	*	*			trans	-121.7	64.9	-172.2	-80.1	-67.1	0	0	0	113.3
418	G	29.1	Very low	31.3	Very low	76 Å²	76	115.1 Å²	115.1	78%	0.784	69%	0.693	S	S	*	*	S	Bend	trans	-147.4	64.8	-174.4	0	0	0	0	0	115.6
419	G	26.7	Very low	31	Very low	89 Å²	89	117.8 Å²	117.8	92%	0.918	71%	0.705	S	S	*	*			trans	49.2	83.3	156.1	0	0	0	0	0	119.3
420	G	28	Very low	30.6	Very low	77 Å²	77	120.4 Å²	120.4	79%	0.794	72%	0.723	S	S	*	*			trans	-170.7	136	166.5	0	0	0	0	0	112.5
421	S	28	Very low	30.2	Very low	128 Å²	128	126.1 Å²	126.1	90%	0.895	75%	0.752	S	S	*	*			trans	-75.4	147.5	-178.4	-146.2	0	0	0	0	111.7
422	P	33.2	Very low	29.5	Very low	114 Å²	114	124.2 Å²	124.2	74%	0.74	76%	0.76	S	S	*	*			trans	-92.8	145.2	-157.5	34.9	-35.5	0	0	0	114.9
423	S	26.2	Very low	29	Very low	121 Å²	121	128.4 Å²	128.4	85%	0.846	77%	0.772	S	S	*	*			trans	-162.1	120	155.7	-87.7	0	0	0	0	113.9
424	Q	28.2	Very low	28.7	Very low	175 Å²	175	133.1 Å²	133.1	82%	0.818	80%	0.796	S	S	*	*			trans	30.7	108.2	153.4	-59.9	-176.1	-0.1	0	0	120.2
425	K	28.1	Very low	28.2	Very low	217 Å²	217	133.1 Å²	133.1	94%	0.943	79%	0.792	S	S	*	*			trans	-136.4	133.7	135.6	-119.3	175.9	-177.2	175.9	0	109.2
426	I	29.2	Very low	27.7	Very low	132 Å²	132	137 Å²	137	68%	0.677	80%	0.799	S	S	*	*			trans	-114.1	134.4	-165.7	-62.4	169	0	0	0	110.4	T428	I426-T428 HydrophobicContact CG2-CG2 4.31Å
427	L	27.4	Very low	27.2	Very low	165 Å²	165	136.2 Å²	136.2	86%	0.864	80%	0.804	S	S	*	*			trans	-167.8	69.7	161.9	-99.3	150.5	0	0	0	106.7
428	T	25.3	Very low	26.9	Very low	105 Å²	105	136.5 Å²	136.5	64%	0.644	81%	0.806	S	S	*	*				91.6	121.7	92.6	46.4	0	0	0	0	113.1	I426	I426-T428 HydrophobicContact CG2-CG2 4.31Å
429	P	26.9	Very low	26.7	Very low	121 Å²	121	142.8 Å²	142.8	79%	0.786	81%	0.812	S	S	*	*			trans	-96	113.3	-171.7	35.2	-32.3	0	0	0	113.9
430	E	25.8	Very low	26.5	Very low	193 Å²	193	146 Å²	146	90%	0.902	81%	0.807	S	S	*	*			trans	-122.3	73	167.9	-74	-170.7	124.7	0	0	110.5
431	L	28	Very low	26.4	Very low	175 Å²	175	147.5 Å²	147.5	92%	0.916	81%	0.805	S	S	*	*			trans	-150	33.9	178.5	-121.2	142.2	0	0	0	113.1
432	S	24.5	Very low	26.5	Very low	100 Å²	100	144 Å²	144	70%	0.699	77%	0.774	S	S	*	*	S	Bend	trans	-151	33.6	-173.6	52.2	0	0	0	0	114.3
433	Q	25.7	Very low	26.5	Very low	162 Å²	162	141.7 Å²	141.7	76%	0.757	76%	0.756	S	S	*	*			trans	-155.3	76.3	174.1	-130.6	159.7	101.9	0	0	114.2
434	L	28.8	Very low	27	Very low	178 Å²	178	138.1 Å²	138.1	93%	0.932	73%	0.729	S	S	*	*			trans	-139.9	104.5	163.6	-95.7	168.8	0	0	0	108.2
435	Q	25.3	Very low	27.1	Very low	129 Å²	129	137.3 Å²	137.3	60%	0.603	73%	0.725	S	S	*	*			trans	-88.1	131.5	-178.3	-72.6	-175.7	-85.9	0	0	112
436	Q	23.9	Very low	27.3	Very low	187 Å²	187	128.2 Å²	128.2	87%	0.874	69%	0.688	S	S	*	*			trans	18	109.4	150.9	-70.7	157	-54.2	0	0	118
437	G	23.3	Very low	27.6	Very low	69 Å²	69	128.1 Å²	128.1	71%	0.711	69%	0.688	S	S	*	*			trans	-161.9	83.2	168.2	0	0	0	0	0	111.1	F439	G437-F439 PolarHBondContact O-N 2.88Å
438	D	23.7	Very low	28.2	Very low	153 Å²	153	126.8 Å²	126.8	82%	0.818	68%	0.677	S	S	*	*	S	Bend	trans	24.9	80.3	160.1	-55.6	-26.2	0	0	0	119.5
439	F	24.3	Very low	29.1	Very low	208 Å²	208	124.5 Å²	124.5	91%	0.912	66%	0.657	S	S	*	*			trans	-161.4	79.8	144.9	-93	-61.4	0	0	0	110.5	G437 S441	G437-F439 PolarHBondContact O-N 2.88Å; F439-S441 VanDerWaalsContact C-N 3.33Å; F439-S441 PolarHBondContact O-N 2.92Å
440	I	22.7	Very low	29.7	Very low	157 Å²	157	122.7 Å²	122.7	81%	0.805	64%	0.644	S	S	*	*			trans	-78.3	84.4	175.6	-51.4	-179.1	0	0	0	109.2	E442	I440-E442 HydrophobicContact CG2-CG 4.05Å; I440-E442 PolarHBondContact O-N 3.09Å
441	S	26.3	Very low	30.2	Very low	108 Å²	108	116.5 Å²	116.5	76%	0.755	62%	0.617	S	S	*	*			trans	-73	73.4	169.5	-175.8	0	0	0	0	110.6	F439 D443	F439-S441 VanDerWaalsContact C-N 3.33Å; F439-S441 PolarHBondContact O-N 2.92Å; S441-D443 VanDerWaalsContact C-N 3.32Å; S441-D443 PolarHBondContact O-N 3.48Å
442	E	29	Very low	31.3	Very low	55 Å²	55	110 Å²	110	26%	0.257	59%	0.585	S	S	.	*			trans	-49.2	85.4	164.7	-74.7	175.6	111.8	0	0	112.5	I440 T468 K470 Y471	I440-E442 HydrophobicContact CG2-CG 4.05Å; I440-E442 PolarHBondContact O-N 3.09Å; E442-T468 VanDerWaalsContact OE1-CG2 3.25Å; E442-T468 WeakPolarHBondContact OE1-CG2 3.31Å; E442-T468 PolarHBondContact OE1-OG1 2.75Å; E442-K470 PolarHBondContact O-NZ 3.37Å; E442-K470 VanDerWaalsContact OE2-CD 3.25Å; E442-K470 WeakPolarHBondContact OE2-CD 3.47Å; E442-K470 WeakPolarHBondContact OE2-CE 3.41Å; E442-K470 IonicContact OE2-NZ 3.34Å; E442-K470 PolarHBondContact OE2-NZ 2.89Å; E442-Y471 WeakPolarHBondContact OE1-CE2 3.43Å
443	D	33.3	Very low	32.2	Very low	66 Å²	66	114 Å²	114	35%	0.353	59%	0.59	S	S	.	*			trans	-150.6	112.2	158.2	-118	-25.9	0	0	0	108.6	W374 S441 Q445	W374-D443 PolarHBondContact NE1-OD1 2.86Å; S441-D443 VanDerWaalsContact C-N 3.32Å; S441-D443 PolarHBondContact O-N 3.48Å; D443-Q445 PolarHBondContact O-N 3.08Å
444	V	36.4	Very low	33.5	Very low	45 Å²	45	114.5 Å²	114.5	27%	0.273	59%	0.592	S	S	.	*			trans	-78.8	123	-159.8	177.5	0	0	0	0	112.5	P446 L462 I463 I464	V444-P446 VanDerWaalsContact O-CD 3.24Å; V444-P446 WeakPolarHBondContact O-CD 3.42Å; V444-L462 HydrophobicContact CB-CD1 3.84Å; V444-L462 HydrophobicContact CG1-CD1 3.54Å; V444-L462 HydrophobicContact CG1-CG 4.21Å; V444-I463 WeakPolarHBondContact CG1-O 3.32Å; V444-I464 HydrophobicContact CG2-CB 4.23Å; V444-I464 HydrophobicContact CG2-CG1 3.94Å; V444-I464 HydrophobicContact CG2-CG2 4.16Å
445	Q	31.7	Very low	34.7	Very low	159 Å²	159	112.5 Å²	112.5	74%	0.743	58%	0.576	S	S	*	*			trans	-92	112.3	166.4	-67.8	-174.2	-8.3	0	0	111.7	D443	D443-Q445 PolarHBondContact O-N 3.08Å
446	P	32.7	Very low	36.7	Very low	25 Å²	25	110.6 Å²	110.6	16%	0.162	57%	0.569	C	S	.	*			trans	-98.3	77.7	160.4	38.9	-33.7	0	0	0	109	W372 V444 H448 N460 T461 L462	W372-P446 HydrophobicContact CB-CG 4.26Å; W372-P446 HydrophobicContact CG-CG 4.08Å; V444-P446 VanDerWaalsContact O-CD 3.24Å; V444-P446 WeakPolarHBondContact O-CD 3.42Å; P446-H448 PolarHBondContact O-N 2.82Å; P446-N460 VanDerWaalsContact CB-OD1 3.25Å; P446-N460 WeakPolarHBondContact CB-OD1 3.25Å; P446-N460 WeakPolarHBondContact CG-OD1 3.22Å; P446-N460 PolarHBondContact O-ND2 3.38Å; P446-T461 WeakPolarHBondContact CB-O 3.42Å; P446-L462 HydrophobicContact CB-CD1 4.36Å; P446-L462 HydrophobicContact CG-CD1 3.64Å
447	L	35.5	Very low	39.2	Very low	131 Å²	131	104.4 Å²	104.4	69%	0.686	54%	0.541	S	S	*	.			trans	-70.2	16.6	179	-124.2	161.2	0	0	0	113.6
448	H	39.3	Very low	41.6	Very low	137 Å²	137	101.1 Å²	101.1	63%	0.634	51%	0.507	S	S	*	.			trans	-128.8	101.7	-173.6	-61.3	93.7	0	0	0	109.4	P446	P446-H448 PolarHBondContact O-N 2.82Å
449	Y	43.4	Very low	44	Very low	56 Å²	56	94.8 Å²	94.8	22%	0.22	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	136.2	151.2	62.4	-84.4	0	0	0	107.9	V406 L458 V459	V406-Y449 WeakPolarHBondContact CG1-OH 3.47Å; Y449-L458 HydrophobicContact CD2-CD2 3.8Å; Y449-L458 HydrophobicContact CE2-CD2 4.16Å; Y449-V459 CarbonylContact C-O 3.48Å; Y449-V459 WeakPolarHBondContact CA-O 3.38Å
450	T	39.3	Very low	46.4	Very low	84 Å²	84	85 Å²	85	52%	0.515	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.1	169	42.7	0	0	0	0	109.5	T452 V459	T450-T452 PolarHBondContact O-N 3.11Å; T450-V459 PolarHBondContact N-O 3.22Å; T450-V459 PolarHBondContact O-N 3.48Å
451	L	36.7	Very low	48.6	Very low	62 Å²	62	79.5 Å²	79.5	33%	0.325	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	106.9	162.4	178	69.5	0	0	0	107.5	P363 L367 K453	P363-L451 HydrophobicContact CB-CD1 4.16Å; P363-L451 HydrophobicContact CG-CD1 4.2Å; L367-L451 HydrophobicContact CD1-CD2 4.08Å; L367-L451 HydrophobicContact CD2-CD1 3.99Å; L367-L451 HydrophobicContact CD2-CD2 4.32Å; L451-K453 HydrophobicContact CD2-CG 4.47Å; L451-K453 PolarHBondContact O-N 3.16Å
452	T	51.1	Low	50.8	Low	40 Å²	40	74.4 Å²	74.4	25%	0.245	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	92.1	173	52.8	0	0	0	0	109	T450 E454 K455 D456 Q457 V459	T450-T452 PolarHBondContact O-N 3.11Å; T452-E454 PolarHBondContact O-N 2.78Å; T452-K455 PolarHBondContact O-N 3.34Å; T452-D456 PolarHBondContact O-N 2.87Å; T452-Q457 PolarHBondContact N-O 2.87Å; T452-Q457 VanDerWaalsContact N-O 3.12Å; T452-Q457 PolarHBondContact OG1-O 2.75Å; T452-V459 HydrophobicContact CG2-CB 4.35Å; T452-V459 HydrophobicContact CG2-CG2 3.69Å
453	K	43.9	Very low	52.7	Low	184 Å²	184	74.4 Å²	74.4	80%	0.8	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-27.1	-178.6	-69.9	-169.3	175.3	-172.6	0	113.8	L451 K455	L451-K453 HydrophobicContact CD2-CG 4.47Å; L451-K453 PolarHBondContact O-N 3.16Å; K453-K455 VanDerWaalsContact C-N 3.3Å; K453-K455 PolarHBondContact O-N 2.95Å
454	E	52.1	Low	54.3	Low	171 Å²	171	71.4 Å²	71.4	80%	0.799	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-16.6	176.6	-59.8	179	163.7	0	0	115.2	T452	T452-E454 PolarHBondContact O-N 2.78Å
455	K	54.6	Low	55.6	Low	137 Å²	137	75.5 Å²	75.5	60%	0.596	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.2	-3.8	-166.5	-63.6	-176.5	-177.6	173.8	0	115.7	T452 K453 Q457	T452-K455 PolarHBondContact O-N 3.34Å; K453-K455 VanDerWaalsContact C-N 3.3Å; K453-K455 PolarHBondContact O-N 2.95Å; K455-Q457 HydrophobicContact CB-CG 3.85Å; K455-Q457 WeakPolarHBondContact O-CG 3.31Å
456	D	67.6	Low	57.3	Low	88 Å²	88	76.4 Å²	76.4	47%	0.471	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	59.6	-174.9	-159.7	41.3	0	0	0	113.6	S361 P363 T452	S361-D456 PolarHBondContact OG-O 2.87Å; P363-D456 WeakPolarHBondContact CD-OD2 3.07Å; P363-D456 VanDerWaalsContact CG-OD1 3.32Å; P363-D456 WeakPolarHBondContact CG-OD1 3.49Å; T452-D456 PolarHBondContact O-N 2.87Å
457	Q	75.7	Confident	59	Low	58 Å²	58	75.2 Å²	75.2	27%	0.271	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	143.2	-177.7	-42	-162.5	-27.9	0	0	111	S360 T452 K455 V459	S360-Q457 CarbonylContact O-C 3.39Å; S360-Q457 VanDerWaalsContact O-CA 3.25Å; S360-Q457 WeakPolarHBondContact O-CA 3.38Å; S360-Q457 WeakPolarHBondContact O-CB 3.21Å; T452-Q457 PolarHBondContact N-O 2.87Å; T452-Q457 VanDerWaalsContact N-O 3.12Å; T452-Q457 PolarHBondContact OG1-O 2.75Å; K455-Q457 HydrophobicContact CB-CG 3.85Å; K455-Q457 WeakPolarHBondContact O-CG 3.31Å; Q457-V459 HydrophobicContact CB-CG2 4.31Å
458	L	74.6	Confident	60.5	Low	0 Å²	0	70.7 Å²	70.7	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	133.7	158.8	-60.9	172.3	0	0	0	108.1	P334 V359 S360 P363 G368 L370 Y449	P334-L458 HydrophobicContact CB-CD1 4.22Å; P334-L458 HydrophobicContact CG-CD1 4.41Å; V359-L458 CarbonylContact C-O 3.53Å; V359-L458 WeakPolarHBondContact CA-O 3.38Å; S360-L458 PolarHBondContact N-O 3.38Å; S360-L458 PolarHBondContact O-N 2.76Å; P363-L458 HydrophobicContact CB-CD1 4.44Å; P363-L458 HydrophobicContact CB-CD2 3.94Å; P363-L458 HydrophobicContact CB-CG 3.7Å; G368-L458 WeakPolarHBondContact O-CD1 3.18Å; G368-L458 WeakPolarHBondContact O-CD2 3.27Å; L370-L458 HydrophobicContact CD1-CB 3.66Å; L370-L458 VanDerWaalsContact CD1-O 3.29Å; L370-L458 WeakPolarHBondContact CD1-O 3.49Å; L370-L458 HydrophobicContact CG-CB 3.96Å; L370-L458 HydrophobicContact CG-CD1 4.45Å; Y449-L458 HydrophobicContact CD2-CD2 3.8Å; Y449-L458 HydrophobicContact CE2-CD2 4.16Å
459	V	73.9	Confident	61.6	Low	20 Å²	20	70.3 Å²	70.3	12%	0.121	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	121	176.4	-177.3	0	0	0	0	110	V357 C358 V359 Y449 T450 T452 Q457	V357-V459 HydrophobicContact CG1-CG1 3.75Å; C358-V459 CarbonylContact O-C 3.51Å; C358-V459 WeakPolarHBondContact O-CA 3.28Å; V359-V459 HydrophobicContact CG1-CG1 4.17Å; V359-V459 HydrophobicContact CG1-CG2 4.04Å; Y449-V459 CarbonylContact C-O 3.48Å; Y449-V459 WeakPolarHBondContact CA-O 3.38Å; T450-V459 PolarHBondContact N-O 3.22Å; T450-V459 PolarHBondContact O-N 3.48Å; T452-V459 HydrophobicContact CG2-CB 4.35Å; T452-V459 HydrophobicContact CG2-CG2 3.69Å; Q457-V459 HydrophobicContact CB-CG2 4.31Å
460	N	74.7	Confident	62.4	Low	3 Å²	3	72.8 Å²	72.8	2%	0.016	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	128.8	172.6	-176	-36.1	0	0	0	109.7	C358 L370 W372 P446	C358-N460 PolarHBondContact N-O 3.4Å; C358-N460 PolarHBondContact O-N 3.06Å; L370-N460 HydrophobicContact CB-CB 3.66Å; L370-N460 HydrophobicContact CD1-CB 4.34Å; L370-N460 PolarHBondContact O-ND2 3.31Å; W372-N460 VanDerWaalsContact CD1-OD1 3.23Å; W372-N460 PolarHBondContact NE1-OD1 2.64Å; P446-N460 VanDerWaalsContact CB-OD1 3.25Å; P446-N460 WeakPolarHBondContact CB-OD1 3.25Å; P446-N460 WeakPolarHBondContact CG-OD1 3.22Å; P446-N460 PolarHBondContact O-ND2 3.38Å
461	T	69.6	Low	63.8	Low	40 Å²	40	68.9 Å²	68.9	25%	0.245	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122	179	-58.6	0	0	0	0	111.6	R355 A356 V357 P446 I463	R355-T461 HydrophobicContact CG-CG2 4.31Å; A356-T461 CarbonylContact O-C 3.58Å; A356-T461 WeakPolarHBondContact O-CA 3.36Å; V357-T461 HydrophobicContact CG2-CG2 4.13Å; P446-T461 WeakPolarHBondContact CB-O 3.42Å; T461-I463 HydrophobicContact CG2-CD1 4.44Å; T461-I463 HydrophobicContact CG2-CG1 4.03Å
462	L	71.1	Confident	65.3	Low	1 Å²	1	70 Å²	70	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	134.9	168.9	-167.5	78.5	0	0	0	110.4	L354 A356 W372 V444 P446 L476	L354-L462 HydrophobicContact CD2-CD2 4.4Å; A356-L462 PolarHBondContact N-O 3.47Å; A356-L462 PolarHBondContact O-N 2.9Å; W372-L462 HydrophobicContact CB-CD1 4.25Å; W372-L462 HydrophobicContact CD2-CB 4.02Å; W372-L462 HydrophobicContact CD2-CD2 4.46Å; W372-L462 HydrophobicContact CE3-CD2 4.39Å; W372-L462 HydrophobicContact CG-CB 4.3Å; W372-L462 HydrophobicContact CG-CD1 4.22Å; W372-L462 HydrophobicContact CZ2-CB 4.09Å; V444-L462 HydrophobicContact CB-CD1 3.84Å; V444-L462 HydrophobicContact CG1-CD1 3.54Å; V444-L462 HydrophobicContact CG1-CG 4.21Å; P446-L462 HydrophobicContact CB-CD1 4.36Å; P446-L462 HydrophobicContact CG-CD1 3.64Å; L462-L476 HydrophobicContact CD2-CD1 3.67Å; L462-L476 HydrophobicContact CD2-CD2 3.45Å; L462-L476 VanDerWaalsContact CD2-CD2 3.45Å; L462-L476 HydrophobicContact CD2-CG 4.18Å
463	I	68.7	Low	65.9	Low	56 Å²	56	69.9 Å²	69.9	29%	0.287	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	114.9	171.1	-54.6	-177.4	0	0	0	109.6	Q353 L354 R355 V444 T461	Q353-I463 HydrophobicContact CG-CG2 4.02Å; Q353-I463 VanDerWaalsContact NE2-CG2 3.3Å; L354-I463 WeakPolarHBondContact O-CA 3.46Å; R355-I463 HydrophobicContact CG-CG1 4.3Å; V444-I463 WeakPolarHBondContact CG1-O 3.32Å; T461-I463 HydrophobicContact CG2-CD1 4.44Å; T461-I463 HydrophobicContact CG2-CG1 4.03Å
464	I	66.8	Low	66.9	Low	3 Å²	3	61.3 Å²	61.3	2%	0.015	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	113.8	167.4	-42.7	171.5	0	0	0	106.6	Q353 L354 W374 V444 R466 V467 Y471	Q353-I464 CarbonylContact C-O 3.26Å; Q353-I464 WeakPolarHBondContact CA-O 3.43Å; Q353-I464 WeakPolarHBondContact CG-O 3.38Å; L354-I464 HydrophobicContact CB-CB 4.18Å; L354-I464 HydrophobicContact CB-CD1 4.05Å; L354-I464 HydrophobicContact CB-CG1 4.23Å; L354-I464 HydrophobicContact CD1-CD1 3.98Å; L354-I464 HydrophobicContact CD2-CD1 3.91Å; L354-I464 HydrophobicContact CD2-CG1 4.04Å; L354-I464 HydrophobicContact CG-CD1 4.21Å; L354-I464 PolarHBondContact N-O 2.88Å; L354-I464 PolarHBondContact O-N 2.89Å; W374-I464 HydrophobicContact CH2-CD1 3.66Å; W374-I464 HydrophobicContact CZ2-CD1 3.48Å; W374-I464 VanDerWaalsContact CZ2-CD1 3.48Å; W374-I464 HydrophobicContact CZ2-CG1 4.45Å; V444-I464 HydrophobicContact CG2-CB 4.23Å; V444-I464 HydrophobicContact CG2-CG1 3.94Å; V444-I464 HydrophobicContact CG2-CG2 4.16Å; I464-R466 VanDerWaalsContact C-N 3.28Å; I464-R466 PolarHBondContact O-N 2.92Å; I464-V467 HydrophobicContact CB-CG2 4.16Å; I464-V467 HydrophobicContact CD1-CG2 4.19Å; I464-V467 HydrophobicContact CG2-CG2 4.2Å; I464-Y471 HydrophobicContact CG2-CE2 4.33Å
465	Q	64	Low	67.8	Low	130 Å²	130	56.9 Å²	56.9	61%	0.607	27%	0.265	S	S	*	.	S	Bend	trans	-63.8	-33.8	-175.3	-67.8	-65.8	-22.2	0	0	113
466	R	67.7	Low	68.8	Low	178 Å²	178	50.4 Å²	50.4	67%	0.672	24%	0.237	S	C	*	.			trans	-145.8	117.1	177.7	-57	-174.6	81.8	176.1	2.1	108.8	E352 I464 T468	E352-R466 CarbonylContact O-C 3.51Å; E352-R466 WeakPolarHBondContact O-CA 3.2Å; I464-R466 VanDerWaalsContact C-N 3.28Å; I464-R466 PolarHBondContact O-N 2.92Å; R466-T468 PolarHBondContact O-N 2.92Å
467	V	68.3	Low	69.2	Low	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.217	C	C	.	.			trans	-87.6	104.8	174.4	-176.2	0	0	0	0	108.1	D350 G351 E352 L354 I464 Y471 I494 V496	D350-V467 WeakPolarHBondContact CA-O 3.13Å; G351-V467 PolarHBondContact N-O 2.7Å; E352-V467 PolarHBondContact O-N 2.8Å; L354-V467 HydrophobicContact CB-CG2 3.56Å; L354-V467 HydrophobicContact CD1-CG2 4.5Å; I464-V467 HydrophobicContact CB-CG2 4.16Å; I464-V467 HydrophobicContact CD1-CG2 4.19Å; I464-V467 HydrophobicContact CG2-CG2 4.2Å; V467-Y471 HydrophobicContact CG1-CD2 3.88Å; V467-Y471 HydrophobicContact CG1-CG 4.13Å; V467-I494 HydrophobicContact CG1-CG2 4.44Å; V467-V496 HydrophobicContact CG1-CG2 3.57Å
468	T	66.5	Low	69.5	Low	37 Å²	37	44 Å²	44	23%	0.227	20%	0.204	C	C	.	.			trans	-83.3	163	177.6	58.3	0	0	0	0	112.2	D350 E442 R466 K470 Y471	D350-T468 WeakPolarHBondContact OD1-CA 3.16Å; E442-T468 VanDerWaalsContact OE1-CG2 3.25Å; E442-T468 WeakPolarHBondContact OE1-CG2 3.31Å; E442-T468 PolarHBondContact OE1-OG1 2.75Å; R466-T468 PolarHBondContact O-N 2.92Å; T468-K470 PolarHBondContact O-N 3.16Å; T468-K470 WeakPolarHBondContact OG1-CG 3.49Å; T468-Y471 WeakPolarHBondContact O-CD2 3.3Å; T468-Y471 PolarHBondContact O-N 3.16Å
469	R	63.7	Low	69.4	Low	129 Å²	129	46 Å²	46	49%	0.487	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-46.4	-27.3	177.6	61.5	-173.7	-172.2	-139.7	2.6	115.9	D350 Y471 H472 H498	D350-R469 VanDerWaalsContact OD2-CB 3.3Å; D350-R469 WeakPolarHBondContact OD2-CB 3.48Å; D350-R469 PolarHBondContact OD2-N 2.93Å; R469-Y471 PolarHBondContact O-N 2.94Å; R469-H472 WeakPolarHBondContact O-CB 3.28Å; R469-H472 PolarHBondContact O-N 3.14Å; R469-H498 HydrophobicContact CB-CB 4.26Å; R469-H498 WeakPolarHBondContact CB-CD2 3.45Å
470	K	60.2	Low	69.5	Low	107 Å²	107	45.1 Å²	45.1	47%	0.465	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-62.8	-23.8	-180	85.6	-178.7	-166.4	170.6	0	114.4	E442 T468 H472	E442-K470 PolarHBondContact O-NZ 3.37Å; E442-K470 VanDerWaalsContact OE2-CD 3.25Å; E442-K470 WeakPolarHBondContact OE2-CD 3.47Å; E442-K470 WeakPolarHBondContact OE2-CE 3.41Å; E442-K470 IonicContact OE2-NZ 3.34Å; E442-K470 PolarHBondContact OE2-NZ 2.89Å; T468-K470 PolarHBondContact O-N 3.16Å; T468-K470 WeakPolarHBondContact OG1-CG 3.49Å; K470-H472 VanDerWaalsContact C-N 3.28Å
471	Y	68.1	Low	68.7	Low	3 Å²	3	45.3 Å²	45.3	1%	0.012	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-85.7	1.8	-178.4	-64	-82.1	0	0	0	112.9	W374 E442 I464 V467 T468 R469 A473 A474	W374-Y471 AromaticContact CH2-CD1 3.76Å; W374-Y471 HydrophobicContact CH2-CD1 3.76Å; W374-Y471 HydrophobicContact CH2-CE1 4.07Å; W374-Y471 AromaticContact CZ2-CD1 3.76Å; W374-Y471 HydrophobicContact CZ2-CD1 3.76Å; W374-Y471 AromaticContact CZ2-CE1 3.57Å; W374-Y471 HydrophobicContact CZ2-CE1 3.57Å; W374-Y471 HydrophobicContact CZ3-CD1 4.38Å; E442-Y471 WeakPolarHBondContact OE1-CE2 3.43Å; I464-Y471 HydrophobicContact CG2-CE2 4.33Å; V467-Y471 HydrophobicContact CG1-CD2 3.88Å; V467-Y471 HydrophobicContact CG1-CG 4.13Å; T468-Y471 WeakPolarHBondContact O-CD2 3.3Å; T468-Y471 PolarHBondContact O-N 3.16Å; R469-Y471 PolarHBondContact O-N 2.94Å; Y471-A473 PolarHBondContact O-N 3.06Å; Y471-A474 VanDerWaalsContact O-CB 3.29Å; Y471-A474 WeakPolarHBondContact O-CB 3.26Å; Y471-A474 PolarHBondContact O-N 3.34Å; Y471-A474 VanDerWaalsContact O-N 3.1Å
472	H	68.1	Low	68.4	Low	86 Å²	86	43.4 Å²	43.4	40%	0.398	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	129.1	176.6	-167.7	108.6	0	0	0	110.5	R469 K470 A474 F495 V496	R469-H472 WeakPolarHBondContact O-CB 3.28Å; R469-H472 PolarHBondContact O-N 3.14Å; K470-H472 VanDerWaalsContact C-N 3.28Å; H472-A474 PolarHBondContact O-N 2.69Å; H472-F495 AromaticContact NE2-CD1 3.93Å; H472-V496 HydrophobicContact CB-CB 4.34Å; H472-V496 HydrophobicContact CB-CG2 4.43Å; H472-V496 PolarHBondContact CE1-O 3.21Å; H472-V496 PolarHBondContact ND1-N 2.96Å; H472-V496 PolarHBondContact ND1-O 2.6Å
473	A	65.1	Low	67.8	Low	37 Å²	37	45.7 Å²	45.7	31%	0.306	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	12.6	-175.5	0	0	0	0	0	116.6	Y471 I494	Y471-A473 PolarHBondContact O-N 3.06Å; A473-I494 VanDerWaalsContact CA-O 3.24Å; A473-I494 WeakPolarHBondContact CA-O 3.39Å; A473-I494 PolarHBondContact N-O 3.44Å
474	A	64.2	Low	67.4	Low	4 Å²	4	45.2 Å²	45.2	3%	0.033	21%	0.214	C	C	.	.			trans	-72.1	143.9	175.6	0	0	0	0	0	112.6	W374 I376 Y471 H472 T493 I494	W374-A474 HydrophobicContact CE3-CB 4.01Å; W374-A474 HydrophobicContact CZ3-CB 3.83Å; I376-A474 HydrophobicContact CG1-CB 4.36Å; Y471-A474 VanDerWaalsContact O-CB 3.29Å; Y471-A474 WeakPolarHBondContact O-CB 3.26Å; Y471-A474 PolarHBondContact O-N 3.34Å; Y471-A474 VanDerWaalsContact O-N 3.1Å; H472-A474 PolarHBondContact O-N 2.69Å; A474-T493 WeakPolarHBondContact O-CA 3Å; A474-I494 PolarHBondContact O-N 3.38Å
475	K	70.9	Confident	66.6	Low	77 Å²	77	47.6 Å²	47.6	34%	0.335	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	133.9	178.4	-172.9	-179	-179.8	178.1	0	111.3	W374 L375 S491 I492	W374-K475 CarbonylContact C-O 3.55Å; W374-K475 WeakPolarHBondContact CA-O 3.37Å; L375-K475 HydrophobicContact CB-CB 4.36Å; L375-K475 PolarHBondContact N-O 3.33Å; L375-K475 WeakPolarHBondContact O-CB 3.48Å; L375-K475 PolarHBondContact O-N 3.28Å; K475-S491 VanDerWaalsContact CE-CB 3.46Å; K475-S491 WeakPolarHBondContact CE-OG 3.2Å; K475-S491 PolarHBondContact NZ-OG 3.12Å; K475-I492 CarbonylContact C-O 3.57Å; K475-I492 WeakPolarHBondContact CA-O 3.06Å; K475-I492 VanDerWaalsContact CG-O 3.3Å; K475-I492 WeakPolarHBondContact CG-O 3.47Å
476	L	76.5	Confident	66	Low	2 Å²	2	43.3 Å²	43.3	1%	0.01	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	139.5	-177.6	-179.3	68.3	0	0	0	110.9	A356 W372 W374 L462 S491 I492	A356-L476 HydrophobicContact CB-CD2 4.4Å; W372-L476 HydrophobicContact CE3-CD1 3.98Å; W372-L476 HydrophobicContact CE3-CD2 3.86Å; W372-L476 HydrophobicContact CE3-CG 3.75Å; W372-L476 HydrophobicContact CZ3-CD2 3.65Å; W372-L476 HydrophobicContact CZ3-CG 3.87Å; W374-L476 HydrophobicContact CD2-CD1 3.92Å; W374-L476 HydrophobicContact CE3-CB 3.98Å; W374-L476 HydrophobicContact CE3-CD1 4.03Å; W374-L476 HydrophobicContact CG-CD1 4.47Å; W374-L476 HydrophobicContact CH2-CD1 4.42Å; W374-L476 HydrophobicContact CZ2-CD1 4.33Å; W374-L476 HydrophobicContact CZ3-CB 3.9Å; W374-L476 HydrophobicContact CZ3-CD1 4.27Å; L462-L476 HydrophobicContact CD2-CD1 3.67Å; L462-L476 HydrophobicContact CD2-CD2 3.45Å; L462-L476 VanDerWaalsContact CD2-CD2 3.45Å; L462-L476 HydrophobicContact CD2-CG 4.18Å; L476-S491 CarbonylContact O-C 3.44Å; L476-S491 WeakPolarHBondContact O-CA 3.35Å; L476-S491 WeakPolarHBondContact O-CB 3.38Å; L476-I492 HydrophobicContact CB-CG1 4.04Å; L476-I492 HydrophobicContact CD2-CD1 4.2Å; L476-I492 HydrophobicContact CD2-CG1 4.29Å; L476-I492 PolarHBondContact N-O 2.86Å; L476-I492 PolarHBondContact O-N 2.02Å
477	I	76	Confident	65.5	Low	10 Å²	10	37.7 Å²	37.7	5%	0.051	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	143.7	-171.8	-49	176.2	0	0	0	110	W372 R373 L375 Q489 T490	W372-I477 CarbonylContact C-O 3.53Å; W372-I477 VanDerWaalsContact CA-O 3.29Å; W372-I477 WeakPolarHBondContact CA-O 3.36Å; R373-I477 HydrophobicContact CG-CB 3.96Å; R373-I477 HydrophobicContact CG-CG2 4.3Å; R373-I477 PolarHBondContact N-O 3.19Å; R373-I477 WeakPolarHBondContact O-CA 3.1Å; R373-I477 WeakPolarHBondContact O-CB 3.38Å; R373-I477 PolarHBondContact O-N 2.72Å; L375-I477 HydrophobicContact CB-CD1 4.13Å; L375-I477 HydrophobicContact CD1-CD1 4.24Å; I477-Q489 HydrophobicContact CG2-CB 4.39Å; I477-T490 CarbonylContact C-O 3.45Å; I477-T490 VanDerWaalsContact CA-O 3.26Å; I477-T490 WeakPolarHBondContact CA-O 3.36Å; I477-T490 VanDerWaalsContact CG2-O 3.25Å; I477-T490 WeakPolarHBondContact CG2-O 3.35Å
478	C	80	Confident	65.7	Low	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	147.4	166.1	-179.9	0	0	0	0	111.4	I339 C358 F371 W372 Q489 T490	I339-C478 HydrophobicContact CD1-CB 4.01Å; I339-C478 HydrophobicContact CG1-CB 3.88Å; C358-C478 HydrophobicContact CB-CB 3.79Å; C358-C478 WeakPolarHBondContact CB-SG 3.45Å; C358-C478 WeakPolarHBondContact SG-CB 3.41Å; C358-C478 CovalentContact SG-SG 2.03Å; C358-C478 PolarHBondContact SG-SG 2.85Å; F371-C478 CarbonylContact O-C 3.59Å; F371-C478 VanDerWaalsContact O-CA 3.27Å; F371-C478 WeakPolarHBondContact O-CA 3.4Å; W372-C478 HydrophobicContact CD2-CB 4.22Å; W372-C478 HydrophobicContact CE3-CB 4Å; W372-C478 HydrophobicContact CH2-CB 4.47Å; W372-C478 HydrophobicContact CZ3-CB 4.12Å; C478-Q489 CarbonylContact O-C 3.52Å; C478-Q489 VanDerWaalsContact O-CA 3.23Å; C478-Q489 WeakPolarHBondContact O-CA 3.36Å; C478-T490 HydrophobicContact CB-CG2 4.18Å; C478-T490 PolarHBondContact N-O 3.29Å; C478-T490 PolarHBondContact O-N 3.14Å
479	E	74.5	Confident	66.2	Low	43 Å²	43	46 Å²	46	20%	0.201	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	148.4	-173.1	170.7	165.5	-121.1	0	0	112.8	L370 F371 R373 H488 Q489	L370-E479 WeakPolarHBondContact CA-O 3.34Å; F371-E479 PolarHBondContact N-O 2.65Å; F371-E479 PolarHBondContact O-N 2.93Å; R373-E479 IonicContact CZ-OE1 3.51Å; R373-E479 IonicContact CZ-OE2 2.64Å; R373-E479 VanDerWaalsContact CZ-OE2 3.28Å; R373-E479 IonicContact NE-OE1 3.57Å; R373-E479 IonicContact NE-OE2 3.19Å; R373-E479 PolarHBondContact NE-OE2 3.14Å; R373-E479 IonicContact NH2-OE1 2.69Å; R373-E479 PolarHBondContact NH2-OE1 2.91Å; R373-E479 IonicContact NH2-OE2 2.74Å; R373-E479 PolarHBondContact NH2-OE2 2.91Å; E479-H488 CarbonylContact C-O 3.53Å; E479-H488 VanDerWaalsContact CA-O 3.28Å; E479-H488 WeakPolarHBondContact CA-O 3.25Å; E479-Q489 HydrophobicContact CB-CB 4.49Å
480	T	74	Confident	67	Low	1 Å²	1	42 Å²	42	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	148.7	168.1	48.5	0	0	0	0	113	P337 G369 L370 A487 H488	P337-T480 HydrophobicContact CB-CG2 4.12Å; P337-T480 HydrophobicContact CG-CG2 4.11Å; G369-T480 WeakPolarHBondContact O-CA 3.38Å; L370-T480 HydrophobicContact CD2-CG2 3.49Å; L370-T480 VanDerWaalsContact CD2-CG2 3.49Å; T480-A487 WeakPolarHBondContact O-CA 3.47Å; T480-A487 WeakPolarHBondContact O-CB 3.21Å; T480-H488 PolarHBondContact N-O 3.35Å; T480-H488 PolarHBondContact OG1-N 2.69Å; T480-H488 PolarHBondContact OG1-O 3.05Å
481	G	59.9	Low	68	Low	7 Å²	7	39.3 Å²	39.3	7%	0.072	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	157	169.5	0	0	0	0	0	112.8	G368 G369 Y403	G368-G481 VanDerWaalsContact CA-O 3.27Å; G368-G481 WeakPolarHBondContact CA-O 3.2Å; G369-G481 PolarHBondContact N-O 3Å; G369-G481 PolarHBondContact O-N 3.48Å; Y403-G481 PolarHBondContact OH-O 3.15Å
482	H	63.2	Low	68.5	Low	1 Å²	1	40.4 Å²	40.4	1%	0.005	24%	0.242	C	C	.	.			trans	-161	151.4	179.6	-169.8	-117.1	0	0	0	110.7	T332 P334 K365 P366 Y403 V484 G485	T332-H482 PolarHBondContact O-CE1 3.05Å; T332-H482 PolarHBondContact O-NE2 3.08Å; P334-H482 HydrophobicContact CG-CB 4.15Å; K365-H482 PolarHBondContact O-NE2 2.96Å; P366-H482 PolarHBondContact O-CD2 2.83Å; P366-H482 VanDerWaalsContact O-CD2 3.31Å; P366-H482 PolarHBondContact O-NE2 3.33Å; Y403-H482 WeakPolarHBondContact OH-CA 3.29Å; Y403-H482 PolarHBondContact OH-N 2.83Å; H482-V484 VanDerWaalsContact ND1-CG2 3.34Å; H482-V484 WeakPolarHBondContact ND1-CG2 3.25Å; H482-V484 PolarHBondContact O-N 2.96Å; H482-V484 VanDerWaalsContact O-N 3.14Å; H482-G485 PolarHBondContact O-N 3.37Å; H482-G485 VanDerWaalsContact O-N 3.1Å
483	P	57.5	Low	68.8	Low	48 Å²	48	39 Å²	39	31%	0.312	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-25.8	-179.7	-27.2	36.9	0	0	0	115.3	P366 Y403	P366-P483 HydrophobicContact CG-CG 4.26Å; Y403-P483 HydrophobicContact CD1-CG 3.68Å; Y403-P483 HydrophobicContact CD2-CG 4.04Å; Y403-P483 HydrophobicContact CE1-CG 3.93Å; Y403-P483 HydrophobicContact CE2-CG 4.27Å; Y403-P483 HydrophobicContact CG-CG 3.76Å
484	V	60.4	Low	69.2	Low	46 Å²	46	37.3 Å²	37.3	28%	0.279	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	18.7	177.4	-49.2	0	0	0	0	114.8	H331 H482	H331-V484 HydrophobicContact CB-CG1 3.74Å; H482-V484 VanDerWaalsContact ND1-CG2 3.34Å; H482-V484 WeakPolarHBondContact ND1-CG2 3.25Å; H482-V484 PolarHBondContact O-N 2.96Å; H482-V484 VanDerWaalsContact O-N 3.14Å
485	G	50.8	Low	69.6	Low	53 Å²	53	41.5 Å²	41.5	55%	0.546	24%	0.243	S	C	.	.			trans	84.8	16	157.6	0	0	0	0	0	118.5	H482	H482-G485 PolarHBondContact O-N 3.37Å; H482-G485 VanDerWaalsContact O-N 3.1Å
486	S	50.9	Low	69.6	Low	40 Å²	40	38 Å²	38	28%	0.28	23%	0.228	S	C	.	.			trans	-94.4	104.7	176.6	-44.3	0	0	0	0	111.8	P333	P333-S486 WeakPolarHBondContact CB-OG 3.4Å
487	A	56.9	Low	69	Low	61 Å²	61	44.2 Å²	44.2	50%	0.504	26%	0.255	S	S	.	.			trans	-114.6	135.2	179.2	0	0	0	0	0	112.4	T480	T480-A487 WeakPolarHBondContact O-CA 3.47Å; T480-A487 WeakPolarHBondContact O-CB 3.21Å
488	H	71.4	Confident	68.2	Low	85 Å²	85	47 Å²	47	39%	0.394	27%	0.268	S	S	.	.			trans	-131.8	150.8	176.8	-60.1	-55	0	0	0	109.3	P336 P337 E479 T480	P336-H488 HydrophobicContact CB-CB 4.13Å; P337-H488 HydrophobicContact CG-CB 4.34Å; P337-H488 WeakPolarHBondContact CG-O 3.47Å; E479-H488 CarbonylContact C-O 3.53Å; E479-H488 VanDerWaalsContact CA-O 3.28Å; E479-H488 WeakPolarHBondContact CA-O 3.25Å; T480-H488 PolarHBondContact N-O 3.35Å; T480-H488 PolarHBondContact OG1-N 2.69Å; T480-H488 PolarHBondContact OG1-O 3.05Å
489	Q	78.1	Confident	67	Low	125 Å²	125	49 Å²	49	58%	0.584	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.6	157.8	-173	63.5	175.3	-11	0	0	115	I477 C478 E479	I477-Q489 HydrophobicContact CG2-CB 4.39Å; C478-Q489 CarbonylContact O-C 3.52Å; C478-Q489 VanDerWaalsContact O-CA 3.23Å; C478-Q489 WeakPolarHBondContact O-CA 3.36Å; E479-Q489 HydrophobicContact CB-CB 4.49Å
490	T	79.9	Confident	66.1	Low	47 Å²	47	48.3 Å²	48.3	29%	0.288	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	160.3	-179.5	-178.4	0	0	0	0	112	P337 I339 I477 C478	P337-T490 HydrophobicContact CB-CG2 4.27Å; P337-T490 HydrophobicContact CG-CG2 4.21Å; I339-T490 HydrophobicContact CD1-CG2 3.91Å; I339-T490 HydrophobicContact CG1-CG2 3.79Å; I477-T490 CarbonylContact C-O 3.45Å; I477-T490 VanDerWaalsContact CA-O 3.26Å; I477-T490 WeakPolarHBondContact CA-O 3.36Å; I477-T490 VanDerWaalsContact CG2-O 3.25Å; I477-T490 WeakPolarHBondContact CG2-O 3.35Å; C478-T490 HydrophobicContact CB-CG2 4.18Å; C478-T490 PolarHBondContact N-O 3.29Å; C478-T490 PolarHBondContact O-N 3.14Å
491	S	81	Confident	65.3	Low	49 Å²	49	49.2 Å²	49.2	34%	0.343	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	156.7	-169.2	68.3	0	0	0	0	118.1	K475 L476	K475-S491 VanDerWaalsContact CE-CB 3.46Å; K475-S491 WeakPolarHBondContact CE-OG 3.2Å; K475-S491 PolarHBondContact NZ-OG 3.12Å; L476-S491 CarbonylContact O-C 3.44Å; L476-S491 WeakPolarHBondContact O-CA 3.35Å; L476-S491 WeakPolarHBondContact O-CB 3.38Å
492	I	78.8	Confident	65.5	Low	26 Å²	26	54.6 Å²	54.6	13%	0.133	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	174.1	174.7	63.5	174.7	0	0	0	112.4	I339 K475 L476 I494	I339-I492 HydrophobicContact CD1-CG2 4.46Å; I339-I492 HydrophobicContact CG2-CD1 4.39Å; I339-I492 HydrophobicContact CG2-CG2 4.15Å; K475-I492 CarbonylContact C-O 3.57Å; K475-I492 WeakPolarHBondContact CA-O 3.06Å; K475-I492 VanDerWaalsContact CG-O 3.3Å; K475-I492 WeakPolarHBondContact CG-O 3.47Å; L476-I492 HydrophobicContact CB-CG1 4.04Å; L476-I492 HydrophobicContact CD2-CD1 4.2Å; L476-I492 HydrophobicContact CD2-CG1 4.29Å; L476-I492 PolarHBondContact N-O 2.86Å; L476-I492 PolarHBondContact O-N 2.02Å; I492-I494 HydrophobicContact CD1-CD1 4.18Å; I492-I494 HydrophobicContact CG1-CD1 4.42Å
493	T	75.1	Confident	66	Low	58 Å²	58	55.7 Å²	55.7	36%	0.356	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	143.1	-178.3	-55.2	0	0	0	0	111.6	H346 A474	H346-T493 WeakPolarHBondContact CB-O 3.29Å; A474-T493 WeakPolarHBondContact O-CA 3Å
494	I	73.5	Confident	67.1	Low	0 Å²	0	57 Å²	57	0%	0	33%	0.332	C	S	.	.			trans	-117.3	146.6	-166.5	-49.1	-53.8	0	0	0	112.5	H346 Y348 L354 W374 V467 A473 A474 I492	H346-I494 HydrophobicContact CB-CD1 4.22Å; Y348-I494 HydrophobicContact CD2-CG2 3.72Å; Y348-I494 HydrophobicContact CE2-CD1 4.43Å; Y348-I494 HydrophobicContact CE2-CG2 3.96Å; L354-I494 HydrophobicContact CD1-CD1 3.53Å; L354-I494 HydrophobicContact CD1-CG1 3.93Å; L354-I494 HydrophobicContact CD1-CG2 4.14Å; W374-I494 HydrophobicContact CH2-CG1 4.45Å; W374-I494 HydrophobicContact CZ3-CG1 4.22Å; V467-I494 HydrophobicContact CG1-CG2 4.44Å; A473-I494 VanDerWaalsContact CA-O 3.24Å; A473-I494 WeakPolarHBondContact CA-O 3.39Å; A473-I494 PolarHBondContact N-O 3.44Å; A474-I494 PolarHBondContact O-N 3.38Å; I492-I494 HydrophobicContact CD1-CD1 4.18Å; I492-I494 HydrophobicContact CG1-CD1 4.42Å
495	F	72.9	Confident	68.2	Low	92 Å²	92	55.4 Å²	55.4	40%	0.404	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	146.9	174.5	-60	-86.6	0	0	0	112.3	H346 V347 Y348 H472	H346-F495 PolarHBondContact O-N 2.9Å; V347-F495 HydrophobicContact CG1-CB 4.45Å; V347-F495 HydrophobicContact CG2-CB 4.27Å; V347-F495 HydrophobicContact CG2-CD2 4.39Å; Y348-F495 PolarHBondContact N-O 2.85Å; H472-F495 AromaticContact NE2-CD1 3.93Å
496	V	70.3	Confident	69.9	Low	5 Å²	5	55 Å²	55	3%	0.03	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	146.8	-173.2	-166.4	0	0	0	0	111.7	Y348 D350 V467 H472	Y348-V496 CarbonylContact O-C 3.53Å; Y348-V496 WeakPolarHBondContact O-CA 3.3Å; D350-V496 HydrophobicContact CB-CG1 4.21Å; V467-V496 HydrophobicContact CG1-CG2 3.57Å; H472-V496 HydrophobicContact CB-CB 4.34Å; H472-V496 HydrophobicContact CB-CG2 4.43Å; H472-V496 PolarHBondContact CE1-O 3.21Å; H472-V496 PolarHBondContact ND1-N 2.96Å; H472-V496 PolarHBondContact ND1-O 2.6Å
497	K	64.5	Low	71.3	Confident	132 Å²	132	54.3 Å²	54.3	57%	0.574	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.2	136	177.1	-56	-179.2	-170.8	169.6	0	112.6	Y348 L349 D350	Y348-K497 PolarHBondContact O-N 2.96Å; Y348-K497 VanDerWaalsContact O-N 3.13Å; L349-K497 HydrophobicContact CD2-CB 4.1Å; L349-K497 HydrophobicContact CD2-CD 3.93Å; L349-K497 HydrophobicContact CD2-CG 4.41Å; D350-K497 WeakPolarHBondContact CB-O 3.31Å; D350-K497 PolarHBondContact N-O 2.84Å
498	H	59	Low	72.3	Confident	67 Å²	67	55.9 Å²	55.9	31%	0.31	30%	0.302	S	S	.	.			trans	-151.3	167.9	-178.1	62.5	84.4	0	0	0	113.7	D350 R469 Y543	D350-H498 HydrophobicContact CB-CB 4.11Å; R469-H498 HydrophobicContact CB-CB 4.26Å; R469-H498 WeakPolarHBondContact CB-CD2 3.45Å; H498-Y543 AromaticContact CE1-CE1 3.92Å; H498-Y543 AromaticContact CE1-CZ 3.93Å; H498-Y543 PolarHBondContact CE1-OH 2.93Å; H498-Y543 AromaticContact ND1-CE1 3.92Å; H498-Y543 AromaticContact ND1-CZ 3.99Å; H498-Y543 PolarHBondContact ND1-OH 3.41Å; H498-Y543 VanDerWaalsContact ND1-OH 3.17Å
499	A	55.3	Low	71.9	Confident	44 Å²	44	55.5 Å²	55.5	36%	0.364	31%	0.306	S	S	.	.			trans	-92.2	166.8	-176.6	0	0	0	0	0	114.2	Y543 D609	A499-Y543 WeakPolarHBondContact O-CE1 3.5Å; A499-Y543 PolarHBondContact O-OH 2.64Å; A499-Y543 VanDerWaalsContact O-OH 3.05Å; A499-D609 HydrophobicContact CB-CB 4.3Å; A499-D609 WeakPolarHBondContact CB-OD1 3.11Å
500	P	55.9	Low	71.2	Confident	28 Å²	28	52 Å²	52	18%	0.182	30%	0.303	C	S	.	.			trans	-53.6	150.4	171.1	-29	36.8	0	0	0	116	Y543 D609 I612	P500-Y543 VanDerWaalsContact CA-CE1 3.48Å; P500-Y543 VanDerWaalsContact CA-CZ 3.49Å; P500-Y543 HydrophobicContact CB-CD1 4.13Å; P500-Y543 HydrophobicContact CB-CD2 4.21Å; P500-Y543 HydrophobicContact CB-CE1 4.4Å; P500-Y543 HydrophobicContact CB-CE2 4.47Å; P500-Y543 HydrophobicContact CB-CG 4.07Å; P500-Y543 HydrophobicContact CG-CD1 3.87Å; P500-Y543 HydrophobicContact CG-CE1 4.37Å; P500-Y543 HydrophobicContact CG-CG 4.11Å; P500-D609 WeakPolarHBondContact CD-OD2 3.41Å; P500-D609 HydrophobicContact CG-CB 4.48Å; P500-I612 HydrophobicContact CB-CD1 4.43Å
501	A	56.8	Low	70.4	Confident	20 Å²	20	53.1 Å²	53.1	17%	0.165	31%	0.313	C	S	.	.			trans	-147.6	168	176.7	0	0	0	0	0	111.9	A540	A501-A540 WeakPolarHBondContact O-CB 3.18Å
502	N	64.4	Low	70	Confident	120 Å²	120	52.5 Å²	52.5	64%	0.642	31%	0.306	S	S	*	.			trans	53	67.6	171.1	-61.9	4.4	0	0	0	114.9	A540	N502-A540 HydrophobicContact CB-CB 4.26Å
503	V	73.5	Confident	69.5	Low	24 Å²	24	54 Å²	54	15%	0.145	31%	0.314	C	S	.	.			trans	-82.2	140.1	166.5	177.1	0	0	0	0	109.7	K538 V604 I612	V503-K538 WeakPolarHBondContact CA-O 3.35Å; V503-V604 HydrophobicContact CB-CG2 4.46Å; V503-V604 HydrophobicContact CG1-CB 4.39Å; V503-V604 HydrophobicContact CG1-CG2 3.64Å; V503-V604 HydrophobicContact CG2-CB 3.83Å; V503-V604 HydrophobicContact CG2-CG1 4.13Å; V503-V604 HydrophobicContact CG2-CG2 3.91Å; V503-I612 HydrophobicContact CB-CG2 3.86Å; V503-I612 HydrophobicContact CG2-CB 3.97Å; V503-I612 HydrophobicContact CG2-CD1 4.27Å; V503-I612 HydrophobicContact CG2-CG2 3.68Å
504	T	80.2	Confident	69.2	Low	74 Å²	74	55.7 Å²	55.7	45%	0.454	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	141	-177.3	52.1	0	0	0	0	112.2	C537 K538	T504-C537 CarbonylContact O-C 3.48Å; T504-C537 WeakPolarHBondContact O-CA 3.41Å; T504-K538 PolarHBondContact N-O 3.11Å; T504-K538 VanDerWaalsContact N-O 3.08Å; T504-K538 PolarHBondContact O-N 3.28Å
505	I	84.2	Confident	68.7	Low	13 Å²	13	56 Å²	56	7%	0.067	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	144	163.9	-65.1	176.1	0	0	0	109.2	I512 F535 I536 C537 W550 C602 S614	I505-I512 HydrophobicContact CG2-CD1 3.86Å; I505-F535 HydrophobicContact CG2-CD1 4.37Å; I505-I536 CarbonylContact C-O 3.51Å; I505-I536 VanDerWaalsContact CA-O 3.24Å; I505-I536 WeakPolarHBondContact CA-O 3.29Å; I505-C537 HydrophobicContact CG1-CB 4.48Å; I505-W550 HydrophobicContact CD1-CZ3 4.18Å; I505-W550 HydrophobicContact CG1-CH2 4.47Å; I505-W550 HydrophobicContact CG1-CZ3 4.39Å; I505-W550 HydrophobicContact CG2-CH2 4.32Å; I505-W550 HydrophobicContact CG2-CZ3 4.39Å; I505-C602 HydrophobicContact CD1-CB 3.51Å; I505-C602 HydrophobicContact CG1-CB 3.69Å; I505-S614 WeakPolarHBondContact CD1-O 3.43Å
506	S	85.1	Confident	67.9	Low	46 Å²	46	56.7 Å²	56.7	32%	0.322	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	170	170.3	48.2	0	0	0	0	111.4	F535 I536	S506-F535 CarbonylContact O-C 3.19Å; S506-F535 VanDerWaalsContact O-CA 3.29Å; S506-F535 WeakPolarHBondContact O-CA 3.37Å; S506-I536 PolarHBondContact N-O 2.63Å; S506-I536 PolarHBondContact O-N 3.23Å
507	V	80.9	Confident	67.2	Low	25 Å²	25	57.1 Å²	57.1	15%	0.152	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	144.8	-179.5	156.1	0	0	0	0	109.9	T509 I512 T534 F535	V507-T509 VanDerWaalsContact CG1-N 3.32Å; V507-I512 HydrophobicContact CB-CD1 4.48Å; V507-I512 HydrophobicContact CB-CG1 4.11Å; V507-I512 HydrophobicContact CG2-CD1 3.88Å; V507-I512 HydrophobicContact CG2-CG1 3.67Å; V507-T534 CarbonylContact C-O 3.57Å; V507-T534 WeakPolarHBondContact CA-O 3.42Å; V507-T534 WeakPolarHBondContact CG1-O 3.25Å; V507-T534 WeakPolarHBondContact CG2-O 3.08Å; V507-F535 HydrophobicContact CG2-CD1 3.25Å; V507-F535 HydrophobicContact CG2-CE1 3.35Å; V507-F535 HydrophobicContact CG2-CG 3.88Å; V507-F535 HydrophobicContact CG2-CZ 4.03Å
508	E	76.7	Confident	66.4	Low	94 Å²	94	54.4 Å²	54.4	44%	0.439	34%	0.338	S	S	.	.	S	Bend	trans	-82	-27.3	176.7	-60.6	-176.8	166.6	0	0	113.2	T534 I536 R586	E508-T534 HydrophobicContact CB-CG2 4.33Å; E508-T534 VanDerWaalsContact CD-CG2 3.44Å; E508-T534 HydrophobicContact CG-CG2 3.85Å; E508-T534 PolarHBondContact N-O 2.76Å; E508-T534 VanDerWaalsContact OE2-CG2 3.28Å; E508-T534 WeakPolarHBondContact OE2-CG2 3.31Å; E508-I536 HydrophobicContact CG-CD1 3.78Å; E508-I536 HydrophobicContact CG-CG1 4.15Å; E508-R586 IonicContact OE1-CZ 3.84Å; E508-R586 IonicContact OE1-NH1 2.71Å; E508-R586 PolarHBondContact OE1-NH1 3.32Å
509	T	64.4	Low	65.9	Low	76 Å²	76	55 Å²	55	47%	0.466	36%	0.363	S	S	.	.	S	Bend	trans	-135.6	77.6	-169.8	44.3	0	0	0	0	112.5	V507 K533	V507-T509 VanDerWaalsContact CG1-N 3.32Å; T509-K533 WeakPolarHBondContact O-CD 3.26Å
510	G	62.5	Low	65.7	Low	51 Å²	51	61.5 Å²	61.5	53%	0.526	38%	0.379	S	S	.	.	S	Bend	trans	130.6	171.4	-178.1	0	0	0	0	0	111.4
511	S	63.2	Low	66.1	Low	71 Å²	71	66.6 Å²	66.6	50%	0.497	40%	0.399	S	S	.	.			trans	-82.2	160.2	165.9	49.9	0	0	0	0	111	D513	S511-D513 WeakPolarHBondContact CB-OD1 3.04Å; S511-D513 PolarHBondContact OG-OD1 3.18Å; S511-D513 PolarHBondContact OG-OD2 3.5Å
512	I	73	Confident	66.6	Low	37 Å²	37	67.2 Å²	67.2	19%	0.19	40%	0.399	C	S	.	.			trans	-103.7	115.4	151.1	-59.6	176.8	0	0	0	104.7	I505 V507 K523 V524 V616	I505-I512 HydrophobicContact CG2-CD1 3.86Å; V507-I512 HydrophobicContact CB-CD1 4.48Å; V507-I512 HydrophobicContact CB-CG1 4.11Å; V507-I512 HydrophobicContact CG2-CD1 3.88Å; V507-I512 HydrophobicContact CG2-CG1 3.67Å; I512-K523 HydrophobicContact CG2-CB 3.41Å; I512-K523 VanDerWaalsContact CG2-CB 3.41Å; I512-K523 HydrophobicContact CG2-CD 3.93Å; I512-K523 HydrophobicContact CG2-CG 3.59Å; I512-V524 WeakPolarHBondContact CA-O 3.47Å; I512-V616 HydrophobicContact CD1-CG2 4.24Å; I512-V616 HydrophobicContact CG2-CG1 4.31Å
513	D	68.6	Low	67.4	Low	57 Å²	57	65 Å²	65	31%	0.305	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	141.8	179.6	-58.2	-30.8	0	0	0	109.5	S511 D515 K523 V524	S511-D513 WeakPolarHBondContact CB-OD1 3.04Å; S511-D513 PolarHBondContact OG-OD1 3.18Å; S511-D513 PolarHBondContact OG-OD2 3.5Å; D513-D515 PolarHBondContact O-N 2.66Å; D513-K523 CarbonylContact O-C 3.55Å; D513-K523 WeakPolarHBondContact O-CA 3.36Å; D513-V524 PolarHBondContact N-O 2.89Å; D513-V524 PolarHBondContact O-N 3.11Å
514	D	67.8	Low	67.8	Low	93 Å²	93	63.9 Å²	63.9	50%	0.497	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	91.8	176.6	-72.5	-45.1	0	0	0	110.6	H516 K523	D514-H516 PolarHBondContact O-ND1 3.06Å; D514-K523 WeakPolarHBondContact OD1-CE 3.49Å; D514-K523 WeakPolarHBondContact OD1-CG 3.48Å
515	D	63.1	Low	67.8	Low	6 Å²	6	61.1 Å²	61.1	3%	0.032	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	158.4	171.4	-174	-8.5	0	0	0	110.3	D513 T517 E522 V524 R617	D513-D515 PolarHBondContact O-N 2.66Å; D515-T517 WeakPolarHBondContact OD1-CG2 3.38Å; D515-T517 PolarHBondContact OD1-N 2.97Å; D515-T517 VanDerWaalsContact OD2-CG2 3.26Å; D515-T517 WeakPolarHBondContact OD2-CG2 3.06Å; D515-E522 WeakPolarHBondContact CA-O 3.44Å; D515-E522 WeakPolarHBondContact CB-O 3.4Å; D515-E522 PolarHBondContact N-O 3.29Å; D515-E522 PolarHBondContact O-N 3.25Å; D515-E522 VanDerWaalsContact O-O 3.12Å; D515-V524 HydrophobicContact CB-CB 3.99Å; D515-V524 HydrophobicContact CB-CG2 3.42Å; D515-V524 VanDerWaalsContact CB-CG2 3.42Å; D515-R617 IonicContact OD2-CZ 2.7Å; D515-R617 IonicContact OD2-NE 2.57Å; D515-R617 IonicContact OD2-NH2 3.84Å; D515-R617 PolarHBondContact OD2-NH2 3Å
516	H	57	Low	67.5	Low	107 Å²	107	64.4 Å²	64.4	50%	0.495	37%	0.373	S	S	.	.			trans	-117.7	41.9	-176.3	-71.4	46.2	0	0	0	111.7	D514 G518 H521	D514-H516 PolarHBondContact O-ND1 3.06Å; H516-G518 PolarHBondContact O-N 3.12Å; H516-G518 VanDerWaalsContact O-N 3.16Å; H516-H521 AromaticContact CE1-CE1 3.46Å; H516-H521 PolarHBondContact CE1-CE1 3.11Å; H516-H521 VanDerWaalsContact CE1-CE1 3.46Å; H516-H521 AromaticContact CE1-ND1 3.45Å; H516-H521 PolarHBondContact CE1-ND1 3.35Å; H516-H521 AromaticContact NE2-CE1 3.19Å; H516-H521 PolarHBondContact NE2-CE1 3.24Å; H516-H521 AromaticContact NE2-ND1 3.63Å; H516-H521 AromaticContact NE2-NE2 3.75Å
517	T	55.2	Low	67	Low	14 Å²	14	63.3 Å²	63.3	9%	0.086	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-61.3	116.1	177.3	54.4	0	0	0	0	112.1	D515 G519 R617 N1476	D515-T517 WeakPolarHBondContact OD1-CG2 3.38Å; D515-T517 PolarHBondContact OD1-N 2.97Å; D515-T517 VanDerWaalsContact OD2-CG2 3.26Å; D515-T517 WeakPolarHBondContact OD2-CG2 3.06Å; T517-G519 VanDerWaalsContact C-N 3.33Å; T517-G519 PolarHBondContact O-N 3.21Å; T517-R617 VanDerWaalsContact CG2-CZ 3.49Å; T517-N1476 VanDerWaalsContact CG2-ND2 3.33Å; T517-N1476 WeakPolarHBondContact CG2-ND2 3.47Å
518	G	48.8	Very low	66.7	Low	75 Å²	75	72.3 Å²	72.3	77%	0.773	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	71.1	20.4	173.1	0	0	0	0	0	115.6	H516 R520	H516-G518 PolarHBondContact O-N 3.12Å; H516-G518 VanDerWaalsContact O-N 3.16Å; G518-R520 VanDerWaalsContact C-N 3.3Å; G518-R520 PolarHBondContact O-N 3.03Å
519	G	47.3	Very low	66.3	Low	81 Å²	81	71.3 Å²	71.3	84%	0.835	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	79.6	10.6	179.2	0	0	0	0	0	114.5	T517	T517-G519 VanDerWaalsContact C-N 3.33Å; T517-G519 PolarHBondContact O-N 3.21Å
520	R	52.3	Low	66.6	Low	180 Å²	180	70.8 Å²	70.8	68%	0.679	42%	0.416	S	S	*	.	S	Bend	trans	-108.5	139.2	169.2	-158.3	176.3	-162.6	170	3.5	108	G518 E522	G518-R520 VanDerWaalsContact C-N 3.3Å; G518-R520 PolarHBondContact O-N 3.03Å; R520-E522 HydrophobicContact CB-CG 4.2Å; R520-E522 HydrophobicContact CG-CG 4.41Å; R520-E522 PolarHBondContact O-N 3.37Å
521	H	62.7	Low	67.2	Low	134 Å²	134	71.9 Å²	71.9	62%	0.62	41%	0.407	S	S	*	.			trans	-67.7	111.9	165.8	-74.6	-102.1	0	0	0	107.7	H516	H516-H521 AromaticContact CE1-CE1 3.46Å; H516-H521 PolarHBondContact CE1-CE1 3.11Å; H516-H521 VanDerWaalsContact CE1-CE1 3.46Å; H516-H521 AromaticContact CE1-ND1 3.45Å; H516-H521 PolarHBondContact CE1-ND1 3.35Å; H516-H521 AromaticContact NE2-CE1 3.19Å; H516-H521 PolarHBondContact NE2-CE1 3.24Å; H516-H521 AromaticContact NE2-ND1 3.63Å; H516-H521 AromaticContact NE2-NE2 3.75Å
522	E	68.9	Low	68	Low	34 Å²	34	74.6 Å²	74.6	16%	0.159	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	130.3	176	-63.6	-151.7	172.8	0	0	110.3	D515 R520 Y599 R617	D515-E522 WeakPolarHBondContact CA-O 3.44Å; D515-E522 WeakPolarHBondContact CB-O 3.4Å; D515-E522 PolarHBondContact N-O 3.29Å; D515-E522 PolarHBondContact O-N 3.25Å; D515-E522 VanDerWaalsContact O-O 3.12Å; R520-E522 HydrophobicContact CB-CG 4.2Å; R520-E522 HydrophobicContact CG-CG 4.41Å; R520-E522 PolarHBondContact O-N 3.37Å; E522-Y599 WeakPolarHBondContact OE2-CE1 3.46Å; E522-Y599 PolarHBondContact OE2-OH 3.41Å; E522-R617 WeakPolarHBondContact OE2-CD 3.48Å
523	K	79.7	Confident	68.3	Low	74 Å²	74	74 Å²	74	32%	0.322	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	137	178.6	-85.2	176.4	-179.6	-168.5	0	109.8	I512 D513 D514 R615 V616 R617	I512-K523 HydrophobicContact CG2-CB 3.41Å; I512-K523 VanDerWaalsContact CG2-CB 3.41Å; I512-K523 HydrophobicContact CG2-CD 3.93Å; I512-K523 HydrophobicContact CG2-CG 3.59Å; D513-K523 CarbonylContact O-C 3.55Å; D513-K523 WeakPolarHBondContact O-CA 3.36Å; D514-K523 WeakPolarHBondContact OD1-CE 3.49Å; D514-K523 WeakPolarHBondContact OD1-CG 3.48Å; K523-R615 VanDerWaalsContact CB-O 3.22Å; K523-R615 WeakPolarHBondContact CB-O 3.41Å; K523-V616 HydrophobicContact CB-CG2 4.42Å; K523-V616 CarbonylContact O-C 3.56Å; K523-V616 WeakPolarHBondContact O-CA 3.14Å; K523-R617 PolarHBondContact O-N 3.18Å
524	V	82.6	Confident	69.1	Low	0 Å²	0	72 Å²	72	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	145.3	-171.6	164.8	0	0	0	0	111.1	I512 D513 D515 Y526 R617	I512-V524 WeakPolarHBondContact CA-O 3.47Å; D513-V524 PolarHBondContact N-O 2.89Å; D513-V524 PolarHBondContact O-N 3.11Å; D515-V524 HydrophobicContact CB-CB 3.99Å; D515-V524 HydrophobicContact CB-CG2 3.42Å; D515-V524 VanDerWaalsContact CB-CG2 3.42Å; V524-Y526 HydrophobicContact CG1-CD1 4.05Å; V524-Y526 HydrophobicContact CG1-CD2 3.79Å; V524-Y526 HydrophobicContact CG1-CE1 3.79Å; V524-Y526 HydrophobicContact CG1-CE2 3.51Å; V524-Y526 HydrophobicContact CG1-CG 4.05Å; V524-R617 CarbonylContact C-O 3.5Å; V524-R617 VanDerWaalsContact CA-O 3.29Å; V524-R617 WeakPolarHBondContact CA-O 3.44Å; V524-R617 WeakPolarHBondContact CG1-O 3.35Å; V524-R617 HydrophobicContact CG2-CB 3.81Å; V524-R617 HydrophobicContact CG2-CG 4.49Å
525	A	80	Confident	70.1	Confident	15 Å²	15	67.7 Å²	67.7	12%	0.124	38%	0.377	C	S	.	.			trans	-135.3	85	178.6	0	0	0	0	0	109.6	V616 R617	A525-V616 HydrophobicContact CB-CG1 3.73Å; A525-R617 PolarHBondContact N-O 3.45Å
526	Y	78	Confident	71.3	Confident	82 Å²	82	68.1 Å²	68.1	32%	0.322	38%	0.379	S	S	.	.			trans	-57	146.5	179.5	-61.1	-79	0	0	0	113.2	V524 K533 D1478	V524-Y526 HydrophobicContact CG1-CD1 4.05Å; V524-Y526 HydrophobicContact CG1-CD2 3.79Å; V524-Y526 HydrophobicContact CG1-CE1 3.79Å; V524-Y526 HydrophobicContact CG1-CE2 3.51Å; V524-Y526 HydrophobicContact CG1-CG 4.05Å; Y526-K533 WeakPolarHBondContact O-CE 3.44Å; Y526-K533 PolarHBondContact O-NZ 2.87Å; Y526-D1478 PolarHBondContact OH-OD2 3.15Å
527	A	74.1	Confident	72.8	Confident	24 Å²	24	63 Å²	63	20%	0.198	36%	0.355	C	S	.	.			trans	-148.8	149.1	176.1	0	0	0	0	0	110.7	E531 V591	A527-E531 WeakPolarHBondContact CA-OE2 3.29Å; A527-E531 HydrophobicContact CB-CB 4.03Å; A527-V591 HydrophobicContact CB-CB 4.14Å; A527-V591 HydrophobicContact CB-CG1 4.02Å; A527-V591 HydrophobicContact CB-CG2 4.18Å
528	R	74.6	Confident	74.2	Confident	214 Å²	214	65.8 Å²	65.8	81%	0.808	37%	0.366	S	S	*	.			trans	-82.2	160.8	159.3	-67.5	-178	-177.3	173	1.9	109.4	G530 E531	R528-G530 PolarHBondContact O-N 2.96Å; R528-E531 PolarHBondContact N-OE2 2.8Å; R528-E531 VanDerWaalsContact N-OE2 3.13Å; R528-E531 PolarHBondContact O-N 2.97Å
529	A	68.5	Low	75.6	Confident	73 Å²	73	63 Å²	63	60%	0.603	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	109	171.9	0	0	0	0	0	111.5	P593	A529-P593 HydrophobicContact CB-CB 4.48Å; A529-P593 HydrophobicContact CB-CG 3.6Å
530	G	71.5	Confident	76.6	Confident	65 Å²	65	60.1 Å²	60.1	67%	0.67	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	117.3	14.1	177.5	0	0	0	0	0	117.7	R528 V591	R528-G530 PolarHBondContact O-N 2.96Å; G530-V591 VanDerWaalsContact CA-O 3.25Å; G530-V591 WeakPolarHBondContact CA-O 3.5Å; G530-V591 PolarHBondContact N-O 2.79Å
531	E	75.4	Confident	77.2	Confident	73 Å²	73	54.1 Å²	54.1	34%	0.341	29%	0.286	S	S	.	.			trans	-99.5	167.6	-170.2	-143.7	-179.9	129	0	0	115.3	A527 R528 K533 T590 V591	A527-E531 WeakPolarHBondContact CA-OE2 3.29Å; A527-E531 HydrophobicContact CB-CB 4.03Å; R528-E531 PolarHBondContact N-OE2 2.8Å; R528-E531 VanDerWaalsContact N-OE2 3.13Å; R528-E531 PolarHBondContact O-N 2.97Å; E531-K533 WeakPolarHBondContact OE1-CE 3.34Å; E531-K533 IonicContact OE1-NZ 3.93Å; E531-K533 PolarHBondContact OE1-NZ 3.31Å; E531-T590 CarbonylContact O-C 3.56Å; E531-T590 VanDerWaalsContact O-CA 3.23Å; E531-T590 WeakPolarHBondContact O-CA 3.37Å; E531-T590 VanDerWaalsContact O-CG2 3.24Å; E531-T590 WeakPolarHBondContact O-CG2 3.23Å; E531-V591 PolarHBondContact N-O 3.07Å; E531-V591 PolarHBondContact O-N 2.88Å
532	M	78.9	Confident	77.2	Confident	128 Å²	128	51.9 Å²	51.9	63%	0.631	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.1	143.4	-176.2	-173.9	-171.2	-70.5	0	0	112.9	I589	M532-I589 CarbonylContact C-O 3.59Å; M532-I589 WeakPolarHBondContact CA-O 3.46Å; M532-I589 WeakPolarHBondContact CG-O 3.27Å
533	K	79.5	Confident	76.8	Confident	24 Å²	24	51.6 Å²	51.6	10%	0.104	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	157.9	-172.6	-53.3	-69	-167.3	-174	0	114.2	T509 Y526 E531 F535 Q588 I589	T509-K533 WeakPolarHBondContact O-CD 3.26Å; Y526-K533 WeakPolarHBondContact O-CE 3.44Å; Y526-K533 PolarHBondContact O-NZ 2.87Å; E531-K533 WeakPolarHBondContact OE1-CE 3.34Å; E531-K533 IonicContact OE1-NZ 3.93Å; E531-K533 PolarHBondContact OE1-NZ 3.31Å; K533-F535 HydrophobicContact CB-CE2 3.91Å; K533-F535 HydrophobicContact CB-CZ 4.23Å; K533-Q588 CarbonylContact O-C 3.52Å; K533-Q588 WeakPolarHBondContact O-CA 3.34Å; K533-I589 PolarHBondContact N-O 3.37Å; K533-I589 PolarHBondContact O-N 3.37Å
534	T	85.1	Confident	75.7	Confident	15 Å²	15	49.5 Å²	49.5	9%	0.092	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	143.3	176.2	-46.5	0	0	0	0	112.1	V507 E508 I587 Q588	V507-T534 CarbonylContact C-O 3.57Å; V507-T534 WeakPolarHBondContact CA-O 3.42Å; V507-T534 WeakPolarHBondContact CG1-O 3.25Å; V507-T534 WeakPolarHBondContact CG2-O 3.08Å; E508-T534 HydrophobicContact CB-CG2 4.33Å; E508-T534 VanDerWaalsContact CD-CG2 3.44Å; E508-T534 HydrophobicContact CG-CG2 3.85Å; E508-T534 PolarHBondContact N-O 2.76Å; E508-T534 VanDerWaalsContact OE2-CG2 3.28Å; E508-T534 WeakPolarHBondContact OE2-CG2 3.31Å; T534-I587 CarbonylContact C-O 3.55Å; T534-I587 VanDerWaalsContact CA-O 3.31Å; T534-I587 WeakPolarHBondContact CA-O 3.39Å; T534-I587 VanDerWaalsContact CG2-O 3.22Å; T534-I587 WeakPolarHBondContact CG2-O 3.26Å; T534-Q588 HydrophobicContact CG2-CG 3.66Å
535	F	88.2	Confident	74.8	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.018	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	154.7	-177.6	-53.5	-107.1	0	0	0	113.4	I505 S506 V507 K533 W550 R586 I587 I600 V616	I505-F535 HydrophobicContact CG2-CD1 4.37Å; S506-F535 CarbonylContact O-C 3.19Å; S506-F535 VanDerWaalsContact O-CA 3.29Å; S506-F535 WeakPolarHBondContact O-CA 3.37Å; V507-F535 HydrophobicContact CG2-CD1 3.25Å; V507-F535 HydrophobicContact CG2-CE1 3.35Å; V507-F535 HydrophobicContact CG2-CG 3.88Å; V507-F535 HydrophobicContact CG2-CZ 4.03Å; K533-F535 HydrophobicContact CB-CE2 3.91Å; K533-F535 HydrophobicContact CB-CZ 4.23Å; F535-W550 HydrophobicContact CB-CH2 3.72Å; F535-W550 HydrophobicContact CB-CZ3 3.95Å; F535-R586 CarbonylContact O-C 3.53Å; F535-R586 WeakPolarHBondContact O-CA 3.13Å; F535-I587 HydrophobicContact CB-CD1 4.27Å; F535-I587 HydrophobicContact CB-CG1 3.82Å; F535-I587 HydrophobicContact CD2-CD1 4.4Å; F535-I587 HydrophobicContact CD2-CG1 4.36Å; F535-I587 HydrophobicContact CG-CG1 4.47Å; F535-I587 PolarHBondContact N-O 2.86Å; F535-I587 PolarHBondContact O-N 2.92Å; F535-I600 HydrophobicContact CD1-CD1 4.49Å; F535-I600 HydrophobicContact CD2-CD1 4.26Å; F535-I600 HydrophobicContact CE1-CD1 3.78Å; F535-I600 HydrophobicContact CE2-CD1 3.52Å; F535-I600 HydrophobicContact CZ-CD1 3.25Å; F535-V616 HydrophobicContact CD1-CG2 4.49Å; F535-V616 HydrophobicContact CE1-CB 4.45Å; F535-V616 HydrophobicContact CE1-CG1 4.35Å; F535-V616 HydrophobicContact CE1-CG2 4.19Å
536	I	89	Confident	74.3	Confident	15 Å²	15	56.9 Å²	56.9	8%	0.077	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	147.1	-177	-52.5	167.6	0	0	0	109.9	I505 S506 E508 K538 E584 S585 R586	I505-I536 CarbonylContact C-O 3.51Å; I505-I536 VanDerWaalsContact CA-O 3.24Å; I505-I536 WeakPolarHBondContact CA-O 3.29Å; S506-I536 PolarHBondContact N-O 2.63Å; S506-I536 PolarHBondContact O-N 3.23Å; E508-I536 HydrophobicContact CG-CD1 3.78Å; E508-I536 HydrophobicContact CG-CG1 4.15Å; I536-K538 HydrophobicContact CG2-CG 4.4Å; I536-E584 HydrophobicContact CG2-CG 4.13Å; I536-S585 CarbonylContact C-O 3.54Å; I536-S585 WeakPolarHBondContact CA-O 2.94Å; I536-R586 HydrophobicContact CB-CG 4.27Å; I536-R586 HydrophobicContact CG1-CG 3.93Å; I536-R586 HydrophobicContact CG2-CG 4.1Å
537	C	87.6	Confident	74.3	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	138.4	178.9	-168.8	0	0	0	0	112.7	T504 I505 I548 W550 E584 S585 C602	T504-C537 CarbonylContact O-C 3.48Å; T504-C537 WeakPolarHBondContact O-CA 3.41Å; I505-C537 HydrophobicContact CG1-CB 4.48Å; C537-I548 HydrophobicContact CB-CG2 4.41Å; C537-W550 HydrophobicContact CB-CH2 3.71Å; C537-W550 HydrophobicContact CB-CZ2 3.43Å; C537-W550 VanDerWaalsContact CB-CZ2 3.43Å; C537-E584 CarbonylContact O-C 3.55Å; C537-E584 VanDerWaalsContact O-CA 3.26Å; C537-E584 WeakPolarHBondContact O-CA 3.49Å; C537-S585 PolarHBondContact N-O 2.76Å; C537-S585 PolarHBondContact O-N 3.35Å; C537-C602 HydrophobicContact CB-CB 3.91Å; C537-C602 WeakPolarHBondContact CB-SG 3.14Å; C537-C602 WeakPolarHBondContact SG-CB 3.44Å; C537-C602 CovalentContact SG-SG 2.05Å; C537-C602 PolarHBondContact SG-SG 3.5Å
538	K	85.1	Confident	74.7	Confident	72 Å²	72	56 Å²	56	31%	0.313	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	162.9	-174.5	-48.3	-163.1	-170.5	-148.5	0	115.7	V503 T504 I536 Q583 E584	V503-K538 WeakPolarHBondContact CA-O 3.35Å; T504-K538 PolarHBondContact N-O 3.11Å; T504-K538 VanDerWaalsContact N-O 3.08Å; T504-K538 PolarHBondContact O-N 3.28Å; I536-K538 HydrophobicContact CG2-CG 4.4Å; K538-Q583 WeakPolarHBondContact CA-O 3.41Å; K538-E584 HydrophobicContact CD-CB 4.46Å; K538-E584 HydrophobicContact CD-CG 4.36Å; K538-E584 WeakPolarHBondContact CD-OE2 3.23Å; K538-E584 WeakPolarHBondContact CE-OE2 3.47Å; K538-E584 HydrophobicContact CG-CB 4.1Å; K538-E584 HydrophobicContact CG-CG 4Å; K538-E584 IonicContact NZ-OE1 2.86Å; K538-E584 IonicContact NZ-OE2 3.45Å; K538-E584 PolarHBondContact NZ-OE2 3.24Å
539	T	79.1	Confident	75.2	Confident	16 Å²	16	49.1 Å²	49.1	10%	0.098	28%	0.28	C	S	.	.			trans	-116.4	164.9	174.6	80.1	0	0	0	0	113.9	A546 Q583 V604	T539-A546 HydrophobicContact CG2-CB 4.41Å; T539-Q583 HydrophobicContact CG2-CB 4.18Å; T539-Q583 PolarHBondContact N-O 2.99Å; T539-Q583 PolarHBondContact OG1-N 3.03Å; T539-V604 HydrophobicContact CG2-CG1 3.94Å
540	A	68.9	Low	76.1	Confident	20 Å²	20	45.8 Å²	45.8	17%	0.165	25%	0.252	C	S	.	.			trans	-81.6	168.9	175.8	0	0	0	0	0	114.7	A501 N502 Y543 Y582	A501-A540 WeakPolarHBondContact O-CB 3.18Å; N502-A540 HydrophobicContact CB-CB 4.26Å; A540-Y543 HydrophobicContact CB-CD2 4.26Å; A540-Y543 HydrophobicContact CB-CE2 4.13Å; A540-Y543 WeakPolarHBondContact O-CD2 3.44Å; A540-Y582 WeakPolarHBondContact O-CB 3.49Å
541	P	63.5	Low	76.7	Confident	54 Å²	54	43.8 Å²	43.8	35%	0.351	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	167.9	168.3	-30.6	39.3	0	0	0	115.6	Y543 T575 F581	P541-Y543 WeakPolarHBondContact O-CD2 3.28Å; P541-Y543 WeakPolarHBondContact O-CE2 3.49Å; P541-Y543 PolarHBondContact O-N 3.37Å; P541-T575 HydrophobicContact CB-CG2 3.95Å; P541-T575 HydrophobicContact CG-CG2 4.09Å; P541-F581 CarbonylContact C-O 3.53Å; P541-F581 WeakPolarHBondContact CA-O 3.41Å
542	Y	62.1	Low	77.1	Confident	88 Å²	88	42.4 Å²	42.4	35%	0.345	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	3.4	-176.4	-50.3	-78.1	0	0	0	116.7	V381 S580 F581	V381-Y542 HydrophobicContact CG2-CE2 4.17Å; V381-Y542 PolarHBondContact N-OH 3.4Å; Y542-S580 VanDerWaalsContact CD1-CB 3.45Å; Y542-S580 PolarHBondContact N-OG 3.03Å; Y542-F581 PolarHBondContact N-O 2.98Å
543	Y	60.8	Low	77	Confident	27 Å²	27	38.8 Å²	38.8	11%	0.106	20%	0.2	C	C	.	.			trans	-118.6	80.5	-176.9	-50.6	-55.8	0	0	0	112.4	H498 A499 P500 A540 P541 Q545 F581	H498-Y543 AromaticContact CE1-CE1 3.92Å; H498-Y543 AromaticContact CE1-CZ 3.93Å; H498-Y543 PolarHBondContact CE1-OH 2.93Å; H498-Y543 AromaticContact ND1-CE1 3.92Å; H498-Y543 AromaticContact ND1-CZ 3.99Å; H498-Y543 PolarHBondContact ND1-OH 3.41Å; H498-Y543 VanDerWaalsContact ND1-OH 3.17Å; A499-Y543 WeakPolarHBondContact O-CE1 3.5Å; A499-Y543 PolarHBondContact O-OH 2.64Å; A499-Y543 VanDerWaalsContact O-OH 3.05Å; P500-Y543 VanDerWaalsContact CA-CE1 3.48Å; P500-Y543 VanDerWaalsContact CA-CZ 3.49Å; P500-Y543 HydrophobicContact CB-CD1 4.13Å; P500-Y543 HydrophobicContact CB-CD2 4.21Å; P500-Y543 HydrophobicContact CB-CE1 4.4Å; P500-Y543 HydrophobicContact CB-CE2 4.47Å; P500-Y543 HydrophobicContact CB-CG 4.07Å; P500-Y543 HydrophobicContact CG-CD1 3.87Å; P500-Y543 HydrophobicContact CG-CE1 4.37Å; P500-Y543 HydrophobicContact CG-CG 4.11Å; A540-Y543 HydrophobicContact CB-CD2 4.26Å; A540-Y543 HydrophobicContact CB-CE2 4.13Å; A540-Y543 WeakPolarHBondContact O-CD2 3.44Å; P541-Y543 WeakPolarHBondContact O-CD2 3.28Å; P541-Y543 WeakPolarHBondContact O-CE2 3.49Å; P541-Y543 PolarHBondContact O-N 3.37Å; Y543-Q545 VanDerWaalsContact C-N 3.34Å; Y543-Q545 PolarHBondContact O-N 3Å; Y543-F581 PolarHBondContact N-O 2.65Å; Y543-F581 VanDerWaalsContact N-O 3.11Å
544	G	57.2	Low	76.5	Confident	30 Å²	30	39.9 Å²	39.9	31%	0.309	21%	0.214	S	C	.	.			trans	-75.6	-8.1	-175.6	0	0	0	0	0	116.9
545	Q	64.2	Low	75.4	Confident	160 Å²	160	41 Å²	41	75%	0.748	22%	0.224	S	C	*	.	S	Bend	trans	-141.7	72.8	-174.5	-67	-172.6	-12.4	0	0	112.3	Y543	Y543-Q545 VanDerWaalsContact C-N 3.34Å; Y543-Q545 PolarHBondContact O-N 3Å
546	A	68.9	Low	74	Confident	11 Å²	11	45 Å²	45	9%	0.091	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	176.7	172.4	0	0	0	0	0	112.3	T539 Q583 V604 W605	T539-A546 HydrophobicContact CG2-CB 4.41Å; A546-Q583 VanDerWaalsContact C-OE1 3.24Å; A546-Q583 VanDerWaalsContact N-NE2 3.18Å; A546-Q583 PolarHBondContact O-NE2 3.3Å; A546-Q583 PolarHBondContact O-OE1 2.71Å; A546-Q583 VanDerWaalsContact O-OE1 3.08Å; A546-V604 HydrophobicContact CB-CG1 4.18Å; A546-W605 CarbonylContact C-O 3.48Å; A546-W605 VanDerWaalsContact CA-O 3.28Å; A546-W605 WeakPolarHBondContact CA-O 3.15Å
547	T	77.2	Confident	72.2	Confident	65 Å²	65	47.6 Å²	47.6	40%	0.399	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	147.2	173.7	-56.6	0	0	0	0	110	V604 W605	T547-V604 VanDerWaalsContact O-CA 3.25Å; T547-V604 WeakPolarHBondContact O-CA 3.37Å; T547-W605 HydrophobicContact CG2-CH2 3.67Å; T547-W605 HydrophobicContact CG2-CZ2 3.39Å; T547-W605 HydrophobicContact CG2-CZ3 4.4Å; T547-W605 PolarHBondContact N-O 2.94Å; T547-W605 PolarHBondContact O-N 3.38Å
548	I	83	Confident	70	Confident	21 Å²	21	51.7 Å²	51.7	11%	0.108	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	145.4	-172.4	-48.1	-177.1	0	0	0	111.4	C537 Q583 C602 L603 V604	C537-I548 HydrophobicContact CB-CG2 4.41Å; I548-Q583 HydrophobicContact CD1-CB 4.31Å; I548-C602 VanDerWaalsContact CG2-SG 3.58Å; I548-L603 CarbonylContact C-O 3.05Å; I548-L603 WeakPolarHBondContact CA-O 3.23Å; I548-V604 HydrophobicContact CG1-CG2 4.17Å; I548-V604 HydrophobicContact CG2-CG2 4.23Å
549	K	84.9	Confident	68.3	Low	71 Å²	71	56.2 Å²	56.2	31%	0.309	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	148.5	177.6	177.2	172.8	-179.1	166.3	0	113.7	C602 L603 W605	K549-C602 CarbonylContact O-C 3.6Å; K549-C602 WeakPolarHBondContact O-CA 3.49Å; K549-L603 HydrophobicContact CB-CB 4.38Å; K549-L603 HydrophobicContact CD-CD1 4.44Å; K549-L603 HydrophobicContact CG-CD1 4.42Å; K549-L603 PolarHBondContact N-O 3.1Å; K549-L603 PolarHBondContact O-N 2.86Å; K549-W605 HydrophobicContact CB-CH2 4.25Å; K549-W605 HydrophobicContact CB-CZ3 4.08Å
550	W	87.1	Confident	66.7	Low	3 Å²	3	61.6 Å²	61.6	1%	0.011	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	151.5	-179.6	-65.2	99	0	0	0	115	I505 F535 C537 L566 S585 I587 I600 D601 C602	I505-W550 HydrophobicContact CD1-CZ3 4.18Å; I505-W550 HydrophobicContact CG1-CH2 4.47Å; I505-W550 HydrophobicContact CG1-CZ3 4.39Å; I505-W550 HydrophobicContact CG2-CH2 4.32Å; I505-W550 HydrophobicContact CG2-CZ3 4.39Å; F535-W550 HydrophobicContact CB-CH2 3.72Å; F535-W550 HydrophobicContact CB-CZ3 3.95Å; C537-W550 HydrophobicContact CB-CH2 3.71Å; C537-W550 HydrophobicContact CB-CZ2 3.43Å; C537-W550 VanDerWaalsContact CB-CZ2 3.43Å; W550-L566 HydrophobicContact CB-CB 3.91Å; W550-L566 PolarHBondContact O-N 3.36Å; W550-S585 PolarHBondContact NE1-OG 3.12Å; W550-I587 HydrophobicContact CB-CD1 4.33Å; W550-I587 HydrophobicContact CB-CG2 4.03Å; W550-I587 HydrophobicContact CD2-CD1 3.7Å; W550-I587 HydrophobicContact CD2-CG1 3.84Å; W550-I587 HydrophobicContact CD2-CG2 3.94Å; W550-I587 HydrophobicContact CE3-CD1 3.37Å; W550-I587 HydrophobicContact CE3-CG1 3.85Å; W550-I587 HydrophobicContact CG-CD1 4.17Å; W550-I587 HydrophobicContact CG-CG1 4.38Å; W550-I587 HydrophobicContact CG-CG2 3.62Å; W550-I587 HydrophobicContact CH2-CD1 4.42Å; W550-I587 HydrophobicContact CH2-CG1 4.14Å; W550-I587 HydrophobicContact CZ2-CG1 4.13Å; W550-I587 HydrophobicContact CZ3-CD1 3.78Å; W550-I587 HydrophobicContact CZ3-CG1 4.02Å; W550-I600 HydrophobicContact CE3-CG2 4.43Å; W550-D601 CarbonylContact C-O 3.57Å; W550-D601 VanDerWaalsContact CA-O 3.32Å; W550-D601 WeakPolarHBondContact CA-O 3.29Å; W550-C602 HydrophobicContact CD2-CB 4.25Å; W550-C602 HydrophobicContact CE3-CB 3.82Å; W550-C602 HydrophobicContact CH2-CB 4.32Å; W550-C602 HydrophobicContact CZ3-CB 3.85Å
551	L	84.7	Confident	65.7	Low	22 Å²	22	65.1 Å²	65.1	12%	0.115	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	158.1	177	-58.9	173	0	0	0	113.3	Q565 I600 D601 L603	L551-Q565 HydrophobicContact CD2-CB 4.21Å; L551-I600 WeakPolarHBondContact O-CA 3.41Å; L551-D601 HydrophobicContact CB-CB 4.26Å; L551-D601 PolarHBondContact N-O 2.53Å; L551-D601 PolarHBondContact O-N 2.89Å; L551-L603 HydrophobicContact CD1-CD1 4Å; L551-L603 HydrophobicContact CG-CD1 4.44Å
552	F	83.6	Confident	65	Low	44 Å²	44	67.8 Å²	67.8	19%	0.193	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	143.7	169.5	174.5	-91.4	0	0	0	112	P563 K564 L566 I589 Y599 I600	F552-P563 CarbonylContact O-C 3.38Å; F552-P563 VanDerWaalsContact O-CA 3.3Å; F552-P563 WeakPolarHBondContact O-CA 3.49Å; F552-P563 WeakPolarHBondContact O-CB 2.93Å; F552-K564 HydrophobicContact CB-CB 4.39Å; F552-K564 PolarHBondContact N-O 3.43Å; F552-K564 PolarHBondContact O-N 3.16Å; F552-L566 HydrophobicContact CB-CD1 4.38Å; F552-I589 HydrophobicContact CD2-CD1 3.84Å; F552-I589 HydrophobicContact CE2-CD1 4.45Å; F552-I589 HydrophobicContact CE2-CG2 4.45Å; F552-Y599 WeakPolarHBondContact CA-O 3.32Å; F552-Y599 WeakPolarHBondContact CD2-O 3.43Å; F552-I600 HydrophobicContact CD2-CG1 3.9Å
553	Q	77	Confident	64.9	Low	52 Å²	52	66.5 Å²	66.5	24%	0.243	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	137.1	-175.5	-78.7	152.4	51.5	0	0	111.1	P563 S598 Y599 D601	Q553-P563 HydrophobicContact CG-CB 3.79Å; Q553-S598 WeakPolarHBondContact O-CB 3.02Å; Q553-Y599 PolarHBondContact N-O 3.15Å; Q553-Y599 PolarHBondContact O-N 3Å; Q553-D601 PolarHBondContact NE2-OD2 2.66Å
554	A	70	Confident	65.4	Low	48 Å²	48	72 Å²	72	40%	0.397	44%	0.437	S	S	.	.			trans	-87.8	159.9	-178.4	0	0	0	0	0	113	T557	A554-T557 HydrophobicContact CB-CG2 3.84Å; A554-T557 PolarHBondContact O-OG1 2.83Å
555	A	61.5	Low	66	Low	38 Å²	38	75.4 Å²	75.4	31%	0.314	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	139.1	175.5	0	0	0	0	0	111.6	T557 D596 R597	A555-T557 PolarHBondContact O-N 2.75Å; A555-D596 WeakPolarHBondContact CB-O 3.49Å; A555-R597 HydrophobicContact CB-CB 4.35Å
556	G	59.8	Low	66.4	Low	87 Å²	87	69.2 Å²	69.2	90%	0.897	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	-0.8	171	0	0	0	0	0	117.2	S558	G556-S558 PolarHBondContact O-N 2.84Å; G556-S558 VanDerWaalsContact O-N 3.16Å
557	T	49.8	Very low	66.1	Low	70 Å²	70	74.6 Å²	74.6	43%	0.429	45%	0.448	S	S	.	.			trans	-74.6	105.4	-177.3	50.1	0	0	0	0	112.5	A554 A555 I559 T561	A554-T557 HydrophobicContact CB-CG2 3.84Å; A554-T557 PolarHBondContact O-OG1 2.83Å; A555-T557 PolarHBondContact O-N 2.75Å; T557-I559 PolarHBondContact O-N 2.84Å; T557-T561 WeakPolarHBondContact CB-OG1 3.48Å
558	S	41.7	Very low	65.7	Low	87 Å²	87	75.3 Å²	75.3	61%	0.608	45%	0.449	S	S	*	.			trans	-73.6	104.7	176	-173.8	0	0	0	0	112.3	G556 T560	G556-S558 PolarHBondContact O-N 2.84Å; G556-S558 VanDerWaalsContact O-N 3.16Å; S558-T560 PolarHBondContact O-N 2.86Å; S558-T560 PolarHBondContact O-OG1 2.83Å
559	I	48.5	Very low	65.2	Low	167 Å²	167	82.5 Å²	82.5	86%	0.856	48%	0.48	S	S	*	.	S	Bend	trans	61	-13.4	154.7	-61	175.9	0	0	0	117.6	T557	T557-I559 PolarHBondContact O-N 2.84Å
560	T	47.4	Very low	64.8	Low	129 Å²	129	81.6 Å²	81.6	79%	0.791	48%	0.483	S	S	*	.			trans	-108.6	-10.2	-163.5	47.2	0	0	0	0	115.5	S558	S558-T560 PolarHBondContact O-N 2.86Å; S558-T560 PolarHBondContact O-OG1 2.83Å
561	T	47.9	Very low	64.6	Low	94 Å²	94	84.9 Å²	84.9	58%	0.577	50%	0.503	S	S	*	.	S	Bend	trans	-110.3	125.9	173.7	27.7	0	0	0	0	110	T557	T557-T561 WeakPolarHBondContact CB-OG1 3.48Å
562	S	47.4	Very low	64.3	Low	110 Å²	110	87.2 Å²	87.2	77%	0.769	52%	0.518	S	S	*	.			trans	-72.7	141	-179.9	46.6	0	0	0	0	111.2	K564	S562-K564 PolarHBondContact O-N 2.94Å
563	P	60.4	Low	64.1	Low	61 Å²	61	89.7 Å²	89.7	40%	0.396	53%	0.527	S	S	.	.			trans	-62.5	129.9	179.5	26.2	-34.9	0	0	0	110.3	F552 Q553 Q565	F552-P563 CarbonylContact O-C 3.38Å; F552-P563 VanDerWaalsContact O-CA 3.3Å; F552-P563 WeakPolarHBondContact O-CA 3.49Å; F552-P563 WeakPolarHBondContact O-CB 2.93Å; Q553-P563 HydrophobicContact CG-CB 3.79Å; P563-Q565 PolarHBondContact O-N 2.79Å; P563-Q565 VanDerWaalsContact O-N 3.09Å
564	K	70.2	Confident	64	Low	141 Å²	141	92.8 Å²	92.8	61%	0.613	54%	0.54	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	109	-177	-177.7	-178.4	178.2	-174.8	0	108.9	F552 S562	F552-K564 HydrophobicContact CB-CB 4.39Å; F552-K564 PolarHBondContact N-O 3.43Å; F552-K564 PolarHBondContact O-N 3.16Å; S562-K564 PolarHBondContact O-N 2.94Å
565	Q	71.5	Confident	63.8	Low	103 Å²	103	91.2 Å²	91.2	48%	0.481	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	134.8	175.2	178.8	171.6	-33	0	0	110.4	L551 P563 V567	L551-Q565 HydrophobicContact CD2-CB 4.21Å; P563-Q565 PolarHBondContact O-N 2.79Å; P563-Q565 VanDerWaalsContact O-N 3.09Å; Q565-V567 HydrophobicContact CG-CG2 4.2Å
566	L	72	Confident	64.1	Low	30 Å²	30	96 Å²	96	16%	0.157	55%	0.553	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.5	145.3	171.1	-54.5	175	0	0	0	107.8	W550 F552 I587 I589	W550-L566 HydrophobicContact CB-CB 3.91Å; W550-L566 PolarHBondContact O-N 3.36Å; F552-L566 HydrophobicContact CB-CD1 4.38Å; L566-I587 HydrophobicContact CB-CG2 3.85Å; L566-I587 HydrophobicContact CD1-CB 4.41Å; L566-I587 HydrophobicContact CD1-CD1 3.53Å; L566-I587 HydrophobicContact CD1-CG2 4.47Å; L566-I589 HydrophobicContact CD1-CD1 3.96Å; L566-I589 HydrophobicContact CD1-CG1 4.44Å
567	V	61.8	Low	64.1	Low	123 Å²	123	95.1 Å²	95.1	75%	0.745	53%	0.528	S	S	*	.			trans	-128.9	123.3	-167.4	-178	0	0	0	0	110.3	Q565	Q565-V567 HydrophobicContact CG-CG2 4.2Å
568	D	69.4	Low	64.6	Low	80 Å²	80	93.4 Å²	93.4	43%	0.428	52%	0.524	S	S	.	.			trans	-148.7	172.7	170.7	-178.9	40.7	0	0	0	109.3	S585 R586	D568-S585 PolarHBondContact OD2-OG 3.06Å; D568-R586 WeakPolarHBondContact CB-O 3.08Å; D568-R586 VanDerWaalsContact CG-O 3.29Å; D568-R586 PolarHBondContact OD2-N 3.49Å
569	K	72.5	Confident	65.4	Low	172 Å²	172	95.4 Å²	95.4	75%	0.748	52%	0.524	S	S	*	.			trans	-93.6	158.2	179.4	-62	177.9	-178.7	177.3	0	111.5	S585	K569-S585 WeakPolarHBondContact O-CB 3.48Å; K569-S585 PolarHBondContact O-OG 2.84Å
570	S	76.8	Confident	66.1	Low	53 Å²	53	87.6 Å²	87.6	37%	0.371	48%	0.484	S	S	.	.			trans	-105.7	154	165.2	62	0	0	0	0	112.6	E584	S570-E584 WeakPolarHBondContact CA-O 3.3Å
571	V	81.7	Confident	67.3	Low	72 Å²	72	85.8 Å²	85.8	44%	0.436	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.4	178.5	-176.7	0	0	0	0	109.8	Y573 Q583 E584	V571-Y573 HydrophobicContact CB-CE2 3.84Å; V571-Y573 HydrophobicContact CG1-CD2 4.39Å; V571-Y573 HydrophobicContact CG1-CE1 4.22Å; V571-Y573 HydrophobicContact CG1-CE2 3.71Å; V571-Q583 WeakPolarHBondContact O-CA 3.01Å; V571-E584 PolarHBondContact N-O 3.31Å; V571-E584 VanDerWaalsContact N-O 3.08Å; V571-E584 PolarHBondContact O-N 2.93Å; V571-E584 VanDerWaalsContact O-N 3.16Å
572	T	79.3	Confident	68.8	Low	71 Å²	71	84.7 Å²	84.7	44%	0.436	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	138.1	176.4	-52.3	0	0	0	0	111.4	Y582 Q583	T572-Y582 CarbonylContact C-O 3.51Å; T572-Y582 WeakPolarHBondContact CA-O 3.49Å; T572-Q583 HydrophobicContact CG2-CG 4.37Å; T572-Q583 PolarHBondContact OG1-NE2 2.82Å
573	Y	78.8	Confident	70.4	Confident	95 Å²	95	79.9 Å²	79.9	37%	0.373	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	155.5	179.3	-61.7	-88.4	0	0	0	111	V571 F581 Y582 E584	V571-Y573 HydrophobicContact CB-CE2 3.84Å; V571-Y573 HydrophobicContact CG1-CD2 4.39Å; V571-Y573 HydrophobicContact CG1-CE1 4.22Å; V571-Y573 HydrophobicContact CG1-CE2 3.71Å; Y573-F581 CarbonylContact O-C 3.55Å; Y573-F581 VanDerWaalsContact O-CA 3.27Å; Y573-F581 WeakPolarHBondContact O-CA 3.32Å; Y573-Y582 VanDerWaalsContact CB-CE1 3.48Å; Y573-Y582 HydrophobicContact CD2-CD2 4.3Å; Y573-Y582 AromaticContact CD2-CE2 3.75Å; Y573-Y582 HydrophobicContact CD2-CE2 3.75Å; Y573-Y582 HydrophobicContact CG-CE1 4.44Å; Y573-Y582 AromaticContact CG-CE2 3.98Å; Y573-Y582 HydrophobicContact CG-CE2 3.98Å; Y573-Y582 AromaticContact CG-CZ 3.85Å; Y573-Y582 PolarHBondContact N-O 3.39Å; Y573-Y582 PolarHBondContact O-N 2.77Å; Y573-E584 HydrophobicContact CE2-CB 4.26Å
574	K	74.7	Confident	71.5	Confident	117 Å²	117	77.9 Å²	77.9	51%	0.509	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	147.1	173.5	-160.1	178.8	-172.8	-163.4	0	110.2	G578 S580 F581	K574-G578 VanDerWaalsContact CE-C 3.48Å; K574-G578 WeakPolarHBondContact CE-O 3.35Å; K574-G578 PolarHBondContact NZ-O 2.99Å; K574-S580 VanDerWaalsContact CG-O 3.26Å; K574-S580 WeakPolarHBondContact CG-O 3.35Å; K574-F581 HydrophobicContact CB-CD1 4.07Å; K574-F581 HydrophobicContact CB-CE1 4.14Å; K574-F581 HydrophobicContact CD-CE1 4.04Å; K574-F581 HydrophobicContact CD-CZ 4.35Å; K574-F581 HydrophobicContact CG-CD1 3.88Å; K574-F581 HydrophobicContact CG-CE1 3.7Å; K574-F581 HydrophobicContact CG-CZ 4.27Å
575	T	66.7	Low	72.4	Confident	15 Å²	15	71.5 Å²	71.5	9%	0.092	38%	0.375	C	S	.	.			trans	-76.4	158.1	176.8	45.5	0	0	0	0	113.2	P541 D577 G578 S580 Y582	P541-T575 HydrophobicContact CB-CG2 3.95Å; P541-T575 HydrophobicContact CG-CG2 4.09Å; T575-D577 VanDerWaalsContact C-N 3.26Å; T575-D577 WeakPolarHBondContact CB-OD1 3.41Å; T575-D577 PolarHBondContact O-N 2.94Å; T575-D577 PolarHBondContact OG1-OD1 3.08Å; T575-G578 PolarHBondContact O-N 2.85Å; T575-G578 VanDerWaalsContact O-N 3.11Å; T575-S580 VanDerWaalsContact CG2-OG 3.23Å; T575-S580 WeakPolarHBondContact CG2-OG 3.15Å; T575-S580 PolarHBondContact N-O 2.77Å; T575-S580 VanDerWaalsContact OG1-CA 3.3Å; T575-S580 WeakPolarHBondContact OG1-CA 3.47Å; T575-S580 PolarHBondContact OG1-N 2.85Å; T575-S580 VanDerWaalsContact OG1-N 3.1Å; T575-S580 PolarHBondContact OG1-O 3.15Å; T575-S580 PolarHBondContact OG1-OG 2.86Å; T575-Y582 HydrophobicContact CG2-CD1 4.2Å
576	P	67	Low	73.2	Confident	138 Å²	138	71.3 Å²	71.3	90%	0.896	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-27.3	-179.1	-24.4	35.4	0	0	0	115.1	G578	P576-G578 PolarHBondContact O-N 3.42Å
577	D	60.2	Low	73.9	Confident	69 Å²	69	70.7 Å²	70.7	37%	0.369	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-18.4	175.8	61.1	11	0	0	0	113.6	T575 E579 S580	T575-D577 VanDerWaalsContact C-N 3.26Å; T575-D577 WeakPolarHBondContact CB-OD1 3.41Å; T575-D577 PolarHBondContact O-N 2.94Å; T575-D577 PolarHBondContact OG1-OD1 3.08Å; D577-E579 PolarHBondContact O-N 3.08Å; D577-E579 PolarHBondContact OD1-N 3.37Å; D577-S580 PolarHBondContact OD1-N 2.59Å
578	G	59.7	Low	74.9	Confident	34 Å²	34	71.6 Å²	71.6	35%	0.351	36%	0.363	S	S	.	.	S	Bend	trans	74	5.2	-174.1	0	0	0	0	0	115	K574 T575 P576	K574-G578 VanDerWaalsContact CE-C 3.48Å; K574-G578 WeakPolarHBondContact CE-O 3.35Å; K574-G578 PolarHBondContact NZ-O 2.99Å; T575-G578 PolarHBondContact O-N 2.85Å; T575-G578 VanDerWaalsContact O-N 3.11Å; P576-G578 PolarHBondContact O-N 3.42Å
579	E	59.4	Low	75.5	Confident	129 Å²	129	69.4 Å²	69.4	60%	0.603	35%	0.351	S	S	*	.	S	Bend	trans	-109.7	-9.2	-176.3	-62.2	-166.6	141	0	0	113.7	Q380 D577	Q380-E579 PolarHBondContact NE2-OE2 3.13Å; D577-E579 PolarHBondContact O-N 3.08Å; D577-E579 PolarHBondContact OD1-N 3.37Å
580	S	63.8	Low	76	Confident	4 Å²	4	65.1 Å²	65.1	3%	0.028	34%	0.339	C	S	.	.			trans	-144.9	-171.9	178	87.8	0	0	0	0	116.6	Y542 K574 T575 D577	Y542-S580 VanDerWaalsContact CD1-CB 3.45Å; Y542-S580 PolarHBondContact N-OG 3.03Å; K574-S580 VanDerWaalsContact CG-O 3.26Å; K574-S580 WeakPolarHBondContact CG-O 3.35Å; T575-S580 VanDerWaalsContact CG2-OG 3.23Å; T575-S580 WeakPolarHBondContact CG2-OG 3.15Å; T575-S580 PolarHBondContact N-O 2.77Å; T575-S580 VanDerWaalsContact OG1-CA 3.3Å; T575-S580 WeakPolarHBondContact OG1-CA 3.47Å; T575-S580 PolarHBondContact OG1-N 2.85Å; T575-S580 VanDerWaalsContact OG1-N 3.1Å; T575-S580 PolarHBondContact OG1-O 3.15Å; T575-S580 PolarHBondContact OG1-OG 2.86Å; D577-S580 PolarHBondContact OD1-N 2.59Å
581	F	71.9	Confident	76	Confident	90 Å²	90	63.6 Å²	63.6	40%	0.395	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	158.7	-165.9	-58.8	-91.5	0	0	0	114.3	P541 Y542 Y543 Y573 K574	P541-F581 CarbonylContact C-O 3.53Å; P541-F581 WeakPolarHBondContact CA-O 3.41Å; Y542-F581 PolarHBondContact N-O 2.98Å; Y543-F581 PolarHBondContact N-O 2.65Å; Y543-F581 VanDerWaalsContact N-O 3.11Å; Y573-F581 CarbonylContact O-C 3.55Å; Y573-F581 VanDerWaalsContact O-CA 3.27Å; Y573-F581 WeakPolarHBondContact O-CA 3.32Å; K574-F581 HydrophobicContact CB-CD1 4.07Å; K574-F581 HydrophobicContact CB-CE1 4.14Å; K574-F581 HydrophobicContact CD-CE1 4.04Å; K574-F581 HydrophobicContact CD-CZ 4.35Å; K574-F581 HydrophobicContact CG-CD1 3.88Å; K574-F581 HydrophobicContact CG-CE1 3.7Å; K574-F581 HydrophobicContact CG-CZ 4.27Å
582	Y	79.3	Confident	75.8	Confident	72 Å²	72	67.2 Å²	67.2	28%	0.282	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	177.2	178.4	72.4	-88	0	0	0	115	A540 T572 Y573 T575	A540-Y582 WeakPolarHBondContact O-CB 3.49Å; T572-Y582 CarbonylContact C-O 3.51Å; T572-Y582 WeakPolarHBondContact CA-O 3.49Å; Y573-Y582 VanDerWaalsContact CB-CE1 3.48Å; Y573-Y582 HydrophobicContact CD2-CD2 4.3Å; Y573-Y582 AromaticContact CD2-CE2 3.75Å; Y573-Y582 HydrophobicContact CD2-CE2 3.75Å; Y573-Y582 HydrophobicContact CG-CE1 4.44Å; Y573-Y582 AromaticContact CG-CE2 3.98Å; Y573-Y582 HydrophobicContact CG-CE2 3.98Å; Y573-Y582 AromaticContact CG-CZ 3.85Å; Y573-Y582 PolarHBondContact N-O 3.39Å; Y573-Y582 PolarHBondContact O-N 2.77Å; T575-Y582 HydrophobicContact CG2-CD1 4.2Å
583	Q	80.5	Confident	75.4	Confident	8 Å²	8	68.2 Å²	68.2	4%	0.037	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	164.1	-177.4	-66.2	-173.1	-0.8	0	0	118.4	K538 T539 A546 I548 V571 T572	K538-Q583 WeakPolarHBondContact CA-O 3.41Å; T539-Q583 HydrophobicContact CG2-CB 4.18Å; T539-Q583 PolarHBondContact N-O 2.99Å; T539-Q583 PolarHBondContact OG1-N 3.03Å; A546-Q583 VanDerWaalsContact C-OE1 3.24Å; A546-Q583 VanDerWaalsContact N-NE2 3.18Å; A546-Q583 PolarHBondContact O-NE2 3.3Å; A546-Q583 PolarHBondContact O-OE1 2.71Å; A546-Q583 VanDerWaalsContact O-OE1 3.08Å; I548-Q583 HydrophobicContact CD1-CB 4.31Å; V571-Q583 WeakPolarHBondContact O-CA 3.01Å; T572-Q583 HydrophobicContact CG2-CG 4.37Å; T572-Q583 PolarHBondContact OG1-NE2 2.82Å
584	E	85.3	Confident	75.2	Confident	20 Å²	20	70.2 Å²	70.2	9%	0.093	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	155.3	-179.9	172.5	172.4	162.1	0	0	116.6	I536 C537 K538 S570 V571 Y573 R586	I536-E584 HydrophobicContact CG2-CG 4.13Å; C537-E584 CarbonylContact O-C 3.55Å; C537-E584 VanDerWaalsContact O-CA 3.26Å; C537-E584 WeakPolarHBondContact O-CA 3.49Å; K538-E584 HydrophobicContact CD-CB 4.46Å; K538-E584 HydrophobicContact CD-CG 4.36Å; K538-E584 WeakPolarHBondContact CD-OE2 3.23Å; K538-E584 WeakPolarHBondContact CE-OE2 3.47Å; K538-E584 HydrophobicContact CG-CB 4.1Å; K538-E584 HydrophobicContact CG-CG 4Å; K538-E584 IonicContact NZ-OE1 2.86Å; K538-E584 IonicContact NZ-OE2 3.45Å; K538-E584 PolarHBondContact NZ-OE2 3.24Å; S570-E584 WeakPolarHBondContact CA-O 3.3Å; V571-E584 PolarHBondContact N-O 3.31Å; V571-E584 VanDerWaalsContact N-O 3.08Å; V571-E584 PolarHBondContact O-N 2.93Å; V571-E584 VanDerWaalsContact O-N 3.16Å; Y573-E584 HydrophobicContact CE2-CB 4.26Å; E584-R586 IonicContact OE1-CZ 2.8Å; E584-R586 IonicContact OE1-NE 2.75Å; E584-R586 PolarHBondContact OE1-NE 3.1Å; E584-R586 IonicContact OE1-NH2 3.67Å; E584-R586 PolarHBondContact OE1-NH2 2.92Å
585	S	87.5	Confident	75.3	Confident	6 Å²	6	66.4 Å²	66.4	4%	0.042	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	167.1	173.7	-180	0	0	0	0	115.9	I536 C537 W550 D568 K569	I536-S585 CarbonylContact C-O 3.54Å; I536-S585 WeakPolarHBondContact CA-O 2.94Å; C537-S585 PolarHBondContact N-O 2.76Å; C537-S585 PolarHBondContact O-N 3.35Å; W550-S585 PolarHBondContact NE1-OG 3.12Å; D568-S585 PolarHBondContact OD2-OG 3.06Å; K569-S585 WeakPolarHBondContact O-CB 3.48Å; K569-S585 PolarHBondContact O-OG 2.84Å
586	R	88.4	Confident	75.7	Confident	100 Å²	100	67.6 Å²	67.6	38%	0.377	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	159.3	-169.3	-50.3	-167.9	173.7	-151	0.9	119.3	E508 F535 I536 D568 E584	E508-R586 IonicContact OE1-CZ 3.84Å; E508-R586 IonicContact OE1-NH1 2.71Å; E508-R586 PolarHBondContact OE1-NH1 3.32Å; F535-R586 CarbonylContact O-C 3.53Å; F535-R586 WeakPolarHBondContact O-CA 3.13Å; I536-R586 HydrophobicContact CB-CG 4.27Å; I536-R586 HydrophobicContact CG1-CG 3.93Å; I536-R586 HydrophobicContact CG2-CG 4.1Å; D568-R586 WeakPolarHBondContact CB-O 3.08Å; D568-R586 VanDerWaalsContact CG-O 3.29Å; D568-R586 PolarHBondContact OD2-N 3.49Å; E584-R586 IonicContact OE1-CZ 2.8Å; E584-R586 IonicContact OE1-NE 2.75Å; E584-R586 PolarHBondContact OE1-NE 3.1Å; E584-R586 IonicContact OE1-NH2 3.67Å; E584-R586 PolarHBondContact OE1-NH2 2.92Å
587	I	87.6	Confident	76.3	Confident	17 Å²	17	66.3 Å²	66.3	9%	0.087	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	167.9	179.4	57.7	162	0	0	0	117.2	T534 F535 W550 L566 I600	T534-I587 CarbonylContact C-O 3.55Å; T534-I587 VanDerWaalsContact CA-O 3.31Å; T534-I587 WeakPolarHBondContact CA-O 3.39Å; T534-I587 VanDerWaalsContact CG2-O 3.22Å; T534-I587 WeakPolarHBondContact CG2-O 3.26Å; F535-I587 HydrophobicContact CB-CD1 4.27Å; F535-I587 HydrophobicContact CB-CG1 3.82Å; F535-I587 HydrophobicContact CD2-CD1 4.4Å; F535-I587 HydrophobicContact CD2-CG1 4.36Å; F535-I587 HydrophobicContact CG-CG1 4.47Å; F535-I587 PolarHBondContact N-O 2.86Å; F535-I587 PolarHBondContact O-N 2.92Å; W550-I587 HydrophobicContact CB-CD1 4.33Å; W550-I587 HydrophobicContact CB-CG2 4.03Å; W550-I587 HydrophobicContact CD2-CD1 3.7Å; W550-I587 HydrophobicContact CD2-CG1 3.84Å; W550-I587 HydrophobicContact CD2-CG2 3.94Å; W550-I587 HydrophobicContact CE3-CD1 3.37Å; W550-I587 HydrophobicContact CE3-CG1 3.85Å; W550-I587 HydrophobicContact CG-CD1 4.17Å; W550-I587 HydrophobicContact CG-CG1 4.38Å; W550-I587 HydrophobicContact CG-CG2 3.62Å; W550-I587 HydrophobicContact CH2-CD1 4.42Å; W550-I587 HydrophobicContact CH2-CG1 4.14Å; W550-I587 HydrophobicContact CZ2-CG1 4.13Å; W550-I587 HydrophobicContact CZ3-CD1 3.78Å; W550-I587 HydrophobicContact CZ3-CG1 4.02Å; L566-I587 HydrophobicContact CB-CG2 3.85Å; L566-I587 HydrophobicContact CD1-CB 4.41Å; L566-I587 HydrophobicContact CD1-CD1 3.53Å; L566-I587 HydrophobicContact CD1-CG2 4.47Å; I587-I600 HydrophobicContact CD1-CG2 3.97Å
588	Q	83.3	Confident	77.3	Confident	142 Å²	142	63.6 Å²	63.6	66%	0.664	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.5	146.1	-178.5	-68.9	-178.4	-19.5	0	0	117.1	K533 T534	K533-Q588 CarbonylContact O-C 3.52Å; K533-Q588 WeakPolarHBondContact O-CA 3.34Å; T534-Q588 HydrophobicContact CG2-CG 3.66Å
589	I	80.5	Confident	78.6	Confident	34 Å²	34	64.6 Å²	64.6	17%	0.174	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	164.2	-172.2	-54.7	-175.9	0	0	0	114.8	M532 K533 F552 L566 I600	M532-I589 CarbonylContact C-O 3.59Å; M532-I589 WeakPolarHBondContact CA-O 3.46Å; M532-I589 WeakPolarHBondContact CG-O 3.27Å; K533-I589 PolarHBondContact N-O 3.37Å; K533-I589 PolarHBondContact O-N 3.37Å; F552-I589 HydrophobicContact CD2-CD1 3.84Å; F552-I589 HydrophobicContact CE2-CD1 4.45Å; F552-I589 HydrophobicContact CE2-CG2 4.45Å; L566-I589 HydrophobicContact CD1-CD1 3.96Å; L566-I589 HydrophobicContact CD1-CG1 4.44Å; I589-I600 HydrophobicContact CD1-CD1 3.67Å; I589-I600 HydrophobicContact CD1-CG1 3.77Å
590	T	82.8	Confident	79.9	Confident	82 Å²	82	59.2 Å²	59.2	50%	0.503	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	151.2	177.1	-48.6	0	0	0	0	112.9	E531	E531-T590 CarbonylContact O-C 3.56Å; E531-T590 VanDerWaalsContact O-CA 3.23Å; E531-T590 WeakPolarHBondContact O-CA 3.37Å; E531-T590 VanDerWaalsContact O-CG2 3.24Å; E531-T590 WeakPolarHBondContact O-CG2 3.23Å
591	V	77.4	Confident	81	Confident	20 Å²	20	59.4 Å²	59.4	12%	0.121	28%	0.277	C	S	.	.			trans	-131.2	149	-161.3	-165	0	0	0	0	115.7	A527 G530 E531 D595 L618	A527-V591 HydrophobicContact CB-CB 4.14Å; A527-V591 HydrophobicContact CB-CG1 4.02Å; A527-V591 HydrophobicContact CB-CG2 4.18Å; G530-V591 VanDerWaalsContact CA-O 3.25Å; G530-V591 WeakPolarHBondContact CA-O 3.5Å; G530-V591 PolarHBondContact N-O 2.79Å; E531-V591 PolarHBondContact N-O 3.07Å; E531-V591 PolarHBondContact O-N 2.88Å; V591-D595 WeakPolarHBondContact CA-OD2 3.44Å; V591-D595 HydrophobicContact CG1-CB 3.99Å; V591-L618 HydrophobicContact CG1-CD1 4.37Å
592	R	77.7	Confident	81.7	Confident	148 Å²	148	55.1 Å²	55.1	56%	0.558	26%	0.259	S	S	*	.			trans	-135.7	171.7	-174.4	-52.3	174.4	-173.7	-172.8	2.3	113.6	E594 D595	R592-E594 HydrophobicContact CB-CG 3.67Å; R592-E594 WeakPolarHBondContact CD-OE1 3.44Å; R592-E594 HydrophobicContact CG-CG 4.43Å; R592-E594 IonicContact CZ-OE1 3.76Å; R592-E594 IonicContact NE-OE1 3.95Å; R592-E594 IonicContact NH1-OE1 2.6Å; R592-E594 PolarHBondContact NH1-OE1 2.91Å; R592-E594 PolarHBondContact O-N 2.87Å; R592-D595 WeakPolarHBondContact CB-OD2 2.98Å; R592-D595 VanDerWaalsContact CG-OD2 3.23Å; R592-D595 WeakPolarHBondContact CG-OD2 3.28Å; R592-D595 PolarHBondContact N-OD2 3.27Å; R592-D595 PolarHBondContact O-N 2.94Å
593	P	71.1	Confident	82	Confident	92 Å²	92	51.9 Å²	51.9	60%	0.597	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-20.9	172.3	-15.7	27.4	0	0	0	114.5	A529	A529-P593 HydrophobicContact CB-CB 4.48Å; A529-P593 HydrophobicContact CB-CG 3.6Å
594	E	74.1	Confident	82	Confident	138 Å²	138	51.8 Å²	51.8	65%	0.645	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-6.2	-178.1	54.3	-171.1	-156.3	0	0	113.2	R592	R592-E594 HydrophobicContact CB-CG 3.67Å; R592-E594 WeakPolarHBondContact CD-OE1 3.44Å; R592-E594 HydrophobicContact CG-CG 4.43Å; R592-E594 IonicContact CZ-OE1 3.76Å; R592-E594 IonicContact NE-OE1 3.95Å; R592-E594 IonicContact NH1-OE1 2.6Å; R592-E594 PolarHBondContact NH1-OE1 2.91Å; R592-E594 PolarHBondContact O-N 2.87Å
595	D	76.4	Confident	81.6	Confident	37 Å²	37	55.6 Å²	55.6	20%	0.198	26%	0.26	C	S	.	.			trans	-92.8	3.8	175.2	-63.9	-50.8	0	0	0	112.8	V591 R592 R597 S598	V591-D595 WeakPolarHBondContact CA-OD2 3.44Å; V591-D595 HydrophobicContact CG1-CB 3.99Å; R592-D595 WeakPolarHBondContact CB-OD2 2.98Å; R592-D595 VanDerWaalsContact CG-OD2 3.23Å; R592-D595 WeakPolarHBondContact CG-OD2 3.28Å; R592-D595 PolarHBondContact N-OD2 3.27Å; R592-D595 PolarHBondContact O-N 2.94Å; D595-R597 PolarHBondContact O-N 3.3Å; D595-S598 WeakPolarHBondContact O-CB 3.39Å; D595-S598 PolarHBondContact O-N 3.49Å; D595-S598 PolarHBondContact O-OG 3.13Å
596	D	76.2	Confident	80.6	Confident	40 Å²	40	56.7 Å²	56.7	21%	0.214	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	123.2	179.4	-169.3	63.7	0	0	0	110.8	A555 D619	A555-D596 WeakPolarHBondContact CB-O 3.49Å; D596-D619 WeakPolarHBondContact OD1-CA 3.24Å
597	R	78.4	Confident	79.3	Confident	111 Å²	111	58.5 Å²	58.5	42%	0.419	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	29.6	-179.4	-51.7	164.7	174.7	-167	-1	116.6	A555 D595 L618 D619	A555-R597 HydrophobicContact CB-CB 4.35Å; D595-R597 PolarHBondContact O-N 3.3Å; R597-L618 VanDerWaalsContact CG-O 3.24Å; R597-L618 WeakPolarHBondContact CG-O 3.09Å; R597-L618 PolarHBondContact N-O 3.43Å; R597-D619 IonicContact CZ-OD1 3.19Å; R597-D619 IonicContact NE-OD1 3.16Å; R597-D619 PolarHBondContact NE-OD1 3.23Å; R597-D619 IonicContact NE-OD2 2.74Å; R597-D619 IonicContact NH2-OD1 2.94Å; R597-D619 PolarHBondContact NH2-OD1 3.42Å
598	S	83	Confident	78	Confident	11 Å²	11	61.5 Å²	61.5	8%	0.077	33%	0.325	C	S	.	.			trans	-82.7	169.2	170	55.6	0	0	0	0	114.1	Q553 D595	Q553-S598 WeakPolarHBondContact O-CB 3.02Å; D595-S598 WeakPolarHBondContact O-CB 3.39Å; D595-S598 PolarHBondContact O-N 3.49Å; D595-S598 PolarHBondContact O-OG 3.13Å
599	Y	85.6	Confident	76.6	Confident	56 Å²	56	57.5 Å²	57.5	22%	0.22	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	156.3	-171	-66.7	-88.9	0	0	0	116.7	E522 F552 Q553 R615 V616 R617	E522-Y599 WeakPolarHBondContact OE2-CE1 3.46Å; E522-Y599 PolarHBondContact OE2-OH 3.41Å; F552-Y599 WeakPolarHBondContact CA-O 3.32Å; F552-Y599 WeakPolarHBondContact CD2-O 3.43Å; Q553-Y599 PolarHBondContact N-O 3.15Å; Q553-Y599 PolarHBondContact O-N 3Å; Y599-R615 HydrophobicContact CD1-CG 3.77Å; Y599-R615 HydrophobicContact CE1-CG 4.4Å; Y599-V616 VanDerWaalsContact CA-O 3.25Å; Y599-V616 WeakPolarHBondContact CA-O 3.01Å; Y599-V616 WeakPolarHBondContact CD1-O 3.45Å; Y599-R617 HydrophobicContact CD1-CB 4.14Å; Y599-R617 HydrophobicContact CD1-CG 4.37Å; Y599-R617 HydrophobicContact CE1-CB 3.85Å; Y599-R617 HydrophobicContact CE1-CG 3.74Å
600	I	87	Confident	75.5	Confident	15 Å²	15	59.7 Å²	59.7	8%	0.077	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	140.6	175.4	-59.8	157.3	0	0	0	109.9	F535 W550 L551 F552 I587 I589 R615 V616	F535-I600 HydrophobicContact CD1-CD1 4.49Å; F535-I600 HydrophobicContact CD2-CD1 4.26Å; F535-I600 HydrophobicContact CE1-CD1 3.78Å; F535-I600 HydrophobicContact CE2-CD1 3.52Å; F535-I600 HydrophobicContact CZ-CD1 3.25Å; W550-I600 HydrophobicContact CE3-CG2 4.43Å; L551-I600 WeakPolarHBondContact O-CA 3.41Å; F552-I600 HydrophobicContact CD2-CG1 3.9Å; I587-I600 HydrophobicContact CD1-CG2 3.97Å; I589-I600 HydrophobicContact CD1-CD1 3.67Å; I589-I600 HydrophobicContact CD1-CG1 3.77Å; I600-R615 CarbonylContact O-C 3.59Å; I600-R615 WeakPolarHBondContact O-CA 3.41Å; I600-V616 PolarHBondContact N-O 2.94Å; I600-V616 PolarHBondContact O-N 3.42Å; I600-V616 VanDerWaalsContact O-N 3.07Å
601	D	87.1	Confident	74.7	Confident	8 Å²	8	63.1 Å²	63.1	4%	0.043	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	147.4	177.4	-57.3	-38.7	0	0	0	114.3	W550 L551 Q553 L603 S614 R615	W550-D601 CarbonylContact C-O 3.57Å; W550-D601 VanDerWaalsContact CA-O 3.32Å; W550-D601 WeakPolarHBondContact CA-O 3.29Å; L551-D601 HydrophobicContact CB-CB 4.26Å; L551-D601 PolarHBondContact N-O 2.53Å; L551-D601 PolarHBondContact O-N 2.89Å; Q553-D601 PolarHBondContact NE2-OD2 2.66Å; D601-L603 HydrophobicContact CB-CD2 4.49Å; D601-S614 CarbonylContact C-O 3.59Å; D601-S614 VanDerWaalsContact CA-O 3.26Å; D601-S614 WeakPolarHBondContact CA-O 3.28Å; D601-R615 VanDerWaalsContact CG-NH2 3.29Å; D601-R615 IonicContact OD1-CZ 3.23Å; D601-R615 IonicContact OD1-NE 3.97Å; D601-R615 PolarHBondContact OD1-NE 2.65Å; D601-R615 IonicContact OD1-NH2 3.56Å; D601-R615 PolarHBondContact OD1-NH2 1.8Å; D601-R615 IonicContact OD2-CZ 3.1Å; D601-R615 IonicContact OD2-NH2 2.69Å; D601-R615 PolarHBondContact OD2-NH2 3.26Å
602	C	87.2	Confident	74.2	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	144.5	159.9	-177.1	0	0	0	0	111	I505 C537 I548 K549 W550 D613 S614	I505-C602 HydrophobicContact CD1-CB 3.51Å; I505-C602 HydrophobicContact CG1-CB 3.69Å; C537-C602 HydrophobicContact CB-CB 3.91Å; C537-C602 WeakPolarHBondContact CB-SG 3.14Å; C537-C602 WeakPolarHBondContact SG-CB 3.44Å; C537-C602 CovalentContact SG-SG 2.05Å; C537-C602 PolarHBondContact SG-SG 3.5Å; I548-C602 VanDerWaalsContact CG2-SG 3.58Å; K549-C602 CarbonylContact O-C 3.6Å; K549-C602 WeakPolarHBondContact O-CA 3.49Å; W550-C602 HydrophobicContact CD2-CB 4.25Å; W550-C602 HydrophobicContact CE3-CB 3.82Å; W550-C602 HydrophobicContact CH2-CB 4.32Å; W550-C602 HydrophobicContact CZ3-CB 3.85Å; C602-D613 CarbonylContact O-C 3.55Å; C602-D613 VanDerWaalsContact O-CA 3.27Å; C602-D613 WeakPolarHBondContact O-CA 3.34Å; C602-S614 PolarHBondContact N-O 2.76Å; C602-S614 PolarHBondContact O-N 3.11Å
603	L	85.1	Confident	73.9	Confident	5 Å²	5	62.4 Å²	62.4	3%	0.026	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	136.6	-173.7	-47.5	174.2	0	0	0	111.1	I548 K549 L551 D601 R611 I612 D613	I548-L603 CarbonylContact C-O 3.05Å; I548-L603 WeakPolarHBondContact CA-O 3.23Å; K549-L603 HydrophobicContact CB-CB 4.38Å; K549-L603 HydrophobicContact CD-CD1 4.44Å; K549-L603 HydrophobicContact CG-CD1 4.42Å; K549-L603 PolarHBondContact N-O 3.1Å; K549-L603 PolarHBondContact O-N 2.86Å; L551-L603 HydrophobicContact CD1-CD1 4Å; L551-L603 HydrophobicContact CG-CD1 4.44Å; D601-L603 HydrophobicContact CB-CD2 4.49Å; L603-R611 VanDerWaalsContact CD2-NH2 3.3Å; L603-I612 CarbonylContact C-O 3.54Å; L603-D613 HydrophobicContact CD2-CB 3.52Å
604	V	79.9	Confident	74.3	Confident	5 Å²	5	59.2 Å²	59.2	3%	0.03	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	145.1	-178.9	-177.5	0	0	0	0	112.3	V503 T539 A546 T547 I548 R611 I612	V503-V604 HydrophobicContact CB-CG2 4.46Å; V503-V604 HydrophobicContact CG1-CB 4.39Å; V503-V604 HydrophobicContact CG1-CG2 3.64Å; V503-V604 HydrophobicContact CG2-CB 3.83Å; V503-V604 HydrophobicContact CG2-CG1 4.13Å; V503-V604 HydrophobicContact CG2-CG2 3.91Å; T539-V604 HydrophobicContact CG2-CG1 3.94Å; A546-V604 HydrophobicContact CB-CG1 4.18Å; T547-V604 VanDerWaalsContact O-CA 3.25Å; T547-V604 WeakPolarHBondContact O-CA 3.37Å; I548-V604 HydrophobicContact CG1-CG2 4.17Å; I548-V604 HydrophobicContact CG2-CG2 4.23Å; V604-R611 WeakPolarHBondContact O-CA 3.26Å; V604-I612 PolarHBondContact N-O 3.36Å; V604-I612 PolarHBondContact O-N 2.9Å
605	W	76.2	Confident	74.9	Confident	100 Å²	100	57.2 Å²	57.2	38%	0.379	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	169	174.2	65	96.8	0	0	0	113.3	A546 T547 K549	A546-W605 CarbonylContact C-O 3.48Å; A546-W605 VanDerWaalsContact CA-O 3.28Å; A546-W605 WeakPolarHBondContact CA-O 3.15Å; T547-W605 HydrophobicContact CG2-CH2 3.67Å; T547-W605 HydrophobicContact CG2-CZ2 3.39Å; T547-W605 HydrophobicContact CG2-CZ3 4.4Å; T547-W605 PolarHBondContact N-O 2.94Å; T547-W605 PolarHBondContact O-N 3.38Å; K549-W605 HydrophobicContact CB-CH2 4.25Å; K549-W605 HydrophobicContact CB-CZ3 4.08Å
606	S	67.8	Low	75.3	Confident	29 Å²	29	55.7 Å²	55.7	20%	0.203	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	167.9	178.7	160.6	0	0	0	0	110.2	G608 D609	S606-G608 PolarHBondContact O-N 2.87Å; S606-D609 WeakPolarHBondContact CB-OD2 3.23Å; S606-D609 PolarHBondContact O-N 2.89Å; S606-D609 PolarHBondContact OG-OD2 3.42Å
607	V	61.7	Low	75.8	Confident	138 Å²	138	54.2 Å²	54.2	84%	0.836	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	94.8	-176.5	-176.1	0	0	0	0	111
608	G	58.6	Low	75.9	Confident	81 Å²	81	49.9 Å²	49.9	84%	0.835	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.8	-4.5	178.7	0	0	0	0	0	114.6	S606	S606-G608 PolarHBondContact O-N 2.87Å
609	D	55.5	Low	75.7	Confident	58 Å²	58	51.5 Å²	51.5	31%	0.31	28%	0.283	S	S	.	.	S	Bend	trans	-105	165.3	-173.8	-62.2	-59.9	0	0	0	113.6	A499 P500 S606	A499-D609 HydrophobicContact CB-CB 4.3Å; A499-D609 WeakPolarHBondContact CB-OD1 3.11Å; P500-D609 WeakPolarHBondContact CD-OD2 3.41Å; P500-D609 HydrophobicContact CG-CB 4.48Å; S606-D609 WeakPolarHBondContact CB-OD2 3.23Å; S606-D609 PolarHBondContact O-N 2.89Å; S606-D609 PolarHBondContact OG-OD2 3.42Å
610	A	57.2	Low	75.3	Confident	80 Å²	80	54.7 Å²	54.7	66%	0.661	30%	0.303	S	S	*	.			trans	-65.3	147.7	174.7	0	0	0	0	0	112.6
611	R	66.3	Low	74.5	Confident	154 Å²	154	59.7 Å²	59.7	58%	0.581	33%	0.329	S	S	*	.			trans	-75.3	133.5	170	166.9	176.5	154.5	177.7	-8.7	110.1	L603 V604	L603-R611 VanDerWaalsContact CD2-NH2 3.3Å; V604-R611 WeakPolarHBondContact O-CA 3.26Å
612	I	66.4	Low	73.4	Confident	50 Å²	50	64.2 Å²	64.2	26%	0.256	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	140	177.1	-55.7	174.3	0	0	0	108.6	P500 V503 L603 V604	P500-I612 HydrophobicContact CB-CD1 4.43Å; V503-I612 HydrophobicContact CB-CG2 3.86Å; V503-I612 HydrophobicContact CG2-CB 3.97Å; V503-I612 HydrophobicContact CG2-CD1 4.27Å; V503-I612 HydrophobicContact CG2-CG2 3.68Å; L603-I612 CarbonylContact C-O 3.54Å; V604-I612 PolarHBondContact N-O 3.36Å; V604-I612 PolarHBondContact O-N 2.9Å
613	D	72.1	Confident	71.9	Confident	102 Å²	102	66.9 Å²	66.9	55%	0.545	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	167	-177.8	61.7	-19.5	0	0	0	114.8	C602 L603	C602-D613 CarbonylContact O-C 3.55Å; C602-D613 VanDerWaalsContact O-CA 3.27Å; C602-D613 WeakPolarHBondContact O-CA 3.34Å; L603-D613 HydrophobicContact CD2-CB 3.52Å
614	S	79.5	Confident	71.2	Confident	26 Å²	26	68 Å²	68	18%	0.182	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	152.8	-179.8	-158.7	0	0	0	0	111.4	I505 D601 C602	I505-S614 WeakPolarHBondContact CD1-O 3.43Å; D601-S614 CarbonylContact C-O 3.59Å; D601-S614 VanDerWaalsContact CA-O 3.26Å; D601-S614 WeakPolarHBondContact CA-O 3.28Å; C602-S614 PolarHBondContact N-O 2.76Å; C602-S614 PolarHBondContact O-N 3.11Å
615	R	85.4	Confident	71.2	Confident	96 Å²	96	71 Å²	71	36%	0.362	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	162.4	-158.4	172.7	168.9	-75.3	-135.2	-13.3	115.9	K523 Y599 I600 D601	K523-R615 VanDerWaalsContact CB-O 3.22Å; K523-R615 WeakPolarHBondContact CB-O 3.41Å; Y599-R615 HydrophobicContact CD1-CG 3.77Å; Y599-R615 HydrophobicContact CE1-CG 4.4Å; I600-R615 CarbonylContact O-C 3.59Å; I600-R615 WeakPolarHBondContact O-CA 3.41Å; D601-R615 VanDerWaalsContact CG-NH2 3.29Å; D601-R615 IonicContact OD1-CZ 3.23Å; D601-R615 IonicContact OD1-NE 3.97Å; D601-R615 PolarHBondContact OD1-NE 2.65Å; D601-R615 IonicContact OD1-NH2 3.56Å; D601-R615 PolarHBondContact OD1-NH2 1.8Å; D601-R615 IonicContact OD2-CZ 3.1Å; D601-R615 IonicContact OD2-NH2 2.69Å; D601-R615 PolarHBondContact OD2-NH2 3.26Å
616	V	85.2	Confident	71.5	Confident	4 Å²	4	71 Å²	71	2%	0.024	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	0	179.5	-164	0	0	0	0	117.5	I512 K523 A525 F535 Y599 I600	I512-V616 HydrophobicContact CD1-CG2 4.24Å; I512-V616 HydrophobicContact CG2-CG1 4.31Å; K523-V616 HydrophobicContact CB-CG2 4.42Å; K523-V616 CarbonylContact O-C 3.56Å; K523-V616 WeakPolarHBondContact O-CA 3.14Å; A525-V616 HydrophobicContact CB-CG1 3.73Å; F535-V616 HydrophobicContact CD1-CG2 4.49Å; F535-V616 HydrophobicContact CE1-CB 4.45Å; F535-V616 HydrophobicContact CE1-CG1 4.35Å; F535-V616 HydrophobicContact CE1-CG2 4.19Å; Y599-V616 VanDerWaalsContact CA-O 3.25Å; Y599-V616 WeakPolarHBondContact CA-O 3.01Å; Y599-V616 WeakPolarHBondContact CD1-O 3.45Å; I600-V616 PolarHBondContact N-O 2.94Å; I600-V616 PolarHBondContact O-N 3.42Å; I600-V616 VanDerWaalsContact O-N 3.07Å
617	R	86.3	Confident	72.5	Confident	10 Å²	10	70.3 Å²	70.3	4%	0.038	39%	0.391	C	S	.	.	B	Isolated β-bridge		0	0	0	-166.2	-149.4	79.8	76.3	-3.6	120.4	D515 T517 E522 K523 V524 A525 Y599 D619	D515-R617 IonicContact OD2-CZ 2.7Å; D515-R617 IonicContact OD2-NE 2.57Å; D515-R617 IonicContact OD2-NH2 3.84Å; D515-R617 PolarHBondContact OD2-NH2 3Å; T517-R617 VanDerWaalsContact CG2-CZ 3.49Å; E522-R617 WeakPolarHBondContact OE2-CD 3.48Å; K523-R617 PolarHBondContact O-N 3.18Å; V524-R617 CarbonylContact C-O 3.5Å; V524-R617 VanDerWaalsContact CA-O 3.29Å; V524-R617 WeakPolarHBondContact CA-O 3.44Å; V524-R617 WeakPolarHBondContact CG1-O 3.35Å; V524-R617 HydrophobicContact CG2-CB 3.81Å; V524-R617 HydrophobicContact CG2-CG 4.49Å; A525-R617 PolarHBondContact N-O 3.45Å; Y599-R617 HydrophobicContact CD1-CB 4.14Å; Y599-R617 HydrophobicContact CD1-CG 4.37Å; Y599-R617 HydrophobicContact CE1-CB 3.85Å; Y599-R617 HydrophobicContact CE1-CG 3.74Å; R617-D619 IonicContact CZ-OD2 2.73Å; R617-D619 VanDerWaalsContact CZ-OD2 3.24Å; R617-D619 IonicContact NH1-OD2 3.25Å; R617-D619 PolarHBondContact NH1-OD2 3.19Å; R617-D619 IonicContact NH2-OD2 3.15Å; R617-D619 PolarHBondContact NH2-OD2 3.24Å
618	L	80.3	Confident	73.7	Confident	19 Å²	19	71.1 Å²	71.1	10%	0.099	38%	0.383	C	S	.	.				0	0	0	63.1	130.5	0	0	0	122.8	V591 R597	V591-L618 HydrophobicContact CG1-CD1 4.37Å; R597-L618 VanDerWaalsContact CG-O 3.24Å; R597-L618 WeakPolarHBondContact CG-O 3.09Å; R597-L618 PolarHBondContact N-O 3.43Å
619	D	79.9	Confident	75.1	Confident	45 Å²	45	69.6 Å²	69.6	24%	0.241	36%	0.356	C	S	.	.				0	0	0	-96	-71.9	0	0	0	123.8	D596 R597 R617	D596-D619 WeakPolarHBondContact OD1-CA 3.24Å; R597-D619 IonicContact CZ-OD1 3.19Å; R597-D619 IonicContact NE-OD1 3.16Å; R597-D619 PolarHBondContact NE-OD1 3.23Å; R597-D619 IonicContact NE-OD2 2.74Å; R597-D619 IonicContact NH2-OD1 2.94Å; R597-D619 PolarHBondContact NH2-OD1 3.42Å; R617-D619 IonicContact CZ-OD2 2.73Å; R617-D619 VanDerWaalsContact CZ-OD2 3.24Å; R617-D619 IonicContact NH1-OD2 3.25Å; R617-D619 PolarHBondContact NH1-OD2 3.19Å; R617-D619 IonicContact NH2-OD2 3.15Å; R617-D619 PolarHBondContact NH2-OD2 3.24Å
620	I	77.3	Confident	76.6	Confident	123 Å²	123	71.1 Å²	71.1	63%	0.631	37%	0.367	S	S	*	.				0	0	0	-58.5	-179.2	0	0	0	122.3
621	I	69.9	Low	77.7	Confident	121 Å²	121	69.9 Å²	69.9	62%	0.621	36%	0.362	S	S	*	.				0	0	0	61.8	165.9	0	0	0	124.8	P655 T705	I621-P655 HydrophobicContact CB-CG 3.94Å; I621-P655 HydrophobicContact CG2-CG 3.99Å; I621-T705 HydrophobicContact CD1-CG2 4.36Å
622	H	64.5	Low	78.7	Confident	103 Å²	103	65 Å²	65	48%	0.477	34%	0.344	S	S	.	.				0	0	0	62.7	142	0	0	0	125.7	N654 N704 T705 A706	H622-N654 CarbonylContact C-O 3.55Å; H622-N654 WeakPolarHBondContact CA-O 3.03Å; H622-N654 PolarHBondContact CD2-O 3.46Å; H622-N654 PolarHBondContact NE2-ND2 2.7Å; H622-N704 PolarHBondContact O-ND2 2.82Å; H622-T705 PolarHBondContact O-OG1 3.1Å; H622-A706 VanDerWaalsContact O-CB 3.23Å; H622-A706 WeakPolarHBondContact O-CB 3.29Å; H622-A706 PolarHBondContact O-N 3.4Å
623	P	54.3	Low	79.3	Confident	55 Å²	55	71.1 Å²	71.1	36%	0.357	37%	0.369	S	S	.	.				0	0	0	27.7	-1.1	0	0	0	125.3	G653 N654 N704 A706	P623-G653 CarbonylContact O-C 3.58Å; P623-G653 VanDerWaalsContact O-C 3.26Å; P623-G653 WeakPolarHBondContact O-CA 3.23Å; P623-N654 WeakPolarHBondContact CD-O 3.46Å; P623-N654 PolarHBondContact O-N 2.9Å; P623-N704 VanDerWaalsContact CA-CG 3.48Å; P623-N704 WeakPolarHBondContact CA-ND2 3.29Å; P623-N704 VanDerWaalsContact CA-OD1 3.23Å; P623-N704 WeakPolarHBondContact CA-OD1 3.38Å; P623-N704 PolarHBondContact O-ND2 2.83Å; P623-N704 VanDerWaalsContact O-ND2 3.15Å; P623-A706 HydrophobicContact CB-CB 4.05Å
624	P	71.4	Confident	79.9	Confident	29 Å²	29	69.9 Å²	69.9	19%	0.188	37%	0.369	C	S	.	.	B	Isolated β-bridge		0	178.3	0	47.4	-29	0	0	0	127.4	G652 P657 N704 T707	P624-G652 CarbonylContact C-O 3.52Å; P624-G652 WeakPolarHBondContact CA-O 3.26Å; P624-P657 HydrophobicContact CB-CB 3.82Å; P624-N704 HydrophobicContact CB-CB 3.58Å; P624-N704 WeakPolarHBondContact CD-OD1 3.5Å; P624-N704 HydrophobicContact CG-CB 3.85Å; P624-N704 VanDerWaalsContact CG-CG 3.47Å; P624-N704 WeakPolarHBondContact CG-OD1 3.4Å; P624-T707 HydrophobicContact CG-CG2 3.5Å
625	D	78.6	Confident	79.8	Confident	68 Å²	68	70.6 Å²	70.6	36%	0.364	38%	0.38	S	S	.	.			trans	-146.7	0	169	46.2	-82.4	0	0	0	124.5	T650 T651 G652 A702	D625-T650 PolarHBondContact O-OG1 2.89Å; D625-T651 CarbonylContact C-O 3.5Å; D625-T651 WeakPolarHBondContact CA-O 3.33Å; D625-T651 WeakPolarHBondContact CB-O 3.3Å; D625-T651 PolarHBondContact N-O 3.11Å; D625-T651 WeakPolarHBondContact OD2-CB 3.36Å; D625-T651 VanDerWaalsContact OD2-O 3.06Å; D625-T651 PolarHBondContact OD2-OG1 3.31Å; D625-G652 PolarHBondContact N-O 3.35Å; D625-G652 VanDerWaalsContact OD1-CA 3.25Å; D625-G652 WeakPolarHBondContact OD1-CA 3.48Å; D625-G652 WeakPolarHBondContact OD2-CA 3.41Å; D625-G652 PolarHBondContact OD2-N 3.39Å; D625-A702 WeakPolarHBondContact O-CB 3.5Å
626	I	84.1	Confident	79.8	Confident	100 Å²	100	72.5 Å²	72.5	51%	0.513	39%	0.393	S	S	.	.				0	0	0	-45.9	167	0	0	0	124.6	T650 T651 I712	I626-T650 WeakPolarHBondContact CA-OG1 3.3Å; I626-T650 PolarHBondContact N-OG1 3.14Å; I626-T650 CarbonylContact O-C 3.5Å; I626-T650 WeakPolarHBondContact O-CA 3.32Å; I626-T650 PolarHBondContact O-OG1 2.88Å; I626-T651 PolarHBondContact N-O 3Å; I626-T651 PolarHBondContact N-OG1 3.16Å; I626-T651 PolarHBondContact O-N 3.08Å; I626-I712 HydrophobicContact CB-CD1 4.29Å; I626-I712 HydrophobicContact CD1-CD1 4.5Å; I626-I712 HydrophobicContact CG1-CD1 3.68Å; I626-I712 HydrophobicContact CG2-CD1 4.13Å; I626-I712 HydrophobicContact CG2-CG2 4.07Å
627	P	87.3	Confident	79.8	Confident	15 Å²	15	76.7 Å²	76.7	10%	0.097	42%	0.42	C	S	.	.				0	0	0	45.7	-34.9	0	0	0	128.4	T649 L659 A702 I712	P627-T649 CarbonylContact C-O 3.46Å; P627-T649 WeakPolarHBondContact CA-O 3.44Å; P627-T649 WeakPolarHBondContact CB-O 3.33Å; P627-L659 HydrophobicContact CB-CD2 3.64Å; P627-A702 HydrophobicContact CB-CB 4.25Å; P627-A702 HydrophobicContact CG-CB 3.96Å; P627-I712 VanDerWaalsContact CG-O 3.24Å; P627-I712 WeakPolarHBondContact CG-O 3.25Å
628	K	86.7	Confident	79.6	Confident	154 Å²	154	77.9 Å²	77.9	67%	0.67	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)		0	0	0	-63.5	-160.2	176.8	-174.7	0	121.4	C648 T649 C700	K628-C648 CarbonylContact O-C 3.58Å; K628-C648 VanDerWaalsContact O-C 3.24Å; K628-C648 WeakPolarHBondContact O-CA 3.35Å; K628-C648 WeakPolarHBondContact O-CB 3.27Å; K628-C648 PolarHBondContact O-SG 2.73Å; K628-T649 PolarHBondContact N-O 2.96Å; K628-T649 PolarHBondContact O-N 3.02Å; K628-C700 PolarHBondContact O-SG 2.95Å; K628-C700 VanDerWaalsContact O-SG 3.34Å
629	I	89	Confident	79.7	Confident	49 Å²	49	80.3 Å²	80.3	25%	0.251	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)		0	0	0	-148.9	174.4	0	0	0	125.7	T647 C648 W661 C700 E715	I629-T647 CarbonylContact C-O 3.19Å; I629-T647 VanDerWaalsContact CA-O 3.32Å; I629-T647 WeakPolarHBondContact CA-O 3.43Å; I629-C648 HydrophobicContact CG1-CB 4.32Å; I629-W661 HydrophobicContact CD1-CD2 4.44Å; I629-W661 HydrophobicContact CD1-CE3 3.96Å; I629-W661 HydrophobicContact CD1-CH2 3.59Å; I629-W661 HydrophobicContact CD1-CZ2 4.09Å; I629-W661 HydrophobicContact CD1-CZ3 3.51Å; I629-W661 HydrophobicContact CG1-CE3 4.46Å; I629-W661 HydrophobicContact CG1-CH2 3.27Å; I629-W661 HydrophobicContact CG1-CZ2 3.53Å; I629-W661 HydrophobicContact CG1-CZ3 3.79Å; I629-C700 HydrophobicContact CD1-CB 4Å; I629-C700 HydrophobicContact CG1-CB 4.34Å; I629-E715 WeakPolarHBondContact CD1-O 3.38Å
630	T	87.8	Confident	79.6	Confident	90 Å²	90	79.7 Å²	79.7	55%	0.552	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)		0	162.4	0	53.4	0	0	0	0	120.1	L646 T647	T630-L646 CarbonylContact O-C 3.48Å; T630-L646 WeakPolarHBondContact O-CA 3.19Å; T630-L646 WeakPolarHBondContact O-CB 3.12Å; T630-T647 PolarHBondContact N-O 3.1Å; T630-T647 PolarHBondContact O-N 2.83Å; T630-T647 WeakPolarHBondContact OG1-CB 3.26Å; T630-T647 PolarHBondContact OG1-O 2.57Å
631	G	79.1	Confident	79.4	Confident	54 Å²	54	77.2 Å²	77.2	56%	0.557	44%	0.436	S	S	*	.			trans	167.1	-58.7	159.9	0	0	0	0	0	129.7
632	Y	86.5	Confident	79.8	Confident	51 Å²	51	76.2 Å²	76.2	20%	0.2	43%	0.428	C	S	.	.			trans	-136.8	175.6	-161	157.5	-100.9	0	0	0	115.6	G635 L644 T718 L719	Y632-G635 PolarHBondContact OH-N 3.29Å; Y632-L644 HydrophobicContact CD1-CD2 4.23Å; Y632-L644 HydrophobicContact CD2-CD1 3.51Å; Y632-L644 HydrophobicContact CD2-CD2 3.71Å; Y632-L644 HydrophobicContact CD2-CG 4.22Å; Y632-L644 HydrophobicContact CE1-CD2 4.39Å; Y632-L644 HydrophobicContact CE2-CD1 4.16Å; Y632-L644 HydrophobicContact CE2-CD2 3.88Å; Y632-L644 HydrophobicContact CG-CD1 4.07Å; Y632-L644 HydrophobicContact CG-CD2 3.89Å; Y632-L644 HydrophobicContact CG-CG 4.46Å; Y632-T718 WeakPolarHBondContact CE1-O 3.37Å; Y632-L719 HydrophobicContact CD1-CD2 4.24Å; Y632-L719 HydrophobicContact CE1-CD2 3.46Å; Y632-L719 VanDerWaalsContact CE1-CD2 3.46Å; Y632-L719 HydrophobicContact CE1-CG 4.49Å
633	K	80.8	Confident	80.5	Confident	179 Å²	179	77.2 Å²	77.2	78%	0.778	44%	0.437	S	S	*	.			trans	-117.6	120.3	175.1	-69.9	-172.2	179.9	-177.5	0	113.9
634	S	83.1	Confident	81.8	Confident	77 Å²	77	76.6 Å²	76.6	54%	0.538	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	133	-173	-174.2	0	0	0	0	116.5	T718	S634-T718 VanDerWaalsContact CA-O 3.29Å; S634-T718 WeakPolarHBondContact CA-O 3.46Å; S634-T718 PolarHBondContact OG-O 2.57Å
635	G	78.9	Confident	82.5	Confident	41 Å²	41	78.4 Å²	78.4	42%	0.423	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	109.2	-8.4	157.4	0	0	0	0	0	118.5	Y632 N720	Y632-G635 PolarHBondContact OH-N 3.29Å; G635-N720 PolarHBondContact O-ND2 2.97Å
636	Q	83.7	Confident	82.9	Confident	136 Å²	136	75.6 Å²	75.6	64%	0.636	42%	0.421	S	S	*	.			trans	-71.8	135.4	-176.9	-174.7	177	-18.6	0	0	112.4
637	P	85.7	Confident	83.1	Confident	92 Å²	92	72.7 Å²	72.7	60%	0.597	41%	0.408	S	S	*	.			trans	-69.8	140.5	-179.9	29	-35.7	0	0	0	112.2
638	V	82.5	Confident	83.1	Confident	35 Å²	35	72.1 Å²	72.1	21%	0.212	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	141.8	-179.4	52.7	0	0	0	0	110.9	H642 P689 N720 V721 L722	V638-H642 HydrophobicContact CG2-CB 3.62Å; V638-P689 HydrophobicContact CG1-CB 3.97Å; V638-P689 HydrophobicContact CG1-CG 3.79Å; V638-P689 HydrophobicContact CG2-CG 4.15Å; V638-N720 WeakPolarHBondContact CG1-O 3.11Å; V638-N720 PolarHBondContact N-O 3.32Å; V638-V721 HydrophobicContact CG1-CG2 4.4Å; V638-V721 WeakPolarHBondContact O-CA 3.41Å; V638-L722 PolarHBondContact O-N 3.46Å
639	N	83.4	Confident	83.2	Confident	69 Å²	69	67.7 Å²	67.7	37%	0.369	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	146.9	175.2	-64.4	-19.2	0	0	0	110.3	A641 H642	N639-A641 PolarHBondContact O-N 3.48Å; N639-H642 PolarHBondContact ND2-CE1 2.98Å; N639-H642 VanDerWaalsContact ND2-CE1 3.28Å; N639-H642 PolarHBondContact ND2-NE2 2.76Å; N639-H642 PolarHBondContact O-N 3.29Å
640	M	77.2	Confident	83	Confident	32 Å²	32	65.7 Å²	65.7	16%	0.158	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50	138.8	161.1	174.1	179.3	-81.6	0	0	110.1	P689 K691 V721 L722 F723	M640-P689 WeakPolarHBondContact CA-O 3.48Å; M640-K691 HydrophobicContact CE-CB 3.78Å; M640-K691 HydrophobicContact CE-CG 4.05Å; M640-K691 VanDerWaalsContact CE-N 3.27Å; M640-V721 HydrophobicContact CB-CG1 4.26Å; M640-L722 WeakPolarHBondContact CB-O 3.34Å; M640-L722 PolarHBondContact N-O 2.85Å; M640-F723 HydrophobicContact CB-CB 4.41Å; M640-F723 HydrophobicContact CE-CB 3.66Å; M640-F723 HydrophobicContact SD-CB 4.16Å
641	A	71.9	Confident	82.7	Confident	72 Å²	72	63.5 Å²	63.5	60%	0.595	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	10.5	-179.7	0	0	0	0	0	118.1	N639 P689	N639-A641 PolarHBondContact O-N 3.48Å; A641-P689 PolarHBondContact N-O 3.43Å; A641-P689 VanDerWaalsContact N-O 3.17Å
642	H	78.6	Confident	82.6	Confident	100 Å²	100	61.3 Å²	61.3	46%	0.463	34%	0.344	S	S	.	.			trans	-82.2	171.3	163.9	-73.6	-158.9	0	0	0	111.8	V638 N639 V688 P689	V638-H642 HydrophobicContact CG2-CB 3.62Å; N639-H642 PolarHBondContact ND2-CE1 2.98Å; N639-H642 VanDerWaalsContact ND2-CE1 3.28Å; N639-H642 PolarHBondContact ND2-NE2 2.76Å; N639-H642 PolarHBondContact O-N 3.29Å; H642-V688 VanDerWaalsContact O-CA 3.26Å; H642-V688 WeakPolarHBondContact O-CA 3.35Å; H642-V688 WeakPolarHBondContact O-CG1 3.43Å; H642-P689 WeakPolarHBondContact O-CD 3.46Å
643	L	79.1	Confident	81.9	Confident	124 Å²	124	60.4 Å²	60.4	65%	0.649	35%	0.35	S	S	*	.			trans	-116.1	144.4	-171.2	-175.4	66.2	0	0	0	114.1	K686 V688	L643-K686 HydrophobicContact CD1-CB 4.26Å; L643-V688 HydrophobicContact CD1-CG2 3.64Å
644	L	82.8	Confident	81.5	Confident	41 Å²	41	55.7 Å²	55.7	22%	0.215	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	155.8	178.8	-179.1	61.4	0	0	0	111.7	Y632 K686 L687 L719	Y632-L644 HydrophobicContact CD1-CD2 4.23Å; Y632-L644 HydrophobicContact CD2-CD1 3.51Å; Y632-L644 HydrophobicContact CD2-CD2 3.71Å; Y632-L644 HydrophobicContact CD2-CG 4.22Å; Y632-L644 HydrophobicContact CE1-CD2 4.39Å; Y632-L644 HydrophobicContact CE2-CD1 4.16Å; Y632-L644 HydrophobicContact CE2-CD2 3.88Å; Y632-L644 HydrophobicContact CG-CD1 4.07Å; Y632-L644 HydrophobicContact CG-CD2 3.89Å; Y632-L644 HydrophobicContact CG-CG 4.46Å; L644-K686 CarbonylContact O-C 3.57Å; L644-K686 VanDerWaalsContact O-CA 3.28Å; L644-K686 WeakPolarHBondContact O-CA 3.06Å; L644-L687 HydrophobicContact CB-CD1 4.28Å; L644-L687 HydrophobicContact CB-CG 4.1Å; L644-L687 HydrophobicContact CD2-CD1 4.18Å; L644-L687 HydrophobicContact CD2-CD2 4.26Å; L644-L687 HydrophobicContact CD2-CG 4.29Å; L644-L687 HydrophobicContact CG-CG 4.38Å; L644-L687 PolarHBondContact N-O 2.96Å; L644-L687 PolarHBondContact O-N 2.96Å; L644-L719 HydrophobicContact CD2-CD2 3.76Å
645	E	84.9	Confident	80.7	Confident	68 Å²	68	54.2 Å²	54.2	32%	0.318	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	143.6	-171.3	177.1	167.3	166	0	0	115.7	K684 L685 K686	E645-K684 IonicContact OE1-NZ 2.95Å; E645-K684 PolarHBondContact OE1-NZ 3.45Å; E645-L685 CarbonylContact C-O 3.5Å; E645-L685 WeakPolarHBondContact CA-O 3.3Å; E645-K686 HydrophobicContact CB-CG 4.25Å; E645-K686 HydrophobicContact CG-CG 4.03Å; E645-K686 IonicContact OE1-NZ 3.61Å; E645-K686 WeakPolarHBondContact OE2-CD 3.33Å; E645-K686 WeakPolarHBondContact OE2-CE 3.43Å; E645-K686 IonicContact OE2-NZ 2.65Å; E645-K686 PolarHBondContact OE2-NZ 2.91Å
646	L	87.1	Confident	80.4	Confident	8 Å²	8	56.1 Å²	56.1	4%	0.042	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	164.8	-176.9	-41.8	168.8	0	0	0	111.2	T630 W661 L685 L687 Y698	T630-L646 CarbonylContact O-C 3.48Å; T630-L646 WeakPolarHBondContact O-CA 3.19Å; T630-L646 WeakPolarHBondContact O-CB 3.12Å; L646-W661 HydrophobicContact CB-CH2 3.39Å; L646-W661 HydrophobicContact CB-CZ2 4.04Å; L646-W661 HydrophobicContact CB-CZ3 3.89Å; L646-W661 HydrophobicContact CD1-CE3 4.45Å; L646-W661 HydrophobicContact CD1-CH2 4.13Å; L646-W661 HydrophobicContact CD1-CZ3 3.7Å; L646-W661 HydrophobicContact CG-CH2 4.38Å; L646-W661 HydrophobicContact CG-CZ3 4.44Å; L646-L685 HydrophobicContact CB-CB 4.23Å; L646-L685 HydrophobicContact CD1-CD2 3.88Å; L646-L685 HydrophobicContact CD1-CG 4.19Å; L646-L685 PolarHBondContact N-O 2.93Å; L646-L685 PolarHBondContact O-N 2.78Å; L646-L687 HydrophobicContact CD1-CD2 3.91Å; L646-Y698 HydrophobicContact CD1-CD1 4.46Å
647	T	88.3	Confident	80	Confident	40 Å²	40	49.9 Å²	49.9	25%	0.245	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	145.2	-168.7	-65.2	0	0	0	0	116.7	I629 T630 W661 K684	I629-T647 CarbonylContact C-O 3.19Å; I629-T647 VanDerWaalsContact CA-O 3.32Å; I629-T647 WeakPolarHBondContact CA-O 3.43Å; T630-T647 PolarHBondContact N-O 3.1Å; T630-T647 PolarHBondContact O-N 2.83Å; T630-T647 WeakPolarHBondContact OG1-CB 3.26Å; T630-T647 PolarHBondContact OG1-O 2.57Å; T647-W661 WeakPolarHBondContact O-CZ2 3.27Å; T647-K684 HydrophobicContact CG2-CG 3.99Å; T647-K684 VanDerWaalsContact OG1-CE 3.23Å; T647-K684 WeakPolarHBondContact OG1-CE 3.28Å; T647-K684 WeakPolarHBondContact OG1-CG 3.43Å
648	C	87.8	Confident	79.7	Confident	3 Å²	3	48.4 Å²	48.4	2%	0.02	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	168.2	-170	166.8	0	0	0	0	114.5	K628 I629 W661 T682 I683 C700	K628-C648 CarbonylContact O-C 3.58Å; K628-C648 VanDerWaalsContact O-C 3.24Å; K628-C648 WeakPolarHBondContact O-CA 3.35Å; K628-C648 WeakPolarHBondContact O-CB 3.27Å; K628-C648 PolarHBondContact O-SG 2.73Å; I629-C648 HydrophobicContact CG1-CB 4.32Å; C648-W661 HydrophobicContact CB-CZ2 3.67Å; C648-T682 CarbonylContact O-C 3.51Å; C648-T682 WeakPolarHBondContact O-CG2 3.19Å; C648-I683 CarbonylContact C-O 3.57Å; C648-I683 WeakPolarHBondContact CA-O 3.2Å; C648-I683 HydrophobicContact CB-CG2 3.74Å; C648-I683 WeakPolarHBondContact CB-O 3.24Å; C648-I683 PolarHBondContact N-O 3.4Å; C648-I683 PolarHBondContact O-N 2.85Å; C648-C700 HydrophobicContact CB-CB 4.05Å; C648-C700 WeakPolarHBondContact CB-SG 2.98Å; C648-C700 WeakPolarHBondContact SG-CB 3.27Å; C648-C700 CovalentContact SG-SG 2.07Å; C648-C700 PolarHBondContact SG-SG 2.89Å
649	T	89.1	Confident	79.8	Confident	61 Å²	61	47.1 Å²	47.1	37%	0.374	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	163.5	-172	65.8	0	0	0	0	115.5	P627 K628 T681 T682	P627-T649 CarbonylContact C-O 3.46Å; P627-T649 WeakPolarHBondContact CA-O 3.44Å; P627-T649 WeakPolarHBondContact CB-O 3.33Å; K628-T649 PolarHBondContact N-O 2.96Å; K628-T649 PolarHBondContact O-N 3.02Å; T649-T681 CarbonylContact C-O 3.5Å; T649-T682 HydrophobicContact CG2-CG2 4.24Å; T649-T682 WeakPolarHBondContact CG2-OG1 3.18Å
650	T	84	Confident	80	Confident	6 Å²	6	44.4 Å²	44.4	4%	0.037	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	-172.9	171	-150.6	0	0	0	0	115.2	D625 I626 P657 L659 T681 A702	D625-T650 PolarHBondContact O-OG1 2.89Å; I626-T650 WeakPolarHBondContact CA-OG1 3.3Å; I626-T650 PolarHBondContact N-OG1 3.14Å; I626-T650 CarbonylContact O-C 3.5Å; I626-T650 WeakPolarHBondContact O-CA 3.32Å; I626-T650 PolarHBondContact O-OG1 2.88Å; T650-P657 HydrophobicContact CG2-CG 4.35Å; T650-L659 HydrophobicContact CG2-CB 4.4Å; T650-L659 HydrophobicContact CG2-CD1 3.55Å; T650-L659 HydrophobicContact CG2-CD2 4.23Å; T650-L659 HydrophobicContact CG2-CG 3.39Å; T650-T681 CarbonylContact C-O 3.35Å; T650-T681 WeakPolarHBondContact CA-O 3.16Å; T650-T681 HydrophobicContact CG2-CG2 3.33Å; T650-T681 PolarHBondContact N-O 3.44Å; T650-T681 CarbonylContact O-C 3.58Å; T650-T681 PolarHBondContact O-N 3.02Å; T650-A702 HydrophobicContact CG2-CB 4.4Å; T650-A702 WeakPolarHBondContact OG1-CB 3.05Å
651	T	82.3	Confident	80.5	Confident	45 Å²	45	43.1 Å²	43.1	28%	0.276	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	152.2	172.2	54.8	0	0	0	0	116.3	D625 I626 P657 K679 Q680	D625-T651 CarbonylContact C-O 3.5Å; D625-T651 WeakPolarHBondContact CA-O 3.33Å; D625-T651 WeakPolarHBondContact CB-O 3.3Å; D625-T651 PolarHBondContact N-O 3.11Å; D625-T651 WeakPolarHBondContact OD2-CB 3.36Å; D625-T651 VanDerWaalsContact OD2-O 3.06Å; D625-T651 PolarHBondContact OD2-OG1 3.31Å; I626-T651 PolarHBondContact N-O 3Å; I626-T651 PolarHBondContact N-OG1 3.16Å; I626-T651 PolarHBondContact O-N 3.08Å; T651-P657 WeakPolarHBondContact O-CG 3.2Å; T651-K679 CarbonylContact C-O 3.39Å; T651-K679 WeakPolarHBondContact CA-O 3.48Å; T651-Q680 HydrophobicContact CG2-CG 4.07Å
652	G	77.8	Confident	81.3	Confident	7 Å²	7	41 Å²	41	7%	0.072	23%	0.226	C	C	.	.			trans	67.7	135.7	146.4	0	0	0	0	0	124.1	P624 D625 P657 K679	P624-G652 CarbonylContact C-O 3.52Å; P624-G652 WeakPolarHBondContact CA-O 3.26Å; D625-G652 PolarHBondContact N-O 3.35Å; D625-G652 VanDerWaalsContact OD1-CA 3.25Å; D625-G652 WeakPolarHBondContact OD1-CA 3.48Å; D625-G652 WeakPolarHBondContact OD2-CA 3.41Å; D625-G652 PolarHBondContact OD2-N 3.39Å; G652-P657 VanDerWaalsContact C-CD 3.4Å; G652-P657 VanDerWaalsContact O-CB 3.25Å; G652-P657 WeakPolarHBondContact O-CB 3.13Å; G652-P657 WeakPolarHBondContact O-CD 3.23Å; G652-P657 WeakPolarHBondContact O-CG 3.27Å; G652-K679 PolarHBondContact N-O 2.9Å
653	G	71.7	Confident	81.7	Confident	33 Å²	33	38.2 Å²	38.2	34%	0.34	21%	0.213	S	C	.	.	B	Isolated β-bridge	trans	161.7	-172.9	172.3	0	0	0	0	0	118.2	P623 L656	P623-G653 CarbonylContact O-C 3.58Å; P623-G653 VanDerWaalsContact O-C 3.26Å; P623-G653 WeakPolarHBondContact O-CA 3.23Å; G653-L656 WeakPolarHBondContact O-CD2 3.18Å; G653-L656 WeakPolarHBondContact O-CG 3.28Å
654	N	70.9	Confident	81.9	Confident	80 Å²	80	35.5 Å²	35.5	43%	0.428	20%	0.199	S	C	.	.	S	Bend	trans	-176	115.2	157.7	-168.2	64.6	0	0	0	114.6	H622 P623	H622-N654 CarbonylContact C-O 3.55Å; H622-N654 WeakPolarHBondContact CA-O 3.03Å; H622-N654 PolarHBondContact CD2-O 3.46Å; H622-N654 PolarHBondContact NE2-ND2 2.7Å; P623-N654 WeakPolarHBondContact CD-O 3.46Å; P623-N654 PolarHBondContact O-N 2.9Å
655	P	67.9	Low	81.6	Confident	45 Å²	45	42.1 Å²	42.1	29%	0.292	23%	0.226	S	C	.	.	S	Bend	cis	-40.9	131	-15.3	-31.2	35.4	0	0	0	109	I621 N704	I621-P655 HydrophobicContact CB-CG 3.94Å; I621-P655 HydrophobicContact CG2-CG 3.99Å; P655-N704 PolarHBondContact O-ND2 3.05Å
656	L	71.6	Confident	81.3	Confident	82 Å²	82	43.8 Å²	43.8	43%	0.429	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-64.1	161.1	-167.1	-79.7	146	0	0	0	110.5	G653 I676	G653-L656 WeakPolarHBondContact O-CD2 3.18Å; G653-L656 WeakPolarHBondContact O-CG 3.28Å; L656-I676 HydrophobicContact CB-CD1 3.84Å; L656-I676 HydrophobicContact CD1-CD1 3.87Å; L656-I676 HydrophobicContact CD2-CD1 4.09Å; L656-I676 HydrophobicContact CG-CD1 4.13Å
657	P	76.4	Confident	80.9	Confident	5 Å²	5	47 Å²	47	3%	0.032	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-71.9	145	-169.4	34.7	-38.1	0	0	0	110.3	P624 T650 T651 G652 T681 R703	P624-P657 HydrophobicContact CB-CB 3.82Å; T650-P657 HydrophobicContact CG2-CG 4.35Å; T651-P657 WeakPolarHBondContact O-CG 3.2Å; G652-P657 VanDerWaalsContact C-CD 3.4Å; G652-P657 VanDerWaalsContact O-CB 3.25Å; G652-P657 WeakPolarHBondContact O-CB 3.13Å; G652-P657 WeakPolarHBondContact O-CD 3.23Å; G652-P657 WeakPolarHBondContact O-CG 3.27Å; P657-T681 HydrophobicContact CG-CG2 4.21Å; P657-R703 CarbonylContact C-O 3.47Å; P657-R703 WeakPolarHBondContact CA-O 3.38Å
658	E	78.3	Confident	80.2	Confident	60 Å²	60	46.5 Å²	46.5	28%	0.28	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	147.4	172.7	-170	164.9	-150.1	0	0	110.6	A702 R703 W711	E658-A702 CarbonylContact O-C 3.35Å; E658-A702 WeakPolarHBondContact O-CA 3.45Å; E658-A702 WeakPolarHBondContact O-CB 3.03Å; E658-R703 HydrophobicContact CB-CG 4.06Å; E658-R703 PolarHBondContact N-O 3.03Å; E658-R703 PolarHBondContact O-N 3.26Å; E658-R703 IonicContact OE1-NH2 3.44Å; E658-R703 IonicContact OE2-CZ 3.87Å; E658-R703 IonicContact OE2-NE 2.73Å; E658-R703 PolarHBondContact OE2-NE 2.86Å; E658-R703 IonicContact OE2-NH2 3.5Å; E658-R703 PolarHBondContact OE2-NH2 2.81Å; E658-W711 HydrophobicContact CG-CH2 4.14Å
659	L	85.1	Confident	78.9	Confident	8 Å²	8	49.7 Å²	49.7	4%	0.042	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	146.3	167.9	-112.9	175.4	0	0	0	109.2	P627 T650 P674 T681 I683 S701 A702	P627-L659 HydrophobicContact CB-CD2 3.64Å; T650-L659 HydrophobicContact CG2-CB 4.4Å; T650-L659 HydrophobicContact CG2-CD1 3.55Å; T650-L659 HydrophobicContact CG2-CD2 4.23Å; T650-L659 HydrophobicContact CG2-CG 3.39Å; L659-P674 HydrophobicContact CB-CB 4.17Å; L659-P674 HydrophobicContact CB-CG 4.03Å; L659-P674 HydrophobicContact CD1-CB 4.29Å; L659-T681 HydrophobicContact CD1-CG2 4.42Å; L659-I683 HydrophobicContact CB-CB 3.92Å; L659-I683 HydrophobicContact CB-CD1 3.69Å; L659-I683 HydrophobicContact CB-CG1 4.36Å; L659-I683 HydrophobicContact CB-CG2 3.91Å; L659-I683 HydrophobicContact CD1-CB 3.65Å; L659-I683 HydrophobicContact CD1-CG2 3.71Å; L659-I683 HydrophobicContact CD2-CG2 4.06Å; L659-I683 HydrophobicContact CG-CB 4.3Å; L659-I683 HydrophobicContact CG-CG2 4.09Å; L659-I683 VanDerWaalsContact O-CD1 3.28Å; L659-I683 WeakPolarHBondContact O-CD1 3.32Å; L659-S701 CarbonylContact C-O 3.6Å; L659-S701 WeakPolarHBondContact CA-O 3.4Å; L659-S701 VanDerWaalsContact CD2-O 3.27Å; L659-S701 WeakPolarHBondContact CD2-O 3.32Å; L659-A702 HydrophobicContact CD2-CB 4.46Å
660	Q	86.2	Confident	77.5	Confident	13 Å²	13	47.3 Å²	47.3	6%	0.061	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	143	-163.7	-171.6	63.3	68.8	0	0	109.8	F662 P667 I668 C700 S701 W711	Q660-F662 HydrophobicContact CB-CE2 4.28Å; Q660-F662 HydrophobicContact CG-CD2 4.46Å; Q660-F662 HydrophobicContact CG-CE2 3.73Å; Q660-F662 HydrophobicContact CG-CZ 4.27Å; Q660-P667 HydrophobicContact CG-CB 3.69Å; Q660-I668 PolarHBondContact NE2-O 3.3Å; Q660-C700 CarbonylContact O-C 3.5Å; Q660-C700 WeakPolarHBondContact O-CA 3.48Å; Q660-C700 WeakPolarHBondContact O-CB 3.29Å; Q660-S701 WeakPolarHBondContact CB-O 3.08Å; Q660-S701 PolarHBondContact N-O 3.5Å; Q660-S701 PolarHBondContact O-N 3.05Å; Q660-W711 HydrophobicContact CB-CE3 4.28Å; Q660-W711 HydrophobicContact CB-CH2 3.59Å; Q660-W711 HydrophobicContact CB-CZ3 3.36Å; Q660-W711 HydrophobicContact CG-CH2 3.65Å; Q660-W711 HydrophobicContact CG-CZ2 4.31Å; Q660-W711 HydrophobicContact CG-CZ3 3.84Å
661	W	89.3	Confident	76	Confident	5 Å²	5	51.2 Å²	51.2	2%	0.019	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	178.3	163.6	-86.9	58.8	0	0	0	110.8	I629 L646 T647 C648 P667 I668 N670 L685 H699 C700	I629-W661 HydrophobicContact CD1-CD2 4.44Å; I629-W661 HydrophobicContact CD1-CE3 3.96Å; I629-W661 HydrophobicContact CD1-CH2 3.59Å; I629-W661 HydrophobicContact CD1-CZ2 4.09Å; I629-W661 HydrophobicContact CD1-CZ3 3.51Å; I629-W661 HydrophobicContact CG1-CE3 4.46Å; I629-W661 HydrophobicContact CG1-CH2 3.27Å; I629-W661 HydrophobicContact CG1-CZ2 3.53Å; I629-W661 HydrophobicContact CG1-CZ3 3.79Å; L646-W661 HydrophobicContact CB-CH2 3.39Å; L646-W661 HydrophobicContact CB-CZ2 4.04Å; L646-W661 HydrophobicContact CB-CZ3 3.89Å; L646-W661 HydrophobicContact CD1-CE3 4.45Å; L646-W661 HydrophobicContact CD1-CH2 4.13Å; L646-W661 HydrophobicContact CD1-CZ3 3.7Å; L646-W661 HydrophobicContact CG-CH2 4.38Å; L646-W661 HydrophobicContact CG-CZ3 4.44Å; T647-W661 WeakPolarHBondContact O-CZ2 3.27Å; C648-W661 HydrophobicContact CB-CZ2 3.67Å; W661-P667 CarbonylContact O-C 3.31Å; W661-P667 VanDerWaalsContact O-C 3.26Å; W661-P667 WeakPolarHBondContact O-CA 3.47Å; W661-I668 VanDerWaalsContact C-N 3.28Å; W661-I668 CarbonylContact C-O 3.57Å; W661-I668 HydrophobicContact CB-CB 3.79Å; W661-I668 HydrophobicContact CB-CD1 4.27Å; W661-I668 HydrophobicContact CB-CG2 4.29Å; W661-I668 PolarHBondContact N-O 2.64Å; W661-I668 PolarHBondContact O-N 3.24Å; W661-N670 WeakPolarHBondContact CB-OD1 3.27Å; W661-N670 PolarHBondContact NE1-ND2 3.11Å; W661-N670 VanDerWaalsContact NE1-ND2 3.13Å; W661-L685 HydrophobicContact CB-CD2 4.11Å; W661-L685 HydrophobicContact CD2-CB 3.77Å; W661-L685 HydrophobicContact CD2-CD2 3.67Å; W661-L685 HydrophobicContact CD2-CG 4.38Å; W661-L685 HydrophobicContact CE3-CB 4.15Å; W661-L685 HydrophobicContact CE3-CD2 3.38Å; W661-L685 HydrophobicContact CE3-CG 4.38Å; W661-L685 HydrophobicContact CG-CB 4.11Å; W661-L685 HydrophobicContact CG-CD2 4.05Å; W661-L685 HydrophobicContact CZ2-CB 4.18Å; W661-L685 HydrophobicContact CZ3-CD2 3.99Å; W661-H699 CarbonylContact C-O 3.5Å; W661-H699 VanDerWaalsContact C-O 3.27Å; W661-H699 WeakPolarHBondContact CA-O 3.44Å; W661-H699 VanDerWaalsContact CB-O 3.27Å; W661-H699 WeakPolarHBondContact CB-O 3.45Å; W661-H699 VanDerWaalsContact CD2-O 3.29Å; W661-C700 HydrophobicContact CB-CB 4.39Å; W661-C700 VanDerWaalsContact CD1-CB 3.49Å; W661-C700 HydrophobicContact CD2-CB 3.84Å; W661-C700 HydrophobicContact CG-CB 3.7Å
662	F	88	Confident	74.8	Confident	27 Å²	27	51.2 Å²	51.2	12%	0.118	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	148.8	-176.8	-74.3	-107	0	0	0	111.5	Q660 N666 P667 I668 Y698 H699 S701	Q660-F662 HydrophobicContact CB-CE2 4.28Å; Q660-F662 HydrophobicContact CG-CD2 4.46Å; Q660-F662 HydrophobicContact CG-CE2 3.73Å; Q660-F662 HydrophobicContact CG-CZ 4.27Å; F662-N666 CarbonylContact C-O 3.54Å; F662-N666 WeakPolarHBondContact CA-O 3.39Å; F662-P667 HydrophobicContact CD1-CB 4.24Å; F662-P667 HydrophobicContact CE1-CB 3.96Å; F662-P667 HydrophobicContact CE1-CG 4.2Å; F662-P667 HydrophobicContact CE2-CB 4.23Å; F662-P667 HydrophobicContact CZ-CB 3.93Å; F662-P667 HydrophobicContact CZ-CG 4.47Å; F662-I668 VanDerWaalsContact C-CG1 3.43Å; F662-I668 WeakPolarHBondContact O-CD1 3.38Å; F662-Y698 CarbonylContact O-C 3.28Å; F662-Y698 VanDerWaalsContact O-C 3.28Å; F662-Y698 WeakPolarHBondContact O-CA 3.39Å; F662-H699 HydrophobicContact CB-CB 3.87Å; F662-H699 WeakPolarHBondContact CB-CD2 3.36Å; F662-H699 PolarHBondContact N-O 3.23Å; F662-H699 PolarHBondContact O-N 3.48Å; F662-S701 WeakPolarHBondContact CE2-OG 3.49Å
663	K	86.9	Confident	73.9	Confident	42 Å²	42	58.1 Å²	58.1	18%	0.183	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	122.3	175	-176.2	-170.7	170.6	-175	0	108.7	K665 N666 I668 E692 D693 A696 Q697 Y698	K663-K665 PolarHBondContact O-N 3.1Å; K663-K665 VanDerWaalsContact O-N 3.12Å; K663-N666 PolarHBondContact N-O 2.88Å; K663-N666 WeakPolarHBondContact O-CA 3.01Å; K663-N666 WeakPolarHBondContact O-CB 3.37Å; K663-N666 PolarHBondContact O-N 2.82Å; K663-N666 PolarHBondContact O-ND2 2.88Å; K663-I668 HydrophobicContact CB-CD1 3.75Å; K663-I668 HydrophobicContact CB-CG1 3.58Å; K663-E692 PolarHBondContact NZ-O 2.93Å; K663-D693 WeakPolarHBondContact CE-OD1 3.38Å; K663-D693 IonicContact NZ-OD1 2.83Å; K663-D693 PolarHBondContact NZ-OD1 2.78Å; K663-A696 HydrophobicContact CD-CB 4.37Å; K663-A696 HydrophobicContact CG-CB 4.38Å; K663-Q697 CarbonylContact C-O 3.59Å; K663-Q697 WeakPolarHBondContact CA-O 3.5Å; K663-Q697 WeakPolarHBondContact CG-O 3.34Å; K663-Y698 HydrophobicContact CB-CE1 4.46Å; K663-Y698 HydrophobicContact CG-CE1 4.27Å; K663-Y698 HydrophobicContact CG-CE2 4.26Å
664	D	84.2	Confident	73.7	Confident	67 Å²	67	58.2 Å²	58.2	36%	0.358	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.9	40.6	-178.9	-56.7	-54.8	0	0	0	112.9	N666 A696 Q697	D664-N666 PolarHBondContact O-ND2 2.03Å; D664-A696 WeakPolarHBondContact OD2-CB 3.47Å; D664-Q697 PolarHBondContact N-O 3.42Å; D664-Q697 WeakPolarHBondContact OD1-CB 3.3Å; D664-Q697 PolarHBondContact OD1-N 3.23Å
665	K	76.2	Confident	73.7	Confident	179 Å²	179	58.5 Å²	58.5	78%	0.778	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	8.7	-172.9	-47	177.3	-176.2	179.9	0	117.1	K663 H699	K663-K665 PolarHBondContact O-N 3.1Å; K663-K665 VanDerWaalsContact O-N 3.12Å; K665-H699 WeakPolarHBondContact CA-NE2 3.39Å; K665-H699 PolarHBondContact N-NE2 3.01Å
666	N	78.5	Confident	73.6	Confident	103 Å²	103	60.2 Å²	60.2	55%	0.551	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.6	130.1	179.9	-48.1	-86	0	0	0	111.5	F662 K663 D664 I668	F662-N666 CarbonylContact C-O 3.54Å; F662-N666 WeakPolarHBondContact CA-O 3.39Å; K663-N666 PolarHBondContact N-O 2.88Å; K663-N666 WeakPolarHBondContact O-CA 3.01Å; K663-N666 WeakPolarHBondContact O-CB 3.37Å; K663-N666 PolarHBondContact O-N 2.82Å; K663-N666 PolarHBondContact O-ND2 2.88Å; D664-N666 PolarHBondContact O-ND2 2.03Å; N666-I668 PolarHBondContact O-N 2.89Å
667	P	78.6	Confident	73.3	Confident	77 Å²	77	61.5 Å²	61.5	50%	0.5	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	119.4	-173.4	17.7	-28.9	0	0	0	115.3	Q660 W661 F662	Q660-P667 HydrophobicContact CG-CB 3.69Å; W661-P667 CarbonylContact O-C 3.31Å; W661-P667 VanDerWaalsContact O-C 3.26Å; W661-P667 WeakPolarHBondContact O-CA 3.47Å; F662-P667 HydrophobicContact CD1-CB 4.24Å; F662-P667 HydrophobicContact CE1-CB 3.96Å; F662-P667 HydrophobicContact CE1-CG 4.2Å; F662-P667 HydrophobicContact CE2-CB 4.23Å; F662-P667 HydrophobicContact CZ-CB 3.93Å; F662-P667 HydrophobicContact CZ-CG 4.47Å
668	I	73.6	Confident	72.8	Confident	29 Å²	29	65 Å²	65	15%	0.149	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	120.8	166.5	-60.5	165.8	0	0	0	110	Q660 W661 F662 K663 N666 N670 L685 Y698	Q660-I668 PolarHBondContact NE2-O 3.3Å; W661-I668 VanDerWaalsContact C-N 3.28Å; W661-I668 CarbonylContact C-O 3.57Å; W661-I668 HydrophobicContact CB-CB 3.79Å; W661-I668 HydrophobicContact CB-CD1 4.27Å; W661-I668 HydrophobicContact CB-CG2 4.29Å; W661-I668 PolarHBondContact N-O 2.64Å; W661-I668 PolarHBondContact O-N 3.24Å; F662-I668 VanDerWaalsContact C-CG1 3.43Å; F662-I668 WeakPolarHBondContact O-CD1 3.38Å; K663-I668 HydrophobicContact CB-CD1 3.75Å; K663-I668 HydrophobicContact CB-CG1 3.58Å; N666-I668 PolarHBondContact O-N 2.89Å; I668-N670 PolarHBondContact O-N 2.95Å; I668-N670 VanDerWaalsContact O-N 3.13Å; I668-L685 HydrophobicContact CD1-CD2 3.58Å; I668-L685 HydrophobicContact CG2-CD1 3.87Å; I668-L685 HydrophobicContact CG2-CD2 4.25Å; I668-Y698 HydrophobicContact CD1-CD1 3.22Å; I668-Y698 HydrophobicContact CD1-CE1 3.45Å; I668-Y698 VanDerWaalsContact CD1-CE1 3.45Å; I668-Y698 HydrophobicContact CD1-CG 4.3Å
669	T	60.1	Low	72.3	Confident	69 Å²	69	70.6 Å²	70.6	42%	0.423	38%	0.377	S	S	.	.			trans	-72.8	100.7	169.2	53.3	0	0	0	0	111.3
670	N	58.9	Low	71.9	Confident	11 Å²	11	75.7 Å²	75.7	6%	0.059	40%	0.401	C	S	.	.			trans	-65	147.9	167.7	-82.7	12.1	0	0	0	111.6	W661 I668 I683 K684 L685 R1633	W661-N670 WeakPolarHBondContact CB-OD1 3.27Å; W661-N670 PolarHBondContact NE1-ND2 3.11Å; W661-N670 VanDerWaalsContact NE1-ND2 3.13Å; I668-N670 PolarHBondContact O-N 2.95Å; I668-N670 VanDerWaalsContact O-N 3.13Å; N670-I683 HydrophobicContact CB-CD1 3.47Å; N670-I683 VanDerWaalsContact CB-CD1 3.47Å; N670-I683 HydrophobicContact CB-CG1 3.84Å; N670-K684 PolarHBondContact ND2-O 3.17Å; N670-L685 PolarHBondContact ND2-N 3.31Å; N670-L685 WeakPolarHBondContact OD1-CB 3.3Å; N670-L685 WeakPolarHBondContact OD1-CD1 3.46Å; N670-R1633 PolarHBondContact O-NH2 2.8Å
671	N	53.7	Low	71.7	Confident	89 Å²	89	75.1 Å²	75.1	48%	0.476	40%	0.398	S	S	.	.			trans	-115.5	10.8	177.6	-69.3	-28.9	0	0	0	112.9	R1633 Y1636	N671-R1633 PolarHBondContact OD1-NE 3.19Å; N671-R1633 PolarHBondContact OD1-NH2 3.42Å; N671-Y1636 PolarHBondContact O-OH 3.32Å
672	V	57.2	Low	71.5	Confident	45 Å²	45	76.5 Å²	76.5	27%	0.273	41%	0.407	S	S	.	.	S	Bend	trans	-92.6	129.2	160.1	177.7	0	0	0	0	105.5	I683 K684	V672-I683 WeakPolarHBondContact O-CG1 3.46Å; V672-K684 HydrophobicContact CB-CB 4.11Å; V672-K684 WeakPolarHBondContact CB-O 3.44Å; V672-K684 HydrophobicContact CG1-CB 4.14Å; V672-K684 HydrophobicContact CG2-CB 3.96Å; V672-K684 WeakPolarHBondContact CG2-O 3.43Å
673	E	59.4	Low	71.4	Confident	152 Å²	152	75.4 Å²	75.4	71%	0.71	40%	0.403	S	S	*	.			trans	-62.3	148.8	176.9	-70	-177	165.5	0	0	110.5	I675	E673-I675 PolarHBondContact O-N 3.23Å
674	P	65.6	Low	71.3	Confident	35 Å²	35	76.9 Å²	76.9	23%	0.227	41%	0.409	C	S	.	.			trans	-63.2	102.3	169.2	-14.9	29.7	0	0	0	109.2	L659 I676 T681 T682 I683	L659-P674 HydrophobicContact CB-CB 4.17Å; L659-P674 HydrophobicContact CB-CG 4.03Å; L659-P674 HydrophobicContact CD1-CB 4.29Å; P674-I676 WeakPolarHBondContact O-CG1 3.42Å; P674-I676 PolarHBondContact O-N 3.23Å; P674-T681 HydrophobicContact CB-CG2 3.23Å; P674-T681 HydrophobicContact CG-CG2 4.42Å; P674-T682 CarbonylContact C-O 3.25Å; P674-T682 WeakPolarHBondContact CA-O 3.29Å; P674-I683 HydrophobicContact CG-CD1 4.24Å
675	I	72.5	Confident	71.3	Confident	86 Å²	86	74.1 Å²	74.1	44%	0.441	39%	0.394	S	S	.	.			trans	-59.1	103.1	-177.2	-57.3	170.4	0	0	0	109.3	E673 I677 T681 T682	E673-I675 PolarHBondContact O-N 3.23Å; I675-I677 HydrophobicContact CG2-CD1 4.13Å; I675-I677 HydrophobicContact CG2-CG1 4.02Å; I675-T681 CarbonylContact O-C 3.51Å; I675-T681 VanDerWaalsContact O-C 3.32Å; I675-T681 WeakPolarHBondContact O-CA 3.4Å; I675-T682 HydrophobicContact CD1-CG2 4.34Å; I675-T682 WeakPolarHBondContact CG1-O 3.23Å; I675-T682 PolarHBondContact N-O 3.12Å; I675-T682 PolarHBondContact O-N 2.87Å
676	I	64.3	Low	71.6	Confident	80 Å²	80	70.9 Å²	70.9	41%	0.41	38%	0.38	S	S	.	.			trans	-86.1	117.3	-175	-49.7	-166.5	0	0	0	110	L656 P674 Q680 T681	L656-I676 HydrophobicContact CB-CD1 3.84Å; L656-I676 HydrophobicContact CD1-CD1 3.87Å; L656-I676 HydrophobicContact CD2-CD1 4.09Å; L656-I676 HydrophobicContact CG-CD1 4.13Å; P674-I676 WeakPolarHBondContact O-CG1 3.42Å; P674-I676 PolarHBondContact O-N 3.23Å; I676-Q680 CarbonylContact C-O 3.58Å; I676-Q680 WeakPolarHBondContact CA-O 3.44Å; I676-Q680 WeakPolarHBondContact CG2-O 3.27Å; I676-T681 HydrophobicContact CG1-CG2 4.32Å
677	I	66.9	Low	71.8	Confident	110 Å²	110	66.8 Å²	66.8	56%	0.564	36%	0.358	S	S	*	.	B	Isolated β-bridge	trans	-121.6	91.7	-179.2	-54.8	-177.1	0	0	0	108.6	I675 K679 Q680	I675-I677 HydrophobicContact CG2-CD1 4.13Å; I675-I677 HydrophobicContact CG2-CG1 4.02Å; I677-K679 PolarHBondContact O-N 2.79Å; I677-Q680 HydrophobicContact CB-CB 4.41Å; I677-Q680 PolarHBondContact N-O 2.96Å; I677-Q680 PolarHBondContact O-N 3Å
678	G	65.6	Low	72	Confident	78 Å²	78	66 Å²	66	80%	0.804	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	-88	-176	0	0	0	0	0	112.1
679	K	67.5	Low	72.5	Confident	177 Å²	177	64.6 Å²	64.6	77%	0.77	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	-6.5	171.3	-63.6	-172.1	178.6	-173.8	0	113.6	T651 G652 I677	T651-K679 CarbonylContact C-O 3.39Å; T651-K679 WeakPolarHBondContact CA-O 3.48Å; G652-K679 PolarHBondContact N-O 2.9Å; I677-K679 PolarHBondContact O-N 2.79Å
680	Q	76.3	Confident	73.7	Confident	116 Å²	116	64.7 Å²	64.7	54%	0.542	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	168.6	173.6	-74.6	-177.9	-9.9	0	0	111.7	T651 I676 I677	T651-Q680 HydrophobicContact CG2-CG 4.07Å; I676-Q680 CarbonylContact C-O 3.58Å; I676-Q680 WeakPolarHBondContact CA-O 3.44Å; I676-Q680 WeakPolarHBondContact CG2-O 3.27Å; I677-Q680 HydrophobicContact CB-CB 4.41Å; I677-Q680 PolarHBondContact N-O 2.96Å; I677-Q680 PolarHBondContact O-N 3Å
681	T	81.8	Confident	74.9	Confident	0 Å²	0	65 Å²	65	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	138	-168.2	-56.1	0	0	0	0	107.7	T649 T650 P657 L659 P674 I675 I676	T649-T681 CarbonylContact C-O 3.5Å; T650-T681 CarbonylContact C-O 3.35Å; T650-T681 WeakPolarHBondContact CA-O 3.16Å; T650-T681 HydrophobicContact CG2-CG2 3.33Å; T650-T681 PolarHBondContact N-O 3.44Å; T650-T681 CarbonylContact O-C 3.58Å; T650-T681 PolarHBondContact O-N 3.02Å; P657-T681 HydrophobicContact CG-CG2 4.21Å; L659-T681 HydrophobicContact CD1-CG2 4.42Å; P674-T681 HydrophobicContact CB-CG2 3.23Å; P674-T681 HydrophobicContact CG-CG2 4.42Å; I675-T681 CarbonylContact O-C 3.51Å; I675-T681 VanDerWaalsContact O-C 3.32Å; I675-T681 WeakPolarHBondContact O-CA 3.4Å; I676-T681 HydrophobicContact CG1-CG2 4.32Å
682	T	86.1	Confident	76.2	Confident	35 Å²	35	65.4 Å²	65.4	22%	0.215	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	130.8	-168.3	-82.8	0	0	0	0	116.8	C648 T649 P674 I675	C648-T682 CarbonylContact O-C 3.51Å; C648-T682 WeakPolarHBondContact O-CG2 3.19Å; T649-T682 HydrophobicContact CG2-CG2 4.24Å; T649-T682 WeakPolarHBondContact CG2-OG1 3.18Å; P674-T682 CarbonylContact C-O 3.25Å; P674-T682 WeakPolarHBondContact CA-O 3.29Å; I675-T682 HydrophobicContact CD1-CG2 4.34Å; I675-T682 WeakPolarHBondContact CG1-O 3.23Å; I675-T682 PolarHBondContact N-O 3.12Å; I675-T682 PolarHBondContact O-N 2.87Å
683	I	85.4	Confident	77.5	Confident	4 Å²	4	64 Å²	64	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	139.2	-163.7	-148.8	174	0	0	0	115.3	C648 L659 N670 V672 P674	C648-I683 CarbonylContact C-O 3.57Å; C648-I683 WeakPolarHBondContact CA-O 3.2Å; C648-I683 HydrophobicContact CB-CG2 3.74Å; C648-I683 WeakPolarHBondContact CB-O 3.24Å; C648-I683 PolarHBondContact N-O 3.4Å; C648-I683 PolarHBondContact O-N 2.85Å; L659-I683 HydrophobicContact CB-CB 3.92Å; L659-I683 HydrophobicContact CB-CD1 3.69Å; L659-I683 HydrophobicContact CB-CG1 4.36Å; L659-I683 HydrophobicContact CB-CG2 3.91Å; L659-I683 HydrophobicContact CD1-CB 3.65Å; L659-I683 HydrophobicContact CD1-CG2 3.71Å; L659-I683 HydrophobicContact CD2-CG2 4.06Å; L659-I683 HydrophobicContact CG-CB 4.3Å; L659-I683 HydrophobicContact CG-CG2 4.09Å; L659-I683 VanDerWaalsContact O-CD1 3.28Å; L659-I683 WeakPolarHBondContact O-CD1 3.32Å; N670-I683 HydrophobicContact CB-CD1 3.47Å; N670-I683 VanDerWaalsContact CB-CD1 3.47Å; N670-I683 HydrophobicContact CB-CG1 3.84Å; V672-I683 WeakPolarHBondContact O-CG1 3.46Å; P674-I683 HydrophobicContact CG-CD1 4.24Å
684	K	84.9	Confident	78.9	Confident	73 Å²	73	59.7 Å²	59.7	32%	0.317	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	144.5	175.3	-67	-168.3	161.8	-161.6	0	113.8	E645 T647 N670 V672	E645-K684 IonicContact OE1-NZ 2.95Å; E645-K684 PolarHBondContact OE1-NZ 3.45Å; T647-K684 HydrophobicContact CG2-CG 3.99Å; T647-K684 VanDerWaalsContact OG1-CE 3.23Å; T647-K684 WeakPolarHBondContact OG1-CE 3.28Å; T647-K684 WeakPolarHBondContact OG1-CG 3.43Å; N670-K684 PolarHBondContact ND2-O 3.17Å; V672-K684 HydrophobicContact CB-CB 4.11Å; V672-K684 WeakPolarHBondContact CB-O 3.44Å; V672-K684 HydrophobicContact CG1-CB 4.14Å; V672-K684 HydrophobicContact CG2-CB 3.96Å; V672-K684 WeakPolarHBondContact CG2-O 3.43Å
685	L	84.3	Confident	79.8	Confident	8 Å²	8	60.6 Å²	60.6	4%	0.042	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	108.1	176.2	169.8	51.2	0	0	0	110	E645 L646 W661 I668 N670 L687 Y698	E645-L685 CarbonylContact C-O 3.5Å; E645-L685 WeakPolarHBondContact CA-O 3.3Å; L646-L685 HydrophobicContact CB-CB 4.23Å; L646-L685 HydrophobicContact CD1-CD2 3.88Å; L646-L685 HydrophobicContact CD1-CG 4.19Å; L646-L685 PolarHBondContact N-O 2.93Å; L646-L685 PolarHBondContact O-N 2.78Å; W661-L685 HydrophobicContact CB-CD2 4.11Å; W661-L685 HydrophobicContact CD2-CB 3.77Å; W661-L685 HydrophobicContact CD2-CD2 3.67Å; W661-L685 HydrophobicContact CD2-CG 4.38Å; W661-L685 HydrophobicContact CE3-CB 4.15Å; W661-L685 HydrophobicContact CE3-CD2 3.38Å; W661-L685 HydrophobicContact CE3-CG 4.38Å; W661-L685 HydrophobicContact CG-CB 4.11Å; W661-L685 HydrophobicContact CG-CD2 4.05Å; W661-L685 HydrophobicContact CZ2-CB 4.18Å; W661-L685 HydrophobicContact CZ3-CD2 3.99Å; I668-L685 HydrophobicContact CD1-CD2 3.58Å; I668-L685 HydrophobicContact CG2-CD1 3.87Å; I668-L685 HydrophobicContact CG2-CD2 4.25Å; N670-L685 PolarHBondContact ND2-N 3.31Å; N670-L685 WeakPolarHBondContact OD1-CB 3.3Å; N670-L685 WeakPolarHBondContact OD1-CD1 3.46Å; L685-L687 HydrophobicContact CD1-CB 4.16Å; L685-Y698 HydrophobicContact CD2-CD1 3.89Å; L685-Y698 HydrophobicContact CD2-CE1 4.4Å
686	K	81.8	Confident	80.4	Confident	112 Å²	112	56.8 Å²	56.8	49%	0.487	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	124.8	162.5	-51.2	-163.3	-170	-139	0	108.6	L643 L644 E645	L643-K686 HydrophobicContact CD1-CB 4.26Å; L644-K686 CarbonylContact O-C 3.57Å; L644-K686 VanDerWaalsContact O-CA 3.28Å; L644-K686 WeakPolarHBondContact O-CA 3.06Å; E645-K686 HydrophobicContact CB-CG 4.25Å; E645-K686 HydrophobicContact CG-CG 4.03Å; E645-K686 IonicContact OE1-NZ 3.61Å; E645-K686 WeakPolarHBondContact OE2-CD 3.33Å; E645-K686 WeakPolarHBondContact OE2-CE 3.43Å; E645-K686 IonicContact OE2-NZ 2.65Å; E645-K686 PolarHBondContact OE2-NZ 2.91Å
687	L	83.3	Confident	81.4	Confident	16 Å²	16	57.7 Å²	57.7	8%	0.084	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	149.3	-176.9	78.3	93.6	0	0	0	110.8	L644 L646 L685 P689 Y698 L719	L644-L687 HydrophobicContact CB-CD1 4.28Å; L644-L687 HydrophobicContact CB-CG 4.1Å; L644-L687 HydrophobicContact CD2-CD1 4.18Å; L644-L687 HydrophobicContact CD2-CD2 4.26Å; L644-L687 HydrophobicContact CD2-CG 4.29Å; L644-L687 HydrophobicContact CG-CG 4.38Å; L644-L687 PolarHBondContact N-O 2.96Å; L644-L687 PolarHBondContact O-N 2.96Å; L646-L687 HydrophobicContact CD1-CD2 3.91Å; L685-L687 HydrophobicContact CD1-CB 4.16Å; L687-P689 HydrophobicContact CD1-CG 3.92Å; L687-Y698 HydrophobicContact CD2-CD1 4.15Å; L687-Y698 HydrophobicContact CD2-CE1 3.75Å; L687-L719 HydrophobicContact CD1-CD1 3.83Å
688	V	83.3	Confident	82.5	Confident	60 Å²	60	53.1 Å²	53.1	36%	0.364	29%	0.288	S	S	.	.			trans	-124.9	103.3	-176.7	171	0	0	0	0	106.9	H642 L643 Q690	H642-V688 VanDerWaalsContact O-CA 3.26Å; H642-V688 WeakPolarHBondContact O-CA 3.35Å; H642-V688 WeakPolarHBondContact O-CG1 3.43Å; L643-V688 HydrophobicContact CD1-CG2 3.64Å; V688-Q690 PolarHBondContact O-N 3.05Å; V688-Q690 PolarHBondContact O-NE2 3.19Å
689	P	83.7	Confident	83.7	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.006	26%	0.256	C	S	.	.			trans	-57.7	134.6	-168.1	-28.8	37.5	0	0	0	113.7	V638 M640 A641 H642 L687 D693 V721	V638-P689 HydrophobicContact CG1-CB 3.97Å; V638-P689 HydrophobicContact CG1-CG 3.79Å; V638-P689 HydrophobicContact CG2-CG 4.15Å; M640-P689 WeakPolarHBondContact CA-O 3.48Å; A641-P689 PolarHBondContact N-O 3.43Å; A641-P689 VanDerWaalsContact N-O 3.17Å; H642-P689 WeakPolarHBondContact O-CD 3.46Å; L687-P689 HydrophobicContact CD1-CG 3.92Å; P689-D693 WeakPolarHBondContact CA-OD2 3.29Å; P689-V721 HydrophobicContact CB-CG1 4.21Å; P689-V721 HydrophobicContact CB-CG2 3.67Å
690	Q	84.8	Confident	84.8	Confident	70 Å²	70	42.3 Å²	42.3	33%	0.327	22%	0.219	S	C	.	.			trans	-113.3	172.5	176.6	-54	-58	-60.5	0	0	110.7	V688 E692 D693 V721	V688-Q690 PolarHBondContact O-N 3.05Å; V688-Q690 PolarHBondContact O-NE2 3.19Å; Q690-E692 VanDerWaalsContact CB-OE2 3.29Å; Q690-E692 WeakPolarHBondContact CB-OE2 3.21Å; Q690-E692 PolarHBondContact O-N 3.17Å; Q690-D693 PolarHBondContact N-OD2 3Å; Q690-D693 WeakPolarHBondContact O-CB 3.41Å; Q690-D693 PolarHBondContact O-N 2.81Å; Q690-V721 WeakPolarHBondContact O-CG1 3.31Å; Q690-V721 WeakPolarHBondContact O-CG2 3.48Å
691	K	84	Confident	85.4	Confident	17 Å²	17	36.8 Å²	36.8	7%	0.074	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-62.9	-24.9	176.3	67.7	172.7	-175.9	-177.3	0	111.9	M640 D693 N694 F723 Q726 S814	M640-K691 HydrophobicContact CE-CB 3.78Å; M640-K691 HydrophobicContact CE-CG 4.05Å; M640-K691 VanDerWaalsContact CE-N 3.27Å; K691-D693 VanDerWaalsContact C-N 3.29Å; K691-N694 WeakPolarHBondContact O-CB 3.36Å; K691-F723 HydrophobicContact CB-CB 3.92Å; K691-F723 HydrophobicContact CB-CD1 3.42Å; K691-F723 VanDerWaalsContact CB-CD1 3.42Å; K691-F723 HydrophobicContact CB-CD2 3.86Å; K691-F723 HydrophobicContact CB-CE1 3.81Å; K691-F723 HydrophobicContact CB-CE2 4.21Å; K691-F723 HydrophobicContact CB-CG 3.45Å; K691-F723 VanDerWaalsContact CB-CG 3.45Å; K691-F723 HydrophobicContact CB-CZ 4.19Å; K691-F723 HydrophobicContact CD-CD2 4.02Å; K691-F723 HydrophobicContact CD-CE2 4.18Å; K691-F723 HydrophobicContact CD-CG 4.46Å; K691-Q726 VanDerWaalsContact CE-OE1 3.29Å; K691-Q726 VanDerWaalsContact NZ-CD 3.27Å; K691-S814 VanDerWaalsContact C-OG 3.24Å; K691-S814 WeakPolarHBondContact CG-OG 3.3Å; K691-S814 WeakPolarHBondContact O-CB 3.35Å; K691-S814 PolarHBondContact O-OG 3.36Å
692	E	82.2	Confident	85.7	Confident	99 Å²	99	36.9 Å²	36.9	46%	0.463	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-80.5	-5.5	175.3	-58	79.3	-174.6	0	0	113.4	K663 Q690	K663-E692 PolarHBondContact NZ-O 2.93Å; Q690-E692 VanDerWaalsContact CB-OE2 3.29Å; Q690-E692 WeakPolarHBondContact CB-OE2 3.21Å; Q690-E692 PolarHBondContact O-N 3.17Å
693	D	84.2	Confident	85.6	Confident	16 Å²	16	38.7 Å²	38.7	9%	0.086	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-96.2	2.2	173	-59.4	-37.2	0	0	0	112.3	K663 P689 Q690 K691 G695 Y698 L719 V721	K663-D693 WeakPolarHBondContact CE-OD1 3.38Å; K663-D693 IonicContact NZ-OD1 2.83Å; K663-D693 PolarHBondContact NZ-OD1 2.78Å; P689-D693 WeakPolarHBondContact CA-OD2 3.29Å; Q690-D693 PolarHBondContact N-OD2 3Å; Q690-D693 WeakPolarHBondContact O-CB 3.41Å; Q690-D693 PolarHBondContact O-N 2.81Å; K691-D693 VanDerWaalsContact C-N 3.29Å; D693-G695 PolarHBondContact O-N 2.93Å; D693-Y698 PolarHBondContact OD1-OH 3.01Å; D693-L719 HydrophobicContact CB-CD1 3.96Å; D693-L719 WeakPolarHBondContact O-CB 3.46Å; D693-V721 HydrophobicContact CB-CG2 4.13Å
694	N	87.9	Confident	85.3	Confident	61 Å²	61	39 Å²	39	33%	0.326	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	73.7	176.7	-162.5	25.8	0	0	0	111.4	K691 N720 V721 S814	K691-N694 WeakPolarHBondContact O-CB 3.36Å; N694-N720 PolarHBondContact OD1-OD1 2.89Å; N694-V721 HydrophobicContact CB-CB 4.28Å; N694-V721 PolarHBondContact OD1-N 3.19Å; N694-S814 PolarHBondContact ND2-O 2.92Å
695	G	85.7	Confident	84.8	Confident	54 Å²	54	38.7 Å²	38.7	56%	0.557	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	128.8	8.4	175.9	0	0	0	0	0	117.9	D693 T718 L719	D693-G695 PolarHBondContact O-N 2.93Å; G695-T718 WeakPolarHBondContact O-CG2 3.25Å; G695-L719 VanDerWaalsContact CA-O 3.31Å; G695-L719 WeakPolarHBondContact CA-O 3.41Å; G695-L719 PolarHBondContact N-O 3.02Å; G695-L719 VanDerWaalsContact N-O 3.09Å
696	A	83.6	Confident	84	Confident	5 Å²	5	40.8 Å²	40.8	4%	0.041	22%	0.222	C	C	.	.			trans	-105.4	152.9	-159.8	0	0	0	0	0	117.8	K663 D664 Y698 T718 L719	K663-A696 HydrophobicContact CD-CB 4.37Å; K663-A696 HydrophobicContact CG-CB 4.38Å; D664-A696 WeakPolarHBondContact OD2-CB 3.47Å; A696-Y698 HydrophobicContact CB-CE2 4.45Å; A696-Y698 WeakPolarHBondContact O-CE2 3.23Å; A696-T718 CarbonylContact O-C 3.54Å; A696-T718 WeakPolarHBondContact O-CA 3.47Å; A696-T718 WeakPolarHBondContact O-CG2 3.25Å; A696-L719 PolarHBondContact O-N 3.07Å
697	Q	86.8	Confident	83.3	Confident	99 Å²	99	38.1 Å²	38.1	46%	0.463	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	160.3	-171.4	-52.5	-176	-1.8	0	0	115.5	K663 D664 I717 T718	K663-Q697 CarbonylContact C-O 3.59Å; K663-Q697 WeakPolarHBondContact CA-O 3.5Å; K663-Q697 WeakPolarHBondContact CG-O 3.34Å; D664-Q697 PolarHBondContact N-O 3.42Å; D664-Q697 WeakPolarHBondContact OD1-CB 3.3Å; D664-Q697 PolarHBondContact OD1-N 3.23Å; Q697-I717 CarbonylContact C-O 3.41Å; Q697-I717 WeakPolarHBondContact CA-O 3.28Å; Q697-T718 HydrophobicContact CG-CG2 3.89Å
698	Y	89.6	Confident	82.5	Confident	14 Å²	14	44.1 Å²	44.1	6%	0.055	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	138.9	-165.8	-72.5	-102.3	0	0	0	119	L646 F662 K663 I668 L685 L687 D693 A696 A716 I717 L719	L646-Y698 HydrophobicContact CD1-CD1 4.46Å; F662-Y698 CarbonylContact O-C 3.28Å; F662-Y698 VanDerWaalsContact O-C 3.28Å; F662-Y698 WeakPolarHBondContact O-CA 3.39Å; K663-Y698 HydrophobicContact CB-CE1 4.46Å; K663-Y698 HydrophobicContact CG-CE1 4.27Å; K663-Y698 HydrophobicContact CG-CE2 4.26Å; I668-Y698 HydrophobicContact CD1-CD1 3.22Å; I668-Y698 HydrophobicContact CD1-CE1 3.45Å; I668-Y698 VanDerWaalsContact CD1-CE1 3.45Å; I668-Y698 HydrophobicContact CD1-CG 4.3Å; L685-Y698 HydrophobicContact CD2-CD1 3.89Å; L685-Y698 HydrophobicContact CD2-CE1 4.4Å; L687-Y698 HydrophobicContact CD2-CD1 4.15Å; L687-Y698 HydrophobicContact CD2-CE1 3.75Å; D693-Y698 PolarHBondContact OD1-OH 3.01Å; A696-Y698 HydrophobicContact CB-CE2 4.45Å; A696-Y698 WeakPolarHBondContact O-CE2 3.23Å; Y698-A716 WeakPolarHBondContact O-CA 3.19Å; Y698-A716 WeakPolarHBondContact O-CB 3.49Å; Y698-I717 WeakPolarHBondContact CD2-O 3.32Å; Y698-I717 PolarHBondContact N-O 3.14Å; Y698-L719 HydrophobicContact CE2-CD1 3.49Å; Y698-L719 VanDerWaalsContact CE2-CD1 3.49Å; Y698-L719 HydrophobicContact CE2-CG 4.04Å; Y698-L719 WeakPolarHBondContact OH-CD1 3.32Å
699	H	90.9	Very high	81.6	Confident	28 Å²	28	45.3 Å²	45.3	13%	0.13	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	-174.7	-172.6	1.3	-58.9	0	0	0	116.8	W661 F662 K665 E715 A716	W661-H699 CarbonylContact C-O 3.5Å; W661-H699 VanDerWaalsContact C-O 3.27Å; W661-H699 WeakPolarHBondContact CA-O 3.44Å; W661-H699 VanDerWaalsContact CB-O 3.27Å; W661-H699 WeakPolarHBondContact CB-O 3.45Å; W661-H699 VanDerWaalsContact CD2-O 3.29Å; F662-H699 HydrophobicContact CB-CB 3.87Å; F662-H699 WeakPolarHBondContact CB-CD2 3.36Å; F662-H699 PolarHBondContact N-O 3.23Å; F662-H699 PolarHBondContact O-N 3.48Å; K665-H699 WeakPolarHBondContact CA-NE2 3.39Å; K665-H699 PolarHBondContact N-NE2 3.01Å; H699-E715 WeakPolarHBondContact CA-O 3.35Å; H699-E715 WeakPolarHBondContact CB-O 3.33Å; H699-A716 WeakPolarHBondContact ND1-CB 3.35Å
700	C	89.7	Confident	81.3	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	152.9	176.3	89.3	0	0	0	0	121.7	K628 I629 C648 Q660 W661 D713 S714	K628-C700 PolarHBondContact O-SG 2.95Å; K628-C700 VanDerWaalsContact O-SG 3.34Å; I629-C700 HydrophobicContact CD1-CB 4Å; I629-C700 HydrophobicContact CG1-CB 4.34Å; C648-C700 HydrophobicContact CB-CB 4.05Å; C648-C700 WeakPolarHBondContact CB-SG 2.98Å; C648-C700 WeakPolarHBondContact SG-CB 3.27Å; C648-C700 CovalentContact SG-SG 2.07Å; C648-C700 PolarHBondContact SG-SG 2.89Å; Q660-C700 CarbonylContact O-C 3.5Å; Q660-C700 WeakPolarHBondContact O-CA 3.48Å; Q660-C700 WeakPolarHBondContact O-CB 3.29Å; W661-C700 HydrophobicContact CB-CB 4.39Å; W661-C700 VanDerWaalsContact CD1-CB 3.49Å; W661-C700 HydrophobicContact CD2-CB 3.84Å; W661-C700 HydrophobicContact CG-CB 3.7Å; C700-D713 CarbonylContact O-C 3.47Å; C700-D713 VanDerWaalsContact O-C 3.31Å; C700-D713 WeakPolarHBondContact O-CA 3.26Å; C700-S714 WeakPolarHBondContact CA-OG 3.05Å; C700-S714 PolarHBondContact N-OG 3.11Å; C700-S714 WeakPolarHBondContact O-CB 3.41Å; C700-S714 PolarHBondContact O-N 3.06Å; C700-S714 PolarHBondContact O-OG 3.08Å; C700-S714 PolarHBondContact SG-OG 2.88Å; C700-S714 VanDerWaalsContact SG-OG 3.34Å
701	S	89.6	Confident	81.3	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.007	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	177.6	-170.9	-44	0	0	0	0	120	L659 Q660 F662 I712 D713	L659-S701 CarbonylContact C-O 3.6Å; L659-S701 WeakPolarHBondContact CA-O 3.4Å; L659-S701 VanDerWaalsContact CD2-O 3.27Å; L659-S701 WeakPolarHBondContact CD2-O 3.32Å; Q660-S701 WeakPolarHBondContact CB-O 3.08Å; Q660-S701 PolarHBondContact N-O 3.5Å; Q660-S701 PolarHBondContact O-N 3.05Å; F662-S701 WeakPolarHBondContact CE2-OG 3.49Å; S701-I712 CarbonylContact C-O 3.49Å; S701-I712 WeakPolarHBondContact CA-O 3.06Å; S701-I712 WeakPolarHBondContact CB-O 3.2Å; S701-D713 VanDerWaalsContact CB-OD1 3.23Å; S701-D713 WeakPolarHBondContact CB-OD1 3.35Å; S701-D713 WeakPolarHBondContact OG-CA 3.36Å; S701-D713 VanDerWaalsContact OG-CG 3.31Å; S701-D713 PolarHBondContact OG-OD1 2.89Å
702	A	87.4	Confident	81.4	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.008	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	156.1	-177.3	0	0	0	0	0	121.7	D625 P627 T650 E658 L659 W711 I712	D625-A702 WeakPolarHBondContact O-CB 3.5Å; P627-A702 HydrophobicContact CB-CB 4.25Å; P627-A702 HydrophobicContact CG-CB 3.96Å; T650-A702 HydrophobicContact CG2-CB 4.4Å; T650-A702 WeakPolarHBondContact OG1-CB 3.05Å; E658-A702 CarbonylContact O-C 3.35Å; E658-A702 WeakPolarHBondContact O-CA 3.45Å; E658-A702 WeakPolarHBondContact O-CB 3.03Å; L659-A702 HydrophobicContact CD2-CB 4.46Å; A702-W711 WeakPolarHBondContact O-CA 3.44Å; A702-I712 PolarHBondContact N-O 2.81Å
703	R	84.1	Confident	81.5	Confident	73 Å²	73	57.4 Å²	57.4	28%	0.275	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.6	-174.9	-179.7	72.6	160.1	179.1	-177.4	-1.6	119.9	P657 E658 E710 W711	P657-R703 CarbonylContact C-O 3.47Å; P657-R703 WeakPolarHBondContact CA-O 3.38Å; E658-R703 HydrophobicContact CB-CG 4.06Å; E658-R703 PolarHBondContact N-O 3.03Å; E658-R703 PolarHBondContact O-N 3.26Å; E658-R703 IonicContact OE1-NH2 3.44Å; E658-R703 IonicContact OE2-CZ 3.87Å; E658-R703 IonicContact OE2-NE 2.73Å; E658-R703 PolarHBondContact OE2-NE 2.86Å; E658-R703 IonicContact OE2-NH2 3.5Å; E658-R703 PolarHBondContact OE2-NH2 2.81Å; R703-E710 WeakPolarHBondContact CB-O 3.32Å; R703-W711 HydrophobicContact CB-CD2 3.96Å; R703-W711 HydrophobicContact CB-CE3 3.9Å; R703-W711 HydrophobicContact CB-CG 4.46Å; R703-W711 HydrophobicContact CB-CZ3 4.19Å; R703-W711 VanDerWaalsContact CD-CE2 3.47Å; R703-W711 VanDerWaalsContact CD-CZ2 3.46Å; R703-W711 HydrophobicContact CG-CD2 3.93Å; R703-W711 HydrophobicContact CG-CE3 3.85Å; R703-W711 HydrophobicContact CG-CH2 3.65Å; R703-W711 HydrophobicContact CG-CZ2 3.75Å; R703-W711 HydrophobicContact CG-CZ3 3.69Å
704	N	80.4	Confident	81.7	Confident	10 Å²	10	58.5 Å²	58.5	5%	0.053	32%	0.318	C	S	.	.			trans	-162.2	-165.3	151.4	96.5	-16.2	0	0	0	119	H622 P623 P624 P655 A706 T707	H622-N704 PolarHBondContact O-ND2 2.82Å; P623-N704 VanDerWaalsContact CA-CG 3.48Å; P623-N704 WeakPolarHBondContact CA-ND2 3.29Å; P623-N704 VanDerWaalsContact CA-OD1 3.23Å; P623-N704 WeakPolarHBondContact CA-OD1 3.38Å; P623-N704 PolarHBondContact O-ND2 2.83Å; P623-N704 VanDerWaalsContact O-ND2 3.15Å; P624-N704 HydrophobicContact CB-CB 3.58Å; P624-N704 WeakPolarHBondContact CD-OD1 3.5Å; P624-N704 HydrophobicContact CG-CB 3.85Å; P624-N704 VanDerWaalsContact CG-CG 3.47Å; P624-N704 WeakPolarHBondContact CG-OD1 3.4Å; P655-N704 PolarHBondContact O-ND2 3.05Å; N704-A706 PolarHBondContact OD1-N 2.78Å; N704-T707 PolarHBondContact O-OG1 2.8Å
705	T	72.9	Confident	81.7	Confident	68 Å²	68	63.1 Å²	63.1	42%	0.417	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-19.6	-176.9	54.6	0	0	0	0	119.6	I621 H622	I621-T705 HydrophobicContact CD1-CG2 4.36Å; H622-T705 PolarHBondContact O-OG1 3.1Å
706	A	68.9	Low	81.6	Confident	52 Å²	52	63.3 Å²	63.3	43%	0.43	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114	-0	179.9	0	0	0	0	0	114.5	H622 P623 N704	H622-A706 VanDerWaalsContact O-CB 3.23Å; H622-A706 WeakPolarHBondContact O-CB 3.29Å; H622-A706 PolarHBondContact O-N 3.4Å; P623-A706 HydrophobicContact CB-CB 4.05Å; N704-A706 PolarHBondContact OD1-N 2.78Å
707	T	66.9	Low	81.9	Confident	56 Å²	56	66 Å²	66	34%	0.344	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	13.7	160.7	45.2	0	0	0	0	113.1	P624 N704 N709	P624-T707 HydrophobicContact CG-CG2 3.5Å; N704-T707 PolarHBondContact O-OG1 2.8Å; T707-N709 PolarHBondContact O-N 2.89Å; T707-N709 VanDerWaalsContact O-N 3.08Å
708	N	65.8	Low	82	Confident	141 Å²	141	63 Å²	63	75%	0.754	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	20	-172.3	-54.6	-42.6	0	0	0	114.4
709	N	65.2	Low	81.8	Confident	85 Å²	85	62.9 Å²	62.9	46%	0.455	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	31.5	168.5	-44.2	-81.2	0	0	0	119.6	T707	T707-N709 PolarHBondContact O-N 2.89Å; T707-N709 VanDerWaalsContact O-N 3.08Å
710	E	77.4	Confident	81.8	Confident	157 Å²	157	64.2 Å²	64.2	73%	0.734	34%	0.344	S	S	*	.			trans	-87.3	159.3	177.9	-58.3	-170	147.4	0	0	115.6	R703	R703-E710 WeakPolarHBondContact CB-O 3.32Å
711	W	85	Confident	81.6	Confident	92 Å²	92	64.3 Å²	64.3	35%	0.348	35%	0.345	S	S	.	.			trans	-128.5	167.2	-166	-71.3	104.3	0	0	0	116.6	E658 Q660 A702 R703	E658-W711 HydrophobicContact CG-CH2 4.14Å; Q660-W711 HydrophobicContact CB-CE3 4.28Å; Q660-W711 HydrophobicContact CB-CH2 3.59Å; Q660-W711 HydrophobicContact CB-CZ3 3.36Å; Q660-W711 HydrophobicContact CG-CH2 3.65Å; Q660-W711 HydrophobicContact CG-CZ2 4.31Å; Q660-W711 HydrophobicContact CG-CZ3 3.84Å; A702-W711 WeakPolarHBondContact O-CA 3.44Å; R703-W711 HydrophobicContact CB-CD2 3.96Å; R703-W711 HydrophobicContact CB-CE3 3.9Å; R703-W711 HydrophobicContact CB-CG 4.46Å; R703-W711 HydrophobicContact CB-CZ3 4.19Å; R703-W711 VanDerWaalsContact CD-CE2 3.47Å; R703-W711 VanDerWaalsContact CD-CZ2 3.46Å; R703-W711 HydrophobicContact CG-CD2 3.93Å; R703-W711 HydrophobicContact CG-CE3 3.85Å; R703-W711 HydrophobicContact CG-CH2 3.65Å; R703-W711 HydrophobicContact CG-CZ2 3.75Å; R703-W711 HydrophobicContact CG-CZ3 3.69Å
712	I	84.3	Confident	81.6	Confident	79 Å²	79	67.8 Å²	67.8	41%	0.405	36%	0.363	S	S	.	.			trans	-153.8	129.1	-173.6	-38.2	173.6	0	0	0	113.9	I626 P627 S701 A702	I626-I712 HydrophobicContact CB-CD1 4.29Å; I626-I712 HydrophobicContact CD1-CD1 4.5Å; I626-I712 HydrophobicContact CG1-CD1 3.68Å; I626-I712 HydrophobicContact CG2-CD1 4.13Å; I626-I712 HydrophobicContact CG2-CG2 4.07Å; P627-I712 VanDerWaalsContact CG-O 3.24Å; P627-I712 WeakPolarHBondContact CG-O 3.25Å; S701-I712 CarbonylContact C-O 3.49Å; S701-I712 WeakPolarHBondContact CA-O 3.06Å; S701-I712 WeakPolarHBondContact CB-O 3.2Å; A702-I712 PolarHBondContact N-O 2.81Å
713	D	86.1	Confident	81.5	Confident	113 Å²	113	67.7 Å²	67.7	60%	0.604	36%	0.362	S	S	*	.			trans	-121.5	-176.1	-151.2	-56.1	-15.7	0	0	0	122.9	C700 S701	C700-D713 CarbonylContact O-C 3.47Å; C700-D713 VanDerWaalsContact O-C 3.31Å; C700-D713 WeakPolarHBondContact O-CA 3.26Å; S701-D713 VanDerWaalsContact CB-OD1 3.23Å; S701-D713 WeakPolarHBondContact CB-OD1 3.35Å; S701-D713 WeakPolarHBondContact OG-CA 3.36Å; S701-D713 VanDerWaalsContact OG-CG 3.31Å; S701-D713 PolarHBondContact OG-OD1 2.89Å
714	S	88.4	Confident	81.6	Confident	40 Å²	40	65 Å²	65	28%	0.28	36%	0.355	S	S	.	.			trans	-158.7	-163.8	-178.7	65.9	0	0	0	0	119.7	C700	C700-S714 WeakPolarHBondContact CA-OG 3.05Å; C700-S714 PolarHBondContact N-OG 3.11Å; C700-S714 WeakPolarHBondContact O-CB 3.41Å; C700-S714 PolarHBondContact O-N 3.06Å; C700-S714 PolarHBondContact O-OG 3.08Å; C700-S714 PolarHBondContact SG-OG 2.88Å; C700-S714 VanDerWaalsContact SG-OG 3.34Å
715	E	86.4	Confident	81.8	Confident	157 Å²	157	64.7 Å²	64.7	73%	0.734	35%	0.353	S	S	*	.			trans	-100.7	178.4	-162.6	-59.3	-176.1	171	0	0	119.7	I629 H699	I629-E715 WeakPolarHBondContact CD1-O 3.38Å; H699-E715 WeakPolarHBondContact CA-O 3.35Å; H699-E715 WeakPolarHBondContact CB-O 3.33Å
716	A	84.9	Confident	82.1	Confident	59 Å²	59	65.7 Å²	65.7	49%	0.488	35%	0.353	S	S	.	.			trans	-146.5	160.9	-161.7	0	0	0	0	0	127.2	Y698 H699	Y698-A716 WeakPolarHBondContact O-CA 3.19Å; Y698-A716 WeakPolarHBondContact O-CB 3.49Å; H699-A716 WeakPolarHBondContact ND1-CB 3.35Å
717	I	88.4	Confident	82.8	Confident	60 Å²	60	71.1 Å²	71.1	31%	0.308	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	165.8	-177.6	-17.4	175	0	0	0	116	Q697 Y698	Q697-I717 CarbonylContact C-O 3.41Å; Q697-I717 WeakPolarHBondContact CA-O 3.28Å; Y698-I717 WeakPolarHBondContact CD2-O 3.32Å; Y698-I717 PolarHBondContact N-O 3.14Å
718	T	89	Confident	83.7	Confident	37 Å²	37	68.7 Å²	68.7	23%	0.227	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	156.2	-158.9	-31.7	0	0	0	0	122.2	Y632 S634 G695 A696 Q697	Y632-T718 WeakPolarHBondContact CE1-O 3.37Å; S634-T718 VanDerWaalsContact CA-O 3.29Å; S634-T718 WeakPolarHBondContact CA-O 3.46Å; S634-T718 PolarHBondContact OG-O 2.57Å; G695-T718 WeakPolarHBondContact O-CG2 3.25Å; A696-T718 CarbonylContact O-C 3.54Å; A696-T718 WeakPolarHBondContact O-CA 3.47Å; A696-T718 WeakPolarHBondContact O-CG2 3.25Å; Q697-T718 HydrophobicContact CG-CG2 3.89Å
719	L	87.1	Confident	84.7	Confident	11 Å²	11	63.2 Å²	63.2	6%	0.058	32%	0.32	C	S	.	.			trans	-127.9	176.5	-165.3	-64.7	176.3	0	0	0	122.6	Y632 L644 L687 D693 G695 A696 Y698	Y632-L719 HydrophobicContact CD1-CD2 4.24Å; Y632-L719 HydrophobicContact CE1-CD2 3.46Å; Y632-L719 VanDerWaalsContact CE1-CD2 3.46Å; Y632-L719 HydrophobicContact CE1-CG 4.49Å; L644-L719 HydrophobicContact CD2-CD2 3.76Å; L687-L719 HydrophobicContact CD1-CD1 3.83Å; D693-L719 HydrophobicContact CB-CD1 3.96Å; D693-L719 WeakPolarHBondContact O-CB 3.46Å; G695-L719 VanDerWaalsContact CA-O 3.31Å; G695-L719 WeakPolarHBondContact CA-O 3.41Å; G695-L719 PolarHBondContact N-O 3.02Å; G695-L719 VanDerWaalsContact N-O 3.09Å; A696-L719 PolarHBondContact O-N 3.07Å; Y698-L719 HydrophobicContact CE2-CD1 3.49Å; Y698-L719 VanDerWaalsContact CE2-CD1 3.49Å; Y698-L719 HydrophobicContact CE2-CG 4.04Å; Y698-L719 WeakPolarHBondContact OH-CD1 3.32Å
720	N	89.4	Confident	85.7	Confident	57 Å²	57	60 Å²	60	31%	0.305	30%	0.303	S	S	.	.			trans	-156.9	131.5	-178.6	171.6	8.8	0	0	0	115.4	G635 V638 N694	G635-N720 PolarHBondContact O-ND2 2.97Å; V638-N720 WeakPolarHBondContact CG1-O 3.11Å; V638-N720 PolarHBondContact N-O 3.32Å; N694-N720 PolarHBondContact OD1-OD1 2.89Å
721	V	86.4	Confident	85.9	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.006	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	146.7	-165.2	-165.4	0	0	0	0	119.5	V638 M640 P689 Q690 D693 N694	V638-V721 HydrophobicContact CG1-CG2 4.4Å; V638-V721 WeakPolarHBondContact O-CA 3.41Å; M640-V721 HydrophobicContact CB-CG1 4.26Å; P689-V721 HydrophobicContact CB-CG1 4.21Å; P689-V721 HydrophobicContact CB-CG2 3.67Å; Q690-V721 WeakPolarHBondContact O-CG1 3.31Å; Q690-V721 WeakPolarHBondContact O-CG2 3.48Å; D693-V721 HydrophobicContact CB-CG2 4.13Å; N694-V721 HydrophobicContact CB-CB 4.28Å; N694-V721 PolarHBondContact OD1-N 3.19Å
722	L	88.7	Confident	85.3	Confident	74 Å²	74	55.3 Å²	55.3	39%	0.387	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	147.6	172.2	-59.5	178.7	0	0	0	114.7	V638 M640	V638-L722 PolarHBondContact O-N 3.46Å; M640-L722 WeakPolarHBondContact CB-O 3.34Å; M640-L722 PolarHBondContact N-O 2.85Å
723	F	86.2	Confident	84.2	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-162.8	153.5	-171.1	58.2	-89.3	0	0	0	118.1	M640 K691 N754	M640-F723 HydrophobicContact CB-CB 4.41Å; M640-F723 HydrophobicContact CE-CB 3.66Å; M640-F723 HydrophobicContact SD-CB 4.16Å; K691-F723 HydrophobicContact CB-CB 3.92Å; K691-F723 HydrophobicContact CB-CD1 3.42Å; K691-F723 VanDerWaalsContact CB-CD1 3.42Å; K691-F723 HydrophobicContact CB-CD2 3.86Å; K691-F723 HydrophobicContact CB-CE1 3.81Å; K691-F723 HydrophobicContact CB-CE2 4.21Å; K691-F723 HydrophobicContact CB-CG 3.45Å; K691-F723 VanDerWaalsContact CB-CG 3.45Å; K691-F723 HydrophobicContact CB-CZ 4.19Å; K691-F723 HydrophobicContact CD-CD2 4.02Å; K691-F723 HydrophobicContact CD-CE2 4.18Å; K691-F723 HydrophobicContact CD-CG 4.46Å; F723-N754 HydrophobicContact CD1-CB 4.07Å; F723-N754 HydrophobicContact CD2-CB 4.38Å; F723-N754 HydrophobicContact CE1-CB 3.79Å; F723-N754 HydrophobicContact CE2-CB 4.12Å; F723-N754 HydrophobicContact CG-CB 4.35Å; F723-N754 HydrophobicContact CZ-CB 3.82Å; F723-N754 CarbonylContact O-C 3.5Å; F723-N754 PolarHBondContact O-N 2.98Å
724	P	85.9	Confident	83.3	Confident	17 Å²	17	50.5 Å²	50.5	11%	0.11	28%	0.283	C	S	.	.			trans	-87.4	173.6	172.7	35.8	-32.2	0	0	0	113.3	Y845 W850	P724-Y845 HydrophobicContact CB-CD1 4.43Å; P724-Y845 HydrophobicContact CB-CD2 3.67Å; P724-Y845 HydrophobicContact CB-CE2 4.01Å; P724-Y845 HydrophobicContact CB-CG 3.9Å; P724-Y845 HydrophobicContact CG-CD1 4.19Å; P724-Y845 HydrophobicContact CG-CD2 4.14Å; P724-Y845 HydrophobicContact CG-CE1 4.19Å; P724-Y845 HydrophobicContact CG-CE2 4.14Å; P724-Y845 HydrophobicContact CG-CG 4.16Å; P724-W850 HydrophobicContact CB-CH2 3.77Å; P724-W850 HydrophobicContact CB-CZ2 3.94Å; P724-W850 HydrophobicContact CG-CZ2 4.39Å
725	P	85.3	Confident	82.2	Confident	3 Å²	3	54 Å²	54	2%	0.019	29%	0.294	C	S	.	.			trans	-67	166	169.9	31.6	-36.3	0	0	0	110.9	D751 S753 A757 N842 W850	P725-D751 HydrophobicContact CB-CB 4.16Å; P725-S753 VanDerWaalsContact CD-CB 3.44Å; P725-A757 HydrophobicContact CG-CB 4.2Å; P725-N842 HydrophobicContact CG-CB 4.42Å; P725-W850 HydrophobicContact CG-CD2 3.92Å; P725-W850 HydrophobicContact CG-CE3 3.63Å; P725-W850 HydrophobicContact CG-CH2 3.81Å; P725-W850 HydrophobicContact CG-CZ2 4.06Å; P725-W850 HydrophobicContact CG-CZ3 3.57Å; P725-W850 WeakPolarHBondContact O-CZ2 3.41Å; P725-W850 PolarHBondContact O-NE1 2.73Å
726	Q	79.3	Confident	81.3	Confident	88 Å²	88	50.1 Å²	50.1	41%	0.411	28%	0.284	S	S	.	.			trans	-118.7	-20.5	-177.8	-72.3	179.6	-16.8	0	0	114.4	K691	K691-Q726 VanDerWaalsContact CE-OE1 3.29Å; K691-Q726 VanDerWaalsContact NZ-CD 3.27Å
727	R	82.9	Confident	81	Confident	166 Å²	166	50.2 Å²	50.2	63%	0.626	28%	0.278	S	S	*	.			trans	-152.9	152.6	-179.8	179.3	174.2	-64.4	145.1	2.7	111.3	D751	R727-D751 WeakPolarHBondContact CB-OD2 3.39Å; R727-D751 PolarHBondContact N-OD2 3.31Å; R727-D751 WeakPolarHBondContact O-CB 3.44Å; R727-D751 PolarHBondContact O-N 3.14Å
728	V	86.3	Confident	80.7	Confident	5 Å²	5	47.6 Å²	47.6	3%	0.03	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	145.3	157.3	169.7	0	0	0	0	107.7	C748 Q749 A750 C838 A840 W850 D852	V728-C748 WeakPolarHBondContact CG1-SG 3.26Å; V728-Q749 CarbonylContact C-O 3.53Å; V728-Q749 WeakPolarHBondContact CA-O 3.3Å; V728-A750 HydrophobicContact CG2-CB 4.17Å; V728-C838 HydrophobicContact CG1-CB 4.47Å; V728-A840 HydrophobicContact CG2-CB 3.32Å; V728-W850 HydrophobicContact CB-CB 4.35Å; V728-W850 HydrophobicContact CG2-CB 3.68Å; V728-W850 WeakPolarHBondContact CG2-O 3.43Å; V728-D852 HydrophobicContact CG1-CB 4.38Å
729	S	85.8	Confident	80.6	Confident	27 Å²	27	50.7 Å²	50.7	19%	0.189	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	125	-174.9	53.3	0	0	0	0	112	C748 Q749 D852	S729-C748 CarbonylContact O-C 3.38Å; S729-C748 VanDerWaalsContact O-CA 3.31Å; S729-C748 WeakPolarHBondContact O-CA 3.38Å; S729-Q749 PolarHBondContact N-O 2.83Å; S729-Q749 PolarHBondContact O-N 2.75Å; S729-Q749 PolarHBondContact OG-O 2.79Å; S729-D852 WeakPolarHBondContact CA-OD2 3.39Å
730	L	86.8	Confident	80.5	Confident	16 Å²	16	52.5 Å²	52.5	8%	0.084	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	133.8	173	-79.7	175.5	0	0	0	111.4	I746 N747 C748 W761 C838 D852 L854	L730-I746 HydrophobicContact CD2-CG2 3.92Å; L730-N747 CarbonylContact C-O 3.45Å; L730-N747 WeakPolarHBondContact CA-O 3.42Å; L730-C748 HydrophobicContact CD2-CB 4.04Å; L730-W761 HydrophobicContact CD2-CE3 4.34Å; L730-W761 HydrophobicContact CD2-CH2 3.53Å; L730-W761 HydrophobicContact CD2-CZ3 3.37Å; L730-C838 HydrophobicContact CD1-CB 4.28Å; L730-C838 HydrophobicContact CD2-CB 3.55Å; L730-C838 HydrophobicContact CG-CB 3.97Å; L730-D852 HydrophobicContact CB-CB 4.44Å; L730-D852 HydrophobicContact CD1-CB 4.25Å; L730-D852 WeakPolarHBondContact CD1-O 3.44Å; L730-D852 HydrophobicContact CG-CB 4.11Å; L730-D852 PolarHBondContact N-OD2 3.34Å; L730-L854 HydrophobicContact CD1-CB 3.86Å
731	N	81.3	Confident	80.3	Confident	93 Å²	93	51.7 Å²	51.7	50%	0.497	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	142.2	176.9	-63	-79.6	0	0	0	110.2	N747	N731-N747 PolarHBondContact N-O 3.1Å; N731-N747 PolarHBondContact O-N 3.27Å
732	F	72.1	Confident	80.2	Confident	58 Å²	58	54.7 Å²	54.7	25%	0.254	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	132.7	168.4	-66.6	-72.4	0	0	0	110.2	G734 L744 L854	F732-G734 PolarHBondContact O-N 2.97Å; F732-G734 VanDerWaalsContact O-N 3.07Å; F732-L744 HydrophobicContact CD1-CD1 3.79Å; F732-L744 HydrophobicContact CD1-CD2 4.36Å; F732-L744 HydrophobicContact CD1-CG 4.47Å; F732-L744 HydrophobicContact CE1-CD1 4.31Å; F732-L744 HydrophobicContact CE1-CD2 4.16Å; F732-L854 HydrophobicContact CD1-CD2 3.9Å; F732-L854 HydrophobicContact CD2-CD1 4.33Å; F732-L854 HydrophobicContact CE1-CD1 4.26Å; F732-L854 HydrophobicContact CE1-CD2 3.57Å; F732-L854 HydrophobicContact CE1-CG 3.98Å; F732-L854 HydrophobicContact CE2-CD1 3.67Å; F732-L854 HydrophobicContact CE2-CD2 4.38Å; F732-L854 HydrophobicContact CE2-CG 4.29Å; F732-L854 HydrophobicContact CG-CD2 4.46Å; F732-L854 HydrophobicContact CZ-CD1 3.64Å; F732-L854 HydrophobicContact CZ-CD2 3.83Å; F732-L854 HydrophobicContact CZ-CG 3.75Å
733	G	62	Low	79.8	Confident	35 Å²	35	56.1 Å²	56.1	36%	0.361	31%	0.314	S	S	.	.	S	Bend	trans	-77.4	30.7	167.3	0	0	0	0	0	113.1	E745	G733-E745 PolarHBondContact N-O 2.79Å
734	G	66.7	Low	79.7	Confident	56 Å²	56	56.4 Å²	56.4	58%	0.577	32%	0.316	S	S	*	.	S	Bend	trans	171.3	-145.2	-170.5	0	0	0	0	0	113.8	F732	F732-G734 PolarHBondContact O-N 2.97Å; F732-G734 VanDerWaalsContact O-N 3.07Å
735	K	65.6	Low	79.7	Confident	115 Å²	115	57.9 Å²	57.9	50%	0.5	32%	0.321	S	S	.	.			trans	-68.3	138.4	-179.7	-53.5	170.1	-172.8	163.7	0	110.8	V737 E742	K735-V737 WeakPolarHBondContact CB-O 3.41Å; K735-V737 PolarHBondContact O-N 3.01Å; K735-E742 IonicContact NZ-OE1 3.37Å; K735-E742 PolarHBondContact NZ-OE1 2.91Å; K735-E742 IonicContact NZ-OE2 2.7Å; K735-E742 PolarHBondContact NZ-OE2 3.22Å
736	S	66.9	Low	79.9	Confident	75 Å²	75	57.8 Å²	57.8	52%	0.524	32%	0.32	S	S	.	.	S	Bend	trans	-76.9	-9	169.6	54.1	0	0	0	0	114.1
737	V	78.6	Confident	80.4	Confident	60 Å²	60	55.2 Å²	55.2	36%	0.364	31%	0.31	S	S	.	.	S	Bend	trans	-127.3	124.8	173.1	-175.5	0	0	0	0	107.8	K735 T859	K735-V737 WeakPolarHBondContact CB-O 3.41Å; K735-V737 PolarHBondContact O-N 3.01Å; V737-T859 HydrophobicContact CG1-CG2 3.6Å
738	V	83.2	Confident	80.7	Confident	5 Å²	5	47.5 Å²	47.5	3%	0.03	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	137.4	-168.4	-177.4	0	0	0	0	109.4	E742 L744 P827 N857 I858 T859	V738-E742 HydrophobicContact CG1-CB 3.74Å; V738-E742 HydrophobicContact CG1-CG 4.1Å; V738-L744 HydrophobicContact CG2-CB 4.5Å; V738-L744 HydrophobicContact CG2-CD1 3.73Å; V738-L744 HydrophobicContact CG2-CD2 4.21Å; V738-L744 HydrophobicContact CG2-CG 4.36Å; V738-P827 HydrophobicContact CG1-CG 4.4Å; V738-N857 PolarHBondContact N-O 3.14Å; V738-I858 CarbonylContact O-C 3.6Å; V738-I858 VanDerWaalsContact O-CA 3.25Å; V738-I858 WeakPolarHBondContact O-CA 3.2Å; V738-T859 PolarHBondContact O-N 2.78Å
739	Q	85.5	Confident	81	Confident	103 Å²	103	49.9 Å²	49.9	48%	0.481	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	143	174.1	-68.9	-172.1	-64.6	0	0	110.8	G741 E742	Q739-G741 PolarHBondContact O-N 3.04Å; Q739-E742 HydrophobicContact CB-CB 4.39Å; Q739-E742 PolarHBondContact N-OE2 2.85Å; Q739-E742 VanDerWaalsContact N-OE2 3.09Å; Q739-E742 VanDerWaalsContact O-CB 3.24Å; Q739-E742 WeakPolarHBondContact O-CB 3.38Å; Q739-E742 PolarHBondContact O-N 3.43Å
740	S	85.9	Confident	81.1	Confident	49 Å²	49	48.6 Å²	48.6	34%	0.343	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	111.1	179.4	174	0	0	0	0	111.6	W829 T859	S740-W829 PolarHBondContact OG-N 2.81Å; S740-W829 VanDerWaalsContact OG-N 3.09Å; S740-T859 PolarHBondContact N-O 2.98Å
741	G	84.7	Confident	81.1	Confident	40 Å²	40	50 Å²	50	41%	0.412	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.8	-9.5	-175.8	0	0	0	0	0	115.7	Q739 R826 P827	Q739-G741 PolarHBondContact O-N 3.04Å; G741-R826 VanDerWaalsContact O-CD 3.31Å; G741-R826 WeakPolarHBondContact O-CD 3.36Å; G741-R826 VanDerWaalsContact O-CG 3.24Å; G741-R826 WeakPolarHBondContact O-CG 3.43Å; G741-P827 PolarHBondContact N-O 3.08Å
742	E	83.9	Confident	81.5	Confident	64 Å²	64	45.8 Å²	45.8	30%	0.299	27%	0.268	S	S	.	.			trans	-70.1	156.3	169.3	-176.7	174.1	-152.1	0	0	110.6	K735 V738 Q739 P827	K735-E742 IonicContact NZ-OE1 3.37Å; K735-E742 PolarHBondContact NZ-OE1 2.91Å; K735-E742 IonicContact NZ-OE2 2.7Å; K735-E742 PolarHBondContact NZ-OE2 3.22Å; V738-E742 HydrophobicContact CG1-CB 3.74Å; V738-E742 HydrophobicContact CG1-CG 4.1Å; Q739-E742 HydrophobicContact CB-CB 4.39Å; Q739-E742 PolarHBondContact N-OE2 2.85Å; Q739-E742 VanDerWaalsContact N-OE2 3.09Å; Q739-E742 VanDerWaalsContact O-CB 3.24Å; Q739-E742 WeakPolarHBondContact O-CB 3.38Å; Q739-E742 PolarHBondContact O-N 3.43Å; E742-P827 WeakPolarHBondContact O-CD 3.44Å
743	Q	81.5	Confident	82.3	Confident	103 Å²	103	43 Å²	43	48%	0.481	26%	0.256	S	S	.	.			trans	-95.4	136.6	-178.1	-175.5	163.9	-39.7	0	0	111.3	W824	Q743-W824 HydrophobicContact CG-CE3 4.2Å
744	L	83.2	Confident	83.5	Confident	7 Å²	7	43.8 Å²	43.8	4%	0.037	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	132.5	-173.7	-178.3	59.6	0	0	0	110.6	F732 V738 I746 W824 L825 L856	F732-L744 HydrophobicContact CD1-CD1 3.79Å; F732-L744 HydrophobicContact CD1-CD2 4.36Å; F732-L744 HydrophobicContact CD1-CG 4.47Å; F732-L744 HydrophobicContact CE1-CD1 4.31Å; F732-L744 HydrophobicContact CE1-CD2 4.16Å; V738-L744 HydrophobicContact CG2-CB 4.5Å; V738-L744 HydrophobicContact CG2-CD1 3.73Å; V738-L744 HydrophobicContact CG2-CD2 4.21Å; V738-L744 HydrophobicContact CG2-CG 4.36Å; L744-I746 HydrophobicContact CD2-CD1 4.15Å; L744-I746 HydrophobicContact CD2-CG1 4.22Å; L744-I746 HydrophobicContact CG-CD1 4.48Å; L744-I746 HydrophobicContact CG-CG1 4.05Å; L744-W824 WeakPolarHBondContact O-CA 3.31Å; L744-L825 PolarHBondContact N-O 2.89Å; L744-L825 PolarHBondContact O-N 2.84Å; L744-L856 HydrophobicContact CD2-CD2 4.05Å
745	E	86.9	Confident	84.5	Confident	48 Å²	48	43.7 Å²	43.7	22%	0.224	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	138.6	170.5	-169.3	-173.8	177.5	0	0	109.5	G733 N747 H822 W824	G733-E745 PolarHBondContact N-O 2.79Å; E745-N747 WeakPolarHBondContact CG-OD1 3.32Å; E745-N747 PolarHBondContact OE1-OD1 3.14Å; E745-H822 IonicContact OE1-ND1 2.74Å; E745-W824 HydrophobicContact CB-CD2 4.33Å; E745-W824 HydrophobicContact CB-CE3 3.9Å; E745-W824 HydrophobicContact CB-CH2 3.88Å; E745-W824 HydrophobicContact CB-CZ2 4.29Å; E745-W824 HydrophobicContact CB-CZ3 3.67Å; E745-W824 VanDerWaalsContact CD-CZ2 3.46Å; E745-W824 HydrophobicContact CG-CD2 4.15Å; E745-W824 HydrophobicContact CG-CE3 4.19Å; E745-W824 HydrophobicContact CG-CH2 3.75Å; E745-W824 HydrophobicContact CG-CZ2 3.68Å; E745-W824 HydrophobicContact CG-CZ3 4.02Å; E745-W824 WeakPolarHBondContact OE2-CH2 3.37Å
746	I	88.4	Confident	85.5	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	127	179.3	-45.9	175.2	0	0	0	108.6	L730 L744 W761 H822 L823 L825 I836 L854	L730-I746 HydrophobicContact CD2-CG2 3.92Å; L744-I746 HydrophobicContact CD2-CD1 4.15Å; L744-I746 HydrophobicContact CD2-CG1 4.22Å; L744-I746 HydrophobicContact CG-CD1 4.48Å; L744-I746 HydrophobicContact CG-CG1 4.05Å; I746-W761 HydrophobicContact CB-CH2 4.09Å; I746-W761 HydrophobicContact CB-CZ3 4.13Å; I746-W761 HydrophobicContact CG2-CH2 3.86Å; I746-W761 HydrophobicContact CG2-CZ3 3.78Å; I746-W761 WeakPolarHBondContact O-CH2 3.31Å; I746-H822 CarbonylContact O-C 3.52Å; I746-L823 PolarHBondContact N-O 2.93Å; I746-L823 PolarHBondContact O-N 2.81Å; I746-L825 HydrophobicContact CD1-CD1 3.96Å; I746-I836 HydrophobicContact CD1-CB 4.37Å; I746-I836 HydrophobicContact CD1-CG1 4Å; I746-I836 HydrophobicContact CD1-CG2 4.17Å; I746-L854 HydrophobicContact CD1-CD2 4.29Å; I746-L854 HydrophobicContact CG1-CD2 4.45Å; I746-L854 HydrophobicContact CG2-CD2 3.54Å
747	N	90	Very high	86.4	Confident	35 Å²	35	37.2 Å²	37.2	19%	0.187	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	141.2	-169.9	-60.5	-8.9	0	0	0	109.8	L730 N731 E745 H822	L730-N747 CarbonylContact C-O 3.45Å; L730-N747 WeakPolarHBondContact CA-O 3.42Å; N731-N747 PolarHBondContact N-O 3.1Å; N731-N747 PolarHBondContact O-N 3.27Å; E745-N747 WeakPolarHBondContact CG-OD1 3.32Å; E745-N747 PolarHBondContact OE1-OD1 3.14Å; N747-H822 PolarHBondContact OD1-ND1 2.72Å
748	C	90.2	Very high	86.9	Confident	3 Å²	3	39 Å²	39	2%	0.02	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	133	-175.1	-172.4	0	0	0	0	111.3	V728 S729 L730 W761 R820 S821 C838	V728-C748 WeakPolarHBondContact CG1-SG 3.26Å; S729-C748 CarbonylContact O-C 3.38Å; S729-C748 VanDerWaalsContact O-CA 3.31Å; S729-C748 WeakPolarHBondContact O-CA 3.38Å; L730-C748 HydrophobicContact CD2-CB 4.04Å; C748-W761 HydrophobicContact CB-CH2 3.69Å; C748-W761 HydrophobicContact CB-CZ2 3.42Å; C748-W761 VanDerWaalsContact CB-CZ2 3.42Å; C748-R820 CarbonylContact O-C 3.57Å; C748-R820 VanDerWaalsContact O-CA 3.23Å; C748-R820 WeakPolarHBondContact O-CA 3.37Å; C748-S821 PolarHBondContact N-O 3.02Å; C748-S821 PolarHBondContact O-N 2.89Å; C748-C838 HydrophobicContact CB-CB 3.86Å; C748-C838 WeakPolarHBondContact CB-SG 3.37Å; C748-C838 WeakPolarHBondContact SG-CB 3.38Å; C748-C838 CovalentContact SG-SG 2.04Å; C748-C838 PolarHBondContact SG-SG 2.81Å
749	Q	90.9	Very high	87.1	Confident	55 Å²	55	39.2 Å²	39.2	26%	0.257	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	133.6	177.3	-177.5	-178	-93.3	0	0	111.4	V728 S729 A819 R820	V728-Q749 CarbonylContact C-O 3.53Å; V728-Q749 WeakPolarHBondContact CA-O 3.3Å; S729-Q749 PolarHBondContact N-O 2.83Å; S729-Q749 PolarHBondContact O-N 2.75Å; S729-Q749 PolarHBondContact OG-O 2.79Å; Q749-A819 WeakPolarHBondContact CA-O 3.32Å; Q749-R820 HydrophobicContact CB-CG 3.9Å; Q749-R820 HydrophobicContact CG-CG 3.72Å; Q749-R820 VanDerWaalsContact OE1-NH2 3.14Å
750	A	88.9	Confident	87.3	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	144.5	171.5	0	0	0	0	0	112	V728 I759 L818 A819 A840	V728-A750 HydrophobicContact CG2-CB 4.17Å; A750-I759 HydrophobicContact CB-CD1 4.18Å; A750-I759 HydrophobicContact CB-CG1 4.47Å; A750-L818 WeakPolarHBondContact O-CD2 3.12Å; A750-A819 HydrophobicContact CB-CB 4.48Å; A750-A819 PolarHBondContact N-O 2.99Å; A750-A840 HydrophobicContact CB-CB 4.16Å
751	D	87.6	Confident	87.5	Confident	45 Å²	45	35.6 Å²	35.6	24%	0.241	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	164.8	-178.8	-94.2	-7	0	0	0	114.9	P725 R727 S753	P725-D751 HydrophobicContact CB-CB 4.16Å; R727-D751 WeakPolarHBondContact CB-OD2 3.39Å; R727-D751 PolarHBondContact N-OD2 3.31Å; R727-D751 WeakPolarHBondContact O-CB 3.44Å; R727-D751 PolarHBondContact O-N 3.14Å; D751-S753 PolarHBondContact O-N 2.75Å
752	S	88.8	Confident	87.7	Confident	5 Å²	5	36.1 Å²	36.1	4%	0.035	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	130.9	177.1	-171.6	0	0	0	0	112.2	G812 A813 G816 L817	S752-G812 WeakPolarHBondContact OG-CA 3.36Å; S752-A813 WeakPolarHBondContact CB-O 3.15Å; S752-A813 PolarHBondContact OG-N 2.7Å; S752-A813 PolarHBondContact OG-O 2.92Å; S752-G816 VanDerWaalsContact OG-C 3.3Å; S752-G816 VanDerWaalsContact OG-CA 3.27Å; S752-G816 WeakPolarHBondContact OG-CA 3.45Å; S752-L817 CarbonylContact C-O 3.58Å; S752-L817 WeakPolarHBondContact CA-O 3.37Å
753	S	88.2	Confident	88	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.007	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	149.4	-175.7	52.3	0	0	0	0	112.4	P725 D751 P755 V756 G816 L817	P725-S753 VanDerWaalsContact CD-CB 3.44Å; D751-S753 PolarHBondContact O-N 2.75Å; S753-P755 CarbonylContact C-O 3.52Å; S753-P755 VanDerWaalsContact C-O 3.23Å; S753-P755 WeakPolarHBondContact CB-O 3.48Å; S753-P755 CarbonylContact O-C 3.37Å; S753-P755 PolarHBondContact OG-O 2.94Å; S753-V756 WeakPolarHBondContact OG-CA 3.27Å; S753-G816 CarbonylContact O-C 3.23Å; S753-G816 VanDerWaalsContact O-CA 3.28Å; S753-G816 WeakPolarHBondContact O-CA 3.49Å; S753-L817 PolarHBondContact N-O 3.38Å; S753-L817 PolarHBondContact O-N 3.33Å; S753-L817 PolarHBondContact OG-O 3.18Å; S753-L817 VanDerWaalsContact OG-O 3.14Å
754	N	87.9	Confident	88.3	Confident	51 Å²	51	30.7 Å²	30.7	27%	0.273	17%	0.165	S	C	.	.	B	Isolated β-bridge	trans	-130.4	89.4	-177.5	-178.1	12.2	0	0	0	109.4	F723	F723-N754 HydrophobicContact CD1-CB 4.07Å; F723-N754 HydrophobicContact CD2-CB 4.38Å; F723-N754 HydrophobicContact CE1-CB 3.79Å; F723-N754 HydrophobicContact CE2-CB 4.12Å; F723-N754 HydrophobicContact CG-CB 4.35Å; F723-N754 HydrophobicContact CZ-CB 3.82Å; F723-N754 CarbonylContact O-C 3.5Å; F723-N754 PolarHBondContact O-N 2.98Å
755	P	86.6	Confident	88.5	Confident	54 Å²	54	31.4 Å²	31.4	35%	0.351	17%	0.168	S	C	.	.	S	Bend	cis	-87.2	-176	6	37.4	-37.7	0	0	0	114.3	S753 N842 V844	S753-P755 CarbonylContact C-O 3.52Å; S753-P755 VanDerWaalsContact C-O 3.23Å; S753-P755 WeakPolarHBondContact CB-O 3.48Å; S753-P755 CarbonylContact O-C 3.37Å; S753-P755 PolarHBondContact OG-O 2.94Å; P755-N842 PolarHBondContact O-ND2 3.01Å; P755-V844 HydrophobicContact CG-CB 4.41Å; P755-V844 HydrophobicContact CG-CG2 3.49Å; P755-V844 VanDerWaalsContact CG-CG2 3.49Å
756	V	87.3	Confident	88.1	Confident	44 Å²	44	30.8 Å²	30.8	27%	0.267	17%	0.169	S	C	.	.			trans	-67.3	165.6	-172.2	72.8	0	0	0	0	116	S753 P809 L817 A819 N842 P843	S753-V756 WeakPolarHBondContact OG-CA 3.27Å; V756-P809 HydrophobicContact CG2-CB 4.04Å; V756-P809 HydrophobicContact CG2-CG 4Å; V756-L817 HydrophobicContact CB-CB 3.97Å; V756-L817 HydrophobicContact CB-CD1 4.22Å; V756-L817 HydrophobicContact CG2-CB 3.99Å; V756-A819 HydrophobicContact CG2-CB 4.32Å; V756-N842 PolarHBondContact O-ND2 3.48Å; V756-P843 VanDerWaalsContact O-CD 3.28Å; V756-P843 WeakPolarHBondContact O-CD 3.26Å
757	A	86.8	Confident	87.4	Confident	9 Å²	9	30.9 Å²	30.9	7%	0.074	17%	0.17	C	C	.	.			trans	-116.7	165.4	-176.6	0	0	0	0	0	114.8	P725 A819 E841	P725-A757 HydrophobicContact CG-CB 4.2Å; A757-A819 WeakPolarHBondContact O-CB 3.39Å; A757-E841 CarbonylContact C-O 3.53Å; A757-E841 WeakPolarHBondContact CA-O 3.46Å; A757-E841 WeakPolarHBondContact CB-O 3.37Å
758	V	87.9	Confident	86.8	Confident	97 Å²	97	32.1 Å²	32.1	59%	0.588	18%	0.18	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-117.9	152.1	-177.3	-179	0	0	0	0	111	A840 E841	V758-A840 CarbonylContact O-C 3.24Å; V758-A840 WeakPolarHBondContact O-CA 3.23Å; V758-A840 WeakPolarHBondContact O-CB 2.22Å; V758-E841 PolarHBondContact N-O 3.24Å; V758-E841 PolarHBondContact O-N 2.88Å
759	I	88.6	Confident	85.9	Confident	10 Å²	10	32 Å²	32	5%	0.051	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	147.2	-170.5	-63.6	175.2	0	0	0	113.9	A750 A819 C838 Q839 A840	A750-I759 HydrophobicContact CB-CD1 4.18Å; A750-I759 HydrophobicContact CB-CG1 4.47Å; I759-A819 HydrophobicContact CD1-CB 4.13Å; I759-C838 WeakPolarHBondContact CG2-SG 3.41Å; I759-Q839 CarbonylContact C-O 3.58Å; I759-Q839 VanDerWaalsContact CA-O 3.32Å; I759-Q839 WeakPolarHBondContact CA-O 3.43Å; I759-A840 HydrophobicContact CG1-CB 3.95Å
760	T	88.9	Confident	85.2	Confident	70 Å²	70	30.5 Å²	30.5	43%	0.429	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	168.7	172.3	45	0	0	0	0	114.4	C838 Q839	T760-C838 WeakPolarHBondContact O-CA 3.45Å; T760-Q839 PolarHBondContact N-O 3.13Å; T760-Q839 PolarHBondContact O-N 3.31Å; T760-Q839 WeakPolarHBondContact OG1-CG 3.5Å; T760-Q839 PolarHBondContact OG1-NE2 3.28Å
761	W	90.2	Very high	84.2	Confident	7 Å²	7	32 Å²	32	3%	0.027	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	149.9	-166.9	-67.5	89.4	0	0	0	116.8	L730 I746 C748 L802 S821 L823 I836 E837 C838	L730-W761 HydrophobicContact CD2-CE3 4.34Å; L730-W761 HydrophobicContact CD2-CH2 3.53Å; L730-W761 HydrophobicContact CD2-CZ3 3.37Å; I746-W761 HydrophobicContact CB-CH2 4.09Å; I746-W761 HydrophobicContact CB-CZ3 4.13Å; I746-W761 HydrophobicContact CG2-CH2 3.86Å; I746-W761 HydrophobicContact CG2-CZ3 3.78Å; I746-W761 WeakPolarHBondContact O-CH2 3.31Å; C748-W761 HydrophobicContact CB-CH2 3.69Å; C748-W761 HydrophobicContact CB-CZ2 3.42Å; C748-W761 VanDerWaalsContact CB-CZ2 3.42Å; W761-L802 HydrophobicContact CB-CB 4.16Å; W761-L802 PolarHBondContact O-N 2.87Å; W761-L802 VanDerWaalsContact O-N 3.09Å; W761-S821 PolarHBondContact NE1-OG 2.88Å; W761-L823 HydrophobicContact CD2-CB 3.87Å; W761-L823 HydrophobicContact CD2-CD2 3.94Å; W761-L823 HydrophobicContact CD2-CG 4.46Å; W761-L823 HydrophobicContact CE3-CB 3.9Å; W761-L823 HydrophobicContact CE3-CD2 3.43Å; W761-L823 VanDerWaalsContact CE3-CD2 3.43Å; W761-L823 HydrophobicContact CE3-CG 4.29Å; W761-L823 HydrophobicContact CG-CD2 4.46Å; W761-L823 HydrophobicContact CH2-CB 3.82Å; W761-L823 HydrophobicContact CZ2-CB 3.8Å; W761-L823 HydrophobicContact CZ3-CB 3.86Å; W761-L823 HydrophobicContact CZ3-CD2 3.8Å; W761-L823 HydrophobicContact CZ3-CG 4.49Å; W761-I836 HydrophobicContact CE3-CG2 4.04Å; W761-I836 HydrophobicContact CZ3-CG2 4.1Å; W761-E837 CarbonylContact C-O 3.6Å; W761-E837 WeakPolarHBondContact CA-O 2.23Å; W761-C838 HydrophobicContact CD2-CB 4.22Å; W761-C838 HydrophobicContact CE3-CB 3.96Å; W761-C838 HydrophobicContact CH2-CB 4.48Å; W761-C838 HydrophobicContact CZ3-CB 4.12Å
762	R	89.8	Confident	83.1	Confident	51 Å²	51	33.5 Å²	33.5	19%	0.192	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	157.3	-178.4	-74.5	179.3	-177.2	134.6	6.4	114.5	Y764 L799 L800 E801 I836 E837 Q839	R762-Y764 HydrophobicContact CB-CE2 4.38Å; R762-L799 HydrophobicContact CB-CD1 3.77Å; R762-L799 HydrophobicContact CG-CD1 3.85Å; R762-L800 CarbonylContact C-O 3.53Å; R762-E801 HydrophobicContact CG-CG 4.35Å; R762-E801 IonicContact NE-OE1 2.84Å; R762-I836 CarbonylContact O-C 3.58Å; R762-I836 WeakPolarHBondContact O-CA 3.04Å; R762-E837 HydrophobicContact CB-CB 4.14Å; R762-E837 WeakPolarHBondContact CD-OE2 3.42Å; R762-E837 IonicContact CZ-OE2 2.95Å; R762-E837 PolarHBondContact N-O 3.43Å; R762-E837 IonicContact NH1-OE2 3.36Å; R762-E837 PolarHBondContact NH1-OE2 2.91Å; R762-E837 PolarHBondContact O-N 2.84Å; R762-Q839 VanDerWaalsContact NH2-OE1 3.13Å
763	H	90.3	Very high	82	Confident	7 Å²	7	37.4 Å²	37.4	3%	0.032	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	127	173.1	170.6	-153.1	0	0	0	111.2	Q765 L799 L800 L802 Y831 D834 F835 I836	H763-Q765 PolarHBondContact CE1-NE2 3.17Å; H763-Q765 VanDerWaalsContact CE1-NE2 3.31Å; H763-L799 CarbonylContact O-C 3.57Å; H763-L799 WeakPolarHBondContact O-CA 3.35Å; H763-L800 HydrophobicContact CB-CB 4.42Å; H763-L800 PolarHBondContact N-O 2.73Å; H763-L800 PolarHBondContact O-N 3.34Å; H763-L802 HydrophobicContact CB-CD1 3.83Å; H763-L802 HydrophobicContact CB-CG 4.33Å; H763-Y831 AromaticContact CE1-CD1 3.99Å; H763-Y831 AromaticContact CE1-CD2 3.69Å; H763-Y831 AromaticContact CE1-CE1 3.83Å; H763-Y831 AromaticContact CE1-CE2 3.53Å; H763-Y831 AromaticContact CE1-CG 3.93Å; H763-Y831 AromaticContact CE1-CZ 3.6Å; H763-D834 IonicContact CE1-OD2 3.71Å; H763-D834 WeakPolarHBondContact NE2-CB 3.47Å; H763-D834 IonicContact NE2-OD1 3.73Å; H763-D834 IonicContact NE2-OD2 2.73Å; H763-D834 PolarHBondContact NE2-OD2 3.33Å; H763-F835 WeakPolarHBondContact CA-O 3.03Å; H763-F835 PolarHBondContact CD2-O 2.84Å; H763-I836 HydrophobicContact CB-CD1 3.64Å
764	Y	87	Confident	80.9	Confident	45 Å²	45	40.8 Å²	40.8	18%	0.176	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	113	176.8	-65.9	-90.6	0	0	0	111.1	R762 C766 C797 L799 D834 F835 E837	R762-Y764 HydrophobicContact CB-CE2 4.38Å; Y764-C766 PolarHBondContact O-N 2.91Å; Y764-C797 HydrophobicContact CD1-CB 4.28Å; Y764-L799 HydrophobicContact CD1-CB 4.42Å; Y764-L799 HydrophobicContact CD1-CD1 4.14Å; Y764-L799 HydrophobicContact CD2-CD1 4.45Å; Y764-L799 HydrophobicContact CE1-CB 4.38Å; Y764-L799 HydrophobicContact CE1-CD1 3.88Å; Y764-L799 HydrophobicContact CE1-CG 4.49Å; Y764-L799 HydrophobicContact CE2-CD1 4.2Å; Y764-L799 HydrophobicContact CG-CD1 4.42Å; Y764-D834 WeakPolarHBondContact O-CB 3.44Å; Y764-F835 PolarHBondContact N-O 2.95Å; Y764-F835 PolarHBondContact O-N 2.81Å; Y764-F835 VanDerWaalsContact O-N 3.16Å; Y764-E837 HydrophobicContact CD2-CB 4.45Å; Y764-E837 HydrophobicContact CE2-CB 3.91Å; Y764-E837 PolarHBondContact OH-OE2 2.94Å
765	Q	87.6	Confident	79.6	Confident	22 Å²	22	44.5 Å²	44.5	10%	0.103	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	96.4	174.1	-65.4	-178.5	-21.8	0	0	109.7	H763 H770 R774 C797 K798 D834	H763-Q765 PolarHBondContact CE1-NE2 3.17Å; H763-Q765 VanDerWaalsContact CE1-NE2 3.31Å; Q765-H770 HydrophobicContact CB-CB 4.47Å; Q765-R774 PolarHBondContact O-NH2 3.36Å; Q765-C797 WeakPolarHBondContact O-CB 3.44Å; Q765-K798 HydrophobicContact CB-CB 4.21Å; Q765-K798 WeakPolarHBondContact CB-O 3.41Å; Q765-K798 PolarHBondContact N-O 2.7Å; Q765-K798 PolarHBondContact O-N 2.7Å; Q765-D834 WeakPolarHBondContact CA-OD1 3.41Å
766	C	78	Confident	78	Confident	36 Å²	36	44.3 Å²	44.3	24%	0.243	22%	0.221	C	C	.	.			trans	-125.2	-22	-171.9	-63.8	0	0	0	0	113.9	Y764 C797 D834 F835	Y764-C766 PolarHBondContact O-N 2.91Å; C766-C797 VanDerWaalsContact CA-SG 3.53Å; C766-C797 HydrophobicContact CB-CB 4.16Å; C766-C797 WeakPolarHBondContact CB-SG 3.41Å; C766-C797 WeakPolarHBondContact SG-CB 3.34Å; C766-C797 CovalentContact SG-SG 2.03Å; C766-C797 PolarHBondContact SG-SG 3.07Å; C766-D834 PolarHBondContact N-OD1 3.24Å; C766-F835 HydrophobicContact CB-CD2 4.09Å; C766-F835 HydrophobicContact CB-CE2 4.23Å
767	G	74.8	Confident	76.3	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.01	23%	0.228	C	C	.	.	S	Bend	trans	-61.3	158.8	-167.4	0	0	0	0	0	114.2	A769 H770 A771 H832 D834	G767-A769 PolarHBondContact O-N 2.82Å; G767-A769 VanDerWaalsContact O-N 3.09Å; G767-H770 WeakPolarHBondContact O-CA 3.15Å; G767-H770 WeakPolarHBondContact O-CB 3.36Å; G767-H770 PolarHBondContact O-N 3.05Å; G767-A771 PolarHBondContact O-N 3.05Å; G767-H832 WeakPolarHBondContact CA-O 3.32Å; G767-D834 PolarHBondContact N-OD1 3.14Å
768	P	75.8	Confident	74.2	Confident	61 Å²	61	50.3 Å²	50.3	40%	0.396	25%	0.249	S	C	.	.	H	α-helix	trans	-50.1	-38.9	-176.9	-31.9	37.6	0	0	0	114.5	A771 F772 Y888	P768-A771 PolarHBondContact O-N 3.04Å; P768-F772 WeakPolarHBondContact O-CB 3.4Å; P768-F772 PolarHBondContact O-N 2.96Å; P768-Y888 HydrophobicContact CB-CE2 3.81Å; P768-Y888 HydrophobicContact CG-CE2 3.88Å
769	A	72.8	Confident	72.2	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.8	-47.4	173.3	0	0	0	0	0	112.8	G767 F772 Y773 W829 R830 Y865	G767-A769 PolarHBondContact O-N 2.82Å; G767-A769 VanDerWaalsContact O-N 3.09Å; A769-F772 PolarHBondContact O-N 3.08Å; A769-Y773 WeakPolarHBondContact O-CD2 3.39Å; A769-Y773 PolarHBondContact O-N 2.73Å; A769-W829 HydrophobicContact CB-CE3 4.26Å; A769-W829 HydrophobicContact CB-CZ3 3.9Å; A769-R830 HydrophobicContact CB-CB 4.38Å; A769-R830 HydrophobicContact CB-CG 4.44Å; A769-Y865 HydrophobicContact CB-CE1 3.97Å
770	H	75.8	Confident	70	Confident	25 Å²	25	55.2 Å²	55.2	12%	0.116	27%	0.265	C	S	.	.	H	α-helix	trans	-66.6	-35.6	176.7	-74.5	135.8	0	0	0	112.6	Q765 G767 R774 R830 Y831 D834	Q765-H770 HydrophobicContact CB-CB 4.47Å; G767-H770 WeakPolarHBondContact O-CA 3.15Å; G767-H770 WeakPolarHBondContact O-CB 3.36Å; G767-H770 PolarHBondContact O-N 3.05Å; H770-R774 WeakPolarHBondContact O-CB 3.27Å; H770-R774 PolarHBondContact O-N 3.33Å; H770-R830 PolarHBondContact CE1-O 3.25Å; H770-R830 PolarHBondContact ND1-O 2.92Å; H770-Y831 AromaticContact CE1-CD1 3.58Å; H770-D834 IonicContact CE1-OD1 2.77Å; H770-D834 IonicContact CE1-OD2 3.38Å; H770-D834 PolarHBondContact CE1-OD2 3.03Å; H770-D834 IonicContact CG-OD1 2.73Å; H770-D834 IonicContact ND1-OD1 2.75Å; H770-D834 PolarHBondContact ND1-OD1 2.83Å; H770-D834 IonicContact ND1-OD2 2.64Å; H770-D834 PolarHBondContact ND1-OD2 2.88Å; H770-D834 VanDerWaalsContact ND1-OD2 3.1Å
771	A	67.7	Low	67.8	Low	31 Å²	31	57.2 Å²	57.2	26%	0.256	27%	0.27	S	S	.	.	H	α-helix	trans	-65.7	-46.7	174.3	0	0	0	0	0	111.6	G767 P768 R774 R775	G767-A771 PolarHBondContact O-N 3.05Å; P768-A771 PolarHBondContact O-N 3.04Å; A771-R774 PolarHBondContact O-N 2.99Å; A771-R775 WeakPolarHBondContact O-CG 3.49Å; A771-R775 PolarHBondContact O-N 2.8Å
772	F	65	Low	65.6	Low	76 Å²	76	65.8 Å²	65.8	33%	0.333	31%	0.307	S	S	.	.	H	α-helix	trans	-58.7	-56.9	176.2	179.2	-94.1	0	0	0	111.8	P768 A769 R774 R775 H776 Y865	P768-F772 WeakPolarHBondContact O-CB 3.4Å; P768-F772 PolarHBondContact O-N 2.96Å; A769-F772 PolarHBondContact O-N 3.08Å; F772-R774 VanDerWaalsContact C-N 3.26Å; F772-R774 PolarHBondContact O-N 2.05Å; F772-R775 PolarHBondContact O-N 2.96Å; F772-H776 PolarHBondContact O-N 2.97Å; F772-Y865 WeakPolarHBondContact CE2-O 3.24Å; F772-Y865 WeakPolarHBondContact CZ-O 3.18Å
773	Y	64.9	Low	63.1	Low	87 Å²	87	71.2 Å²	71.2	34%	0.341	33%	0.332	S	S	.	.	H	α-helix	trans	-61.8	-32.8	-179.2	-77.5	-61	0	0	0	112.8	A769 H776 L777 W829 R830	A769-Y773 WeakPolarHBondContact O-CD2 3.39Å; A769-Y773 PolarHBondContact O-N 2.73Å; Y773-H776 PolarHBondContact O-N 3.49Å; Y773-L777 VanDerWaalsContact O-CB 3.29Å; Y773-L777 WeakPolarHBondContact O-CB 3.33Å; Y773-L777 WeakPolarHBondContact O-CG 3.46Å; Y773-L777 PolarHBondContact O-N 3.09Å; Y773-W829 AromaticContact CE2-CH2 3.91Å; Y773-W829 HydrophobicContact CE2-CH2 3.91Å; Y773-W829 HydrophobicContact CE2-CZ3 4.22Å; Y773-R830 PolarHBondContact OH-NH2 3.14Å
774	R	65.1	Low	60.5	Low	72 Å²	72	77.6 Å²	77.6	27%	0.272	37%	0.366	S	S	.	.	H	α-helix	trans	-70.2	-41.8	176.4	-163.9	179.8	-52	155.9	14.6	111.9	Q765 H770 A771 F772 H776 L777 L778 K796	Q765-R774 PolarHBondContact O-NH2 3.36Å; H770-R774 WeakPolarHBondContact O-CB 3.27Å; H770-R774 PolarHBondContact O-N 3.33Å; A771-R774 PolarHBondContact O-N 2.99Å; F772-R774 VanDerWaalsContact C-N 3.26Å; F772-R774 PolarHBondContact O-N 2.05Å; R774-H776 VanDerWaalsContact C-N 3.27Å; R774-H776 PolarHBondContact O-N 2.97Å; R774-L777 PolarHBondContact O-N 2.94Å; R774-L778 HydrophobicContact CG-CD1 4.11Å; R774-L778 VanDerWaalsContact O-CB 3.31Å; R774-L778 WeakPolarHBondContact O-CB 3.25Å; R774-L778 WeakPolarHBondContact O-CG 3.28Å; R774-L778 PolarHBondContact O-N 2.91Å; R774-K796 PolarHBondContact NH1-O 2.76Å
775	R	61.5	Low	57.7	Low	129 Å²	129	80.6 Å²	80.6	49%	0.487	39%	0.391	S	S	.	.	H	α-helix	trans	-63	-35	173.4	-71.3	174.7	-177.4	163.4	0.9	111.7	A771 F772 Q779 E795	A771-R775 WeakPolarHBondContact O-CG 3.49Å; A771-R775 PolarHBondContact O-N 2.8Å; F772-R775 PolarHBondContact O-N 2.96Å; R775-Q779 WeakPolarHBondContact O-CG 3.31Å; R775-Q779 PolarHBondContact O-N 3.22Å; R775-Q779 PolarHBondContact O-NE2 3.34Å; R775-E795 IonicContact CZ-OE1 3.69Å; R775-E795 IonicContact CZ-OE2 3.7Å; R775-E795 IonicContact NE-OE1 3.35Å; R775-E795 PolarHBondContact NE-OE1 2.92Å; R775-E795 IonicContact NE-OE2 3.51Å; R775-E795 IonicContact NH2-OE1 2.71Å; R775-E795 PolarHBondContact NH2-OE1 2.78Å; R775-E795 IonicContact NH2-OE2 2.71Å; R775-E795 PolarHBondContact NH2-OE2 2.77Å
776	H	53.4	Low	55	Low	51 Å²	51	89 Å²	89	24%	0.236	43%	0.427	C	S	.	.	H	α-helix	trans	-73.2	-46	176.6	-139.7	60.7	0	0	0	112.8	F772 Y773 R774 L778 Q779 Q780 Q868	F772-H776 PolarHBondContact O-N 2.97Å; Y773-H776 PolarHBondContact O-N 3.49Å; R774-H776 VanDerWaalsContact C-N 3.27Å; R774-H776 PolarHBondContact O-N 2.97Å; H776-L778 VanDerWaalsContact C-N 3.3Å; H776-L778 PolarHBondContact O-N 2.82Å; H776-Q779 WeakPolarHBondContact O-CB 3.39Å; H776-Q779 PolarHBondContact O-N 2.83Å; H776-Q779 VanDerWaalsContact O-N 3.09Å; H776-Q780 PolarHBondContact O-N 3.01Å; H776-Q868 PolarHBondContact CE1-OE1 3.49Å; H776-Q868 PolarHBondContact NE2-OE1 2.73Å
777	L	49.7	Very low	52.7	Low	81 Å²	81	92 Å²	92	42%	0.424	45%	0.448	S	S	.	.	H	α-helix	trans	-62	-35.4	174.2	-79.2	164.6	0	0	0	112.4	Y773 R774 Q779 Q780 Q781	Y773-L777 VanDerWaalsContact O-CB 3.29Å; Y773-L777 WeakPolarHBondContact O-CB 3.33Å; Y773-L777 WeakPolarHBondContact O-CG 3.46Å; Y773-L777 PolarHBondContact O-N 3.09Å; R774-L777 PolarHBondContact O-N 2.94Å; L777-Q779 VanDerWaalsContact C-N 3.35Å; L777-Q780 PolarHBondContact O-N 2.77Å; L777-Q781 VanDerWaalsContact O-CB 3.24Å; L777-Q781 WeakPolarHBondContact O-CB 3.35Å; L777-Q781 VanDerWaalsContact O-CG 3.25Å; L777-Q781 WeakPolarHBondContact O-CG 3.21Å; L777-Q781 PolarHBondContact O-N 3.33Å
778	L	44.2	Very low	50.6	Low	97 Å²	97	96.9 Å²	96.9	51%	0.508	48%	0.482	S	S	.	.	H	α-helix	trans	-70.2	-29.6	174	-73.6	169	0	0	0	112.8	R774 H776 K782	R774-L778 HydrophobicContact CG-CD1 4.11Å; R774-L778 VanDerWaalsContact O-CB 3.31Å; R774-L778 WeakPolarHBondContact O-CB 3.25Å; R774-L778 WeakPolarHBondContact O-CG 3.28Å; R774-L778 PolarHBondContact O-N 2.91Å; H776-L778 VanDerWaalsContact C-N 3.3Å; H776-L778 PolarHBondContact O-N 2.82Å; L778-K782 WeakPolarHBondContact O-CB 3.2Å; L778-K782 WeakPolarHBondContact O-CG 3.22Å; L778-K782 PolarHBondContact O-N 2.94Å
779	Q	44.9	Very low	48.3	Very low	95 Å²	95	99.3 Å²	99.3	44%	0.444	50%	0.501	S	S	.	.	H	α-helix	trans	-71	-38.3	170.5	-77.7	165.8	98.9	0	0	111.3	R775 H776 L777	R775-Q779 WeakPolarHBondContact O-CG 3.31Å; R775-Q779 PolarHBondContact O-N 3.22Å; R775-Q779 PolarHBondContact O-NE2 3.34Å; H776-Q779 WeakPolarHBondContact O-CB 3.39Å; H776-Q779 PolarHBondContact O-N 2.83Å; H776-Q779 VanDerWaalsContact O-N 3.09Å; L777-Q779 VanDerWaalsContact C-N 3.35Å
780	Q	42.5	Very low	46.1	Very low	115 Å²	115	104 Å²	104	54%	0.537	53%	0.533	S	S	.	.	H	α-helix	trans	-73.6	-40.4	176.7	-69.2	175.4	-18.4	0	0	113.2	H776 L777 K782	H776-Q780 PolarHBondContact O-N 3.01Å; L777-Q780 PolarHBondContact O-N 2.77Å; Q780-K782 PolarHBondContact O-N 2.64Å
781	Q	43.1	Very low	43.8	Very low	113 Å²	113	108.3 Å²	108.3	53%	0.528	56%	0.562	S	S	.	*	H	α-helix	trans	-78.9	-13.9	-177.1	-70	178	6	0	0	113.9	L777 K783 L784	L777-Q781 VanDerWaalsContact O-CB 3.24Å; L777-Q781 WeakPolarHBondContact O-CB 3.35Å; L777-Q781 VanDerWaalsContact O-CG 3.25Å; L777-Q781 WeakPolarHBondContact O-CG 3.21Å; L777-Q781 PolarHBondContact O-N 3.33Å; Q781-K783 PolarHBondContact O-N 2.87Å; Q781-L784 PolarHBondContact O-N 2.88Å; Q781-L784 VanDerWaalsContact O-N 3.13Å
782	K	43	Very low	41.8	Very low	187 Å²	187	114 Å²	114	81%	0.813	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-6.4	173.6	-98.8	-173.6	172.8	-169.6	0	114.7	L778 Q780 L784	L778-K782 WeakPolarHBondContact O-CB 3.2Å; L778-K782 WeakPolarHBondContact O-CG 3.22Å; L778-K782 PolarHBondContact O-N 2.94Å; Q780-K782 PolarHBondContact O-N 2.64Å; K782-L784 VanDerWaalsContact C-N 3.33Å
783	K	38.9	Very low	40.2	Very low	164 Å²	164	117.2 Å²	117.2	71%	0.713	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	5.7	170	-76.2	-172.2	173.7	-177.5	0	114.7	Q781	Q781-K783 PolarHBondContact O-N 2.87Å
784	L	34.1	Very low	38.5	Very low	141 Å²	141	116.5 Å²	116.5	74%	0.738	62%	0.623	S	S	*	*			trans	-111	120	178.8	-86.1	158.9	0	0	0	112.9	Q781 K782	Q781-L784 PolarHBondContact O-N 2.88Å; Q781-L784 VanDerWaalsContact O-N 3.13Å; K782-L784 VanDerWaalsContact C-N 3.33Å
785	P	28.6	Very low	37.6	Very low	109 Å²	109	119.2 Å²	119.2	71%	0.708	64%	0.639	S	S	*	*			trans	-85.7	124	177.2	32	-32.6	0	0	0	112.4
786	K	32.2	Very low	37.1	Very low	198 Å²	198	119.1 Å²	119.1	86%	0.861	64%	0.642	S	S	*	*			trans	-164.9	112.2	159.1	-107.9	135.7	-167.8	170.5	0	115.3
787	S	29	Very low	37.6	Very low	99 Å²	99	119 Å²	119	69%	0.692	65%	0.646	S	S	*	*			trans	42	117.8	137.1	59.7	0	0	0	0	122
788	S	29.6	Very low	39	Very low	103 Å²	103	120.8 Å²	120.8	72%	0.72	65%	0.65	S	S	*	*			trans	62.3	121.4	137.6	60.2	0	0	0	0	121.8
789	S	27.8	Very low	40.8	Very low	112 Å²	112	119.7 Å²	119.7	78%	0.783	65%	0.645	S	S	*	*			trans	60.5	139.1	153.9	51.4	0	0	0	0	119.3
790	S	27.5	Very low	42.6	Very low	98 Å²	98	119 Å²	119	69%	0.685	64%	0.643	S	S	*	*			cis	-167.1	146.9	-9.9	45	0	0	0	0	111.2
791	T	27.1	Very low	44.6	Very low	116 Å²	116	119.9 Å²	119.9	71%	0.712	65%	0.648	S	S	*	*			trans	51.3	121.8	151.3	54.7	0	0	0	0	121.3
792	N	26.1	Very low	46.6	Very low	151 Å²	151	116.3 Å²	116.3	81%	0.807	63%	0.632	S	S	*	*			trans	78.9	166.7	143.4	-58.8	-8.5	0	0	0	120.1
793	E	30.2	Very low	48.4	Very low	144 Å²	144	117 Å²	117	67%	0.673	64%	0.635	S	S	*	*			trans	75.7	118.1	174.3	-50.6	-172.1	101	0	0	117.2	K796	E793-K796 HydrophobicContact CB-CD 4.42Å; E793-K796 VanDerWaalsContact CD-CE 3.47Å; E793-K796 VanDerWaalsContact OE1-CE 3.22Å; E793-K796 WeakPolarHBondContact OE1-CE 3.37Å; E793-K796 IonicContact OE1-NZ 3.83Å; E793-K796 PolarHBondContact OE1-NZ 3.01Å; E793-K796 WeakPolarHBondContact OE2-CE 3.02Å; E793-K796 IonicContact OE2-NZ 3.17Å; E793-K796 PolarHBondContact OE2-NZ 2.79Å
794	G	30.4	Very low	50.5	Low	72 Å²	72	110.8 Å²	110.8	74%	0.742	62%	0.617	S	S	*	*			trans	-77.2	144.1	-175.5	0	0	0	0	0	114.6	K796	G794-K796 PolarHBondContact O-N 2.97Å
795	E	45.3	Very low	53	Low	129 Å²	129	107.2 Å²	107.2	60%	0.603	60%	0.604	S	S	*	*			trans	17.2	48.2	172.8	-67.2	-167	128.5	0	0	118.3	R775 C797	R775-E795 IonicContact CZ-OE1 3.69Å; R775-E795 IonicContact CZ-OE2 3.7Å; R775-E795 IonicContact NE-OE1 3.35Å; R775-E795 PolarHBondContact NE-OE1 2.92Å; R775-E795 IonicContact NE-OE2 3.51Å; R775-E795 IonicContact NH2-OE1 2.71Å; R775-E795 PolarHBondContact NH2-OE1 2.78Å; R775-E795 IonicContact NH2-OE2 2.71Å; R775-E795 PolarHBondContact NH2-OE2 2.77Å; E795-C797 PolarHBondContact O-N 2.83Å
796	K	51	Low	55.6	Low	127 Å²	127	107.3 Å²	107.3	55%	0.552	60%	0.599	S	S	*	*			trans	-56.9	134.4	178.2	-78.8	-173.7	169.2	178.4	0	111.4	R774 E793 G794	R774-K796 PolarHBondContact NH1-O 2.76Å; E793-K796 HydrophobicContact CB-CD 4.42Å; E793-K796 VanDerWaalsContact CD-CE 3.47Å; E793-K796 VanDerWaalsContact OE1-CE 3.22Å; E793-K796 WeakPolarHBondContact OE1-CE 3.37Å; E793-K796 IonicContact OE1-NZ 3.83Å; E793-K796 PolarHBondContact OE1-NZ 3.01Å; E793-K796 WeakPolarHBondContact OE2-CE 3.02Å; E793-K796 IonicContact OE2-NZ 3.17Å; E793-K796 PolarHBondContact OE2-NZ 2.79Å; G794-K796 PolarHBondContact O-N 2.97Å
797	C	65.3	Low	58.2	Low	47 Å²	47	102 Å²	102	32%	0.318	58%	0.577	S	S	.	*			trans	-58.7	145.7	174.4	-59.3	0	0	0	0	111.2	Y764 Q765 C766 E795 L799	Y764-C797 HydrophobicContact CD1-CB 4.28Å; Q765-C797 WeakPolarHBondContact O-CB 3.44Å; C766-C797 VanDerWaalsContact CA-SG 3.53Å; C766-C797 HydrophobicContact CB-CB 4.16Å; C766-C797 WeakPolarHBondContact CB-SG 3.41Å; C766-C797 WeakPolarHBondContact SG-CB 3.34Å; C766-C797 CovalentContact SG-SG 2.03Å; C766-C797 PolarHBondContact SG-SG 3.07Å; E795-C797 PolarHBondContact O-N 2.83Å; C797-L799 PolarHBondContact O-N 3.36Å
798	K	79.4	Confident	61	Low	119 Å²	119	102.9 Å²	102.9	52%	0.517	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.6	115.4	175.6	172.3	-179.7	164.5	-156.8	0	108.3	Q765	Q765-K798 HydrophobicContact CB-CB 4.21Å; Q765-K798 WeakPolarHBondContact CB-O 3.41Å; Q765-K798 PolarHBondContact N-O 2.7Å; Q765-K798 PolarHBondContact O-N 2.7Å
799	L	81.1	Confident	63.5	Low	74 Å²	74	101.6 Å²	101.6	39%	0.387	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.5	142.8	176.3	176.1	59.9	0	0	0	110.8	R762 H763 Y764 C797	R762-L799 HydrophobicContact CB-CD1 3.77Å; R762-L799 HydrophobicContact CG-CD1 3.85Å; H763-L799 CarbonylContact O-C 3.57Å; H763-L799 WeakPolarHBondContact O-CA 3.35Å; Y764-L799 HydrophobicContact CD1-CB 4.42Å; Y764-L799 HydrophobicContact CD1-CD1 4.14Å; Y764-L799 HydrophobicContact CD2-CD1 4.45Å; Y764-L799 HydrophobicContact CE1-CB 4.38Å; Y764-L799 HydrophobicContact CE1-CD1 3.88Å; Y764-L799 HydrophobicContact CE1-CG 4.49Å; Y764-L799 HydrophobicContact CE2-CD1 4.2Å; Y764-L799 HydrophobicContact CG-CD1 4.42Å; C797-L799 PolarHBondContact O-N 3.36Å
800	L	83.3	Confident	66.4	Low	80 Å²	80	98.7 Å²	98.7	42%	0.419	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	126.1	169.8	-174.9	72.8	0	0	0	108	R762 H763 L802	R762-L800 CarbonylContact C-O 3.53Å; H763-L800 HydrophobicContact CB-CB 4.42Å; H763-L800 PolarHBondContact N-O 2.73Å; H763-L800 PolarHBondContact O-N 3.34Å; L800-L802 HydrophobicContact CD2-CD2 4.12Å; L800-L802 HydrophobicContact CG-CD2 4.42Å
801	E	83	Confident	69.1	Low	134 Å²	134	99.1 Å²	99.1	63%	0.626	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	143.5	174.8	-58	-158.8	133.1	0	0	110.6	R762	R762-E801 HydrophobicContact CG-CG 4.35Å; R762-E801 IonicContact NE-OE1 2.84Å
802	L	86	Confident	71.6	Confident	39 Å²	39	94.7 Å²	94.7	20%	0.204	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	153.9	-175.2	-63.7	178.6	0	0	0	110.4	W761 H763 L800 L823 L825 I836	W761-L802 HydrophobicContact CB-CB 4.16Å; W761-L802 PolarHBondContact O-N 2.87Å; W761-L802 VanDerWaalsContact O-N 3.09Å; H763-L802 HydrophobicContact CB-CD1 3.83Å; H763-L802 HydrophobicContact CB-CG 4.33Å; L800-L802 HydrophobicContact CD2-CD2 4.12Å; L800-L802 HydrophobicContact CG-CD2 4.42Å; L802-L823 HydrophobicContact CB-CD1 4.1Å; L802-L823 HydrophobicContact CD1-CD1 4.24Å; L802-L823 HydrophobicContact CD1-CD2 3.8Å; L802-L825 HydrophobicContact CD1-CD2 4.13Å; L802-I836 HydrophobicContact CD1-CD1 4.46Å
803	K	80	Confident	74.1	Confident	202 Å²	202	90.4 Å²	90.4	88%	0.878	51%	0.509	S	S	*	.			trans	-104.1	126.6	174.3	-67.1	-169.2	176.1	-171.1	0	110
804	G	82.7	Confident	76.4	Confident	33 Å²	33	85.3 Å²	85.3	34%	0.34	49%	0.489	S	S	.	.			trans	-99.5	-167.9	168.8	0	0	0	0	0	112.4	H822	G804-H822 CarbonylContact C-O 3.47Å; G804-H822 WeakPolarHBondContact CA-O 3.49Å
805	S	86.9	Confident	78.6	Confident	66 Å²	66	85 Å²	85	46%	0.462	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	123.6	174.6	56	0	0	0	0	110.7	S821 H822	S805-S821 CarbonylContact O-C 3.5Å; S805-S821 VanDerWaalsContact O-CA 3.32Å; S805-S821 WeakPolarHBondContact O-CA 3.32Å; S805-H822 PolarHBondContact N-O 3Å; S805-H822 PolarHBondContact O-N 2.96Å
806	D	84.8	Confident	80.4	Confident	110 Å²	110	79 Å²	79	59%	0.588	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	150.4	-167.7	-50.1	-40.8	0	0	0	113.7	R820 S821	D806-R820 WeakPolarHBondContact CA-O 3.39Å; D806-S821 WeakPolarHBondContact OD1-CB 3.27Å; D806-S821 PolarHBondContact OD1-OG 2.81Å
807	E	86.8	Confident	82.2	Confident	86 Å²	86	76.3 Å²	76.3	40%	0.402	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-101.9	163.8	176	-52.6	-165.6	146.8	0	0	113.9	R820 H822	E807-R820 HydrophobicContact CB-CB 4.04Å; E807-R820 HydrophobicContact CG-CB 3.94Å; E807-R820 PolarHBondContact N-O 3.13Å; E807-R820 WeakPolarHBondContact OE2-CD 3.39Å; E807-R820 IonicContact OE2-CZ 2.77Å; E807-R820 IonicContact OE2-NE 3.21Å; E807-R820 IonicContact OE2-NH1 3.43Å; E807-R820 PolarHBondContact OE2-NH1 2.84Å; E807-H822 IonicContact OE1-NE2 2.61Å; E807-H822 PolarHBondContact OE1-NE2 2.87Å
808	T	86.1	Confident	83.3	Confident	119 Å²	119	75.4 Å²	75.4	73%	0.73	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-67.3	141.9	171.6	50.6	0	0	0	0	113.1
809	P	83.6	Confident	83.8	Confident	76 Å²	76	70.2 Å²	70.2	49%	0.494	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-59	148.6	178.3	-28.9	37.2	0	0	0	115.9	V756 L818	V756-P809 HydrophobicContact CG2-CB 4.04Å; V756-P809 HydrophobicContact CG2-CG 4Å; P809-L818 VanDerWaalsContact CA-O 3.24Å; P809-L818 WeakPolarHBondContact CA-O 3.25Å; P809-L818 WeakPolarHBondContact CB-O 3.39Å
810	V	87.3	Confident	84.3	Confident	51 Å²	51	70.9 Å²	70.9	31%	0.309	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	142.9	-175.8	-175.8	0	0	0	0	110.7	L817 L818	V810-L817 CarbonylContact O-C 3.5Å; V810-L817 WeakPolarHBondContact O-CA 3.19Å; V810-L818 HydrophobicContact CB-CB 4.4Å; V810-L818 HydrophobicContact CB-CD1 4.4Å; V810-L818 PolarHBondContact N-O 2.65Å; V810-L818 WeakPolarHBondContact O-CB 3.45Å; V810-L818 PolarHBondContact O-N 3.07Å
811	P	85.1	Confident	84.6	Confident	106 Å²	106	67 Å²	67	69%	0.688	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.1	137.9	174.6	-27.2	36.1	0	0	0	113.8	L818	P811-L818 WeakPolarHBondContact O-CD1 3.38Å
812	G	79.6	Confident	84.9	Confident	23 Å²	23	62.3 Å²	62.3	24%	0.237	38%	0.376	C	S	.	.			trans	-132.2	-179.7	-174.9	0	0	0	0	0	114.5	S752 G816	S752-G812 WeakPolarHBondContact OG-CA 3.36Å; G812-G816 PolarHBondContact N-O 2.9Å
813	A	79.4	Confident	85.1	Confident	62 Å²	62	60.8 Å²	60.8	51%	0.512	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-54.6	152.9	179.8	0	0	0	0	0	113.2	S752 G815 G816	S752-A813 WeakPolarHBondContact CB-O 3.15Å; S752-A813 PolarHBondContact OG-N 2.7Å; S752-A813 PolarHBondContact OG-O 2.92Å; A813-G815 PolarHBondContact O-N 2.57Å; A813-G815 VanDerWaalsContact O-N 3.1Å; A813-G816 PolarHBondContact O-N 2.87Å
814	S	76.9	Confident	85.4	Confident	37 Å²	37	57.8 Å²	57.8	26%	0.259	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	59.6	12.8	179.3	-66.5	0	0	0	0	116.4	K691 N694	K691-S814 VanDerWaalsContact C-OG 3.24Å; K691-S814 WeakPolarHBondContact CG-OG 3.3Å; K691-S814 WeakPolarHBondContact O-CB 3.35Å; K691-S814 PolarHBondContact O-OG 3.36Å; N694-S814 PolarHBondContact ND2-O 2.92Å
815	G	78.2	Confident	85.5	Confident	64 Å²	64	57.9 Å²	57.9	66%	0.66	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	85.5	21.4	-177.6	0	0	0	0	0	114.6	A813	A813-G815 PolarHBondContact O-N 2.57Å; A813-G815 VanDerWaalsContact O-N 3.1Å
816	G	83.1	Confident	85.5	Confident	5 Å²	5	62.4 Å²	62.4	5%	0.052	35%	0.351	C	S	.	.			trans	-99.2	-165.4	176.7	0	0	0	0	0	114.3	S752 S753 G812 A813	S752-G816 VanDerWaalsContact OG-C 3.3Å; S752-G816 VanDerWaalsContact OG-CA 3.27Å; S752-G816 WeakPolarHBondContact OG-CA 3.45Å; S753-G816 CarbonylContact O-C 3.23Å; S753-G816 VanDerWaalsContact O-CA 3.28Å; S753-G816 WeakPolarHBondContact O-CA 3.49Å; G812-G816 PolarHBondContact N-O 2.9Å; A813-G816 PolarHBondContact O-N 2.87Å
817	L	88.8	Confident	85.5	Confident	70 Å²	70	57.2 Å²	57.2	37%	0.366	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	144.6	-178.1	-63.6	173.6	0	0	0	112.1	S752 S753 V756 V810	S752-L817 CarbonylContact C-O 3.58Å; S752-L817 WeakPolarHBondContact CA-O 3.37Å; S753-L817 PolarHBondContact N-O 3.38Å; S753-L817 PolarHBondContact O-N 3.33Å; S753-L817 PolarHBondContact OG-O 3.18Å; S753-L817 VanDerWaalsContact OG-O 3.14Å; V756-L817 HydrophobicContact CB-CB 3.97Å; V756-L817 HydrophobicContact CB-CD1 4.22Å; V756-L817 HydrophobicContact CG2-CB 3.99Å; V810-L817 CarbonylContact O-C 3.5Å; V810-L817 WeakPolarHBondContact O-CA 3.19Å
818	L	88.2	Confident	85.7	Confident	28 Å²	28	55.7 Å²	55.7	15%	0.147	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	159.1	179.1	-63.5	158.8	0	0	0	111.5	A750 P809 V810 P811	A750-L818 WeakPolarHBondContact O-CD2 3.12Å; P809-L818 VanDerWaalsContact CA-O 3.24Å; P809-L818 WeakPolarHBondContact CA-O 3.25Å; P809-L818 WeakPolarHBondContact CB-O 3.39Å; V810-L818 HydrophobicContact CB-CB 4.4Å; V810-L818 HydrophobicContact CB-CD1 4.4Å; V810-L818 PolarHBondContact N-O 2.65Å; V810-L818 WeakPolarHBondContact O-CB 3.45Å; V810-L818 PolarHBondContact O-N 3.07Å; P811-L818 WeakPolarHBondContact O-CD1 3.38Å
819	A	89.6	Confident	85.7	Confident	10 Å²	10	52.1 Å²	52.1	8%	0.083	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	155.5	173.5	0	0	0	0	0	112.3	Q749 A750 V756 A757 I759	Q749-A819 WeakPolarHBondContact CA-O 3.32Å; A750-A819 HydrophobicContact CB-CB 4.48Å; A750-A819 PolarHBondContact N-O 2.99Å; V756-A819 HydrophobicContact CG2-CB 4.32Å; A757-A819 WeakPolarHBondContact O-CB 3.39Å; I759-A819 HydrophobicContact CD1-CB 4.13Å
820	R	90.8	Very high	85.8	Confident	87 Å²	87	53.8 Å²	53.8	33%	0.328	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	157.6	-174.1	-72.3	168.2	179.5	164.6	2	114.7	C748 Q749 D806 E807	C748-R820 CarbonylContact O-C 3.57Å; C748-R820 VanDerWaalsContact O-CA 3.23Å; C748-R820 WeakPolarHBondContact O-CA 3.37Å; Q749-R820 HydrophobicContact CB-CG 3.9Å; Q749-R820 HydrophobicContact CG-CG 3.72Å; Q749-R820 VanDerWaalsContact OE1-NH2 3.14Å; D806-R820 WeakPolarHBondContact CA-O 3.39Å; E807-R820 HydrophobicContact CB-CB 4.04Å; E807-R820 HydrophobicContact CG-CB 3.94Å; E807-R820 PolarHBondContact N-O 3.13Å; E807-R820 WeakPolarHBondContact OE2-CD 3.39Å; E807-R820 IonicContact OE2-CZ 2.77Å; E807-R820 IonicContact OE2-NE 3.21Å; E807-R820 IonicContact OE2-NH1 3.43Å; E807-R820 PolarHBondContact OE2-NH1 2.84Å
821	S	89.9	Confident	85.9	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	157.7	176.9	-167.3	0	0	0	0	112.6	C748 W761 S805 D806	C748-S821 PolarHBondContact N-O 3.02Å; C748-S821 PolarHBondContact O-N 2.89Å; W761-S821 PolarHBondContact NE1-OG 2.88Å; S805-S821 CarbonylContact O-C 3.5Å; S805-S821 VanDerWaalsContact O-CA 3.32Å; S805-S821 WeakPolarHBondContact O-CA 3.32Å; D806-S821 WeakPolarHBondContact OD1-CB 3.27Å; D806-S821 PolarHBondContact OD1-OG 2.81Å
822	H	89.6	Confident	85.9	Confident	35 Å²	35	50.8 Å²	50.8	16%	0.162	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	151.3	-178.5	-59.1	-108.3	0	0	0	112.7	E745 I746 N747 G804 S805 E807	E745-H822 IonicContact OE1-ND1 2.74Å; I746-H822 CarbonylContact O-C 3.52Å; N747-H822 PolarHBondContact OD1-ND1 2.72Å; G804-H822 CarbonylContact C-O 3.47Å; G804-H822 WeakPolarHBondContact CA-O 3.49Å; S805-H822 PolarHBondContact N-O 3Å; S805-H822 PolarHBondContact O-N 2.96Å; E807-H822 IonicContact OE1-NE2 2.61Å; E807-H822 PolarHBondContact OE1-NE2 2.87Å
823	L	89	Confident	86.2	Confident	7 Å²	7	51.3 Å²	51.3	4%	0.037	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	141.4	-178	174.2	66.3	0	0	0	111.7	I746 W761 L802 L825 I836	I746-L823 PolarHBondContact N-O 2.93Å; I746-L823 PolarHBondContact O-N 2.81Å; W761-L823 HydrophobicContact CD2-CB 3.87Å; W761-L823 HydrophobicContact CD2-CD2 3.94Å; W761-L823 HydrophobicContact CD2-CG 4.46Å; W761-L823 HydrophobicContact CE3-CB 3.9Å; W761-L823 HydrophobicContact CE3-CD2 3.43Å; W761-L823 VanDerWaalsContact CE3-CD2 3.43Å; W761-L823 HydrophobicContact CE3-CG 4.29Å; W761-L823 HydrophobicContact CG-CD2 4.46Å; W761-L823 HydrophobicContact CH2-CB 3.82Å; W761-L823 HydrophobicContact CZ2-CB 3.8Å; W761-L823 HydrophobicContact CZ3-CB 3.86Å; W761-L823 HydrophobicContact CZ3-CD2 3.8Å; W761-L823 HydrophobicContact CZ3-CG 4.49Å; L802-L823 HydrophobicContact CB-CD1 4.1Å; L802-L823 HydrophobicContact CD1-CD1 4.24Å; L802-L823 HydrophobicContact CD1-CD2 3.8Å; L823-L825 HydrophobicContact CD2-CD1 4.26Å; L823-L825 HydrophobicContact CD2-CG 4.43Å; L823-L825 HydrophobicContact CG-CG 4.36Å; L823-I836 HydrophobicContact CD2-CG2 4.01Å
824	W	86.9	Confident	86.6	Confident	138 Å²	138	48.3 Å²	48.3	52%	0.523	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	132.3	179.2	-65	86.7	0	0	0	112	Q743 L744 E745	Q743-W824 HydrophobicContact CG-CE3 4.2Å; L744-W824 WeakPolarHBondContact O-CA 3.31Å; E745-W824 HydrophobicContact CB-CD2 4.33Å; E745-W824 HydrophobicContact CB-CE3 3.9Å; E745-W824 HydrophobicContact CB-CH2 3.88Å; E745-W824 HydrophobicContact CB-CZ2 4.29Å; E745-W824 HydrophobicContact CB-CZ3 3.67Å; E745-W824 VanDerWaalsContact CD-CZ2 3.46Å; E745-W824 HydrophobicContact CG-CD2 4.15Å; E745-W824 HydrophobicContact CG-CE3 4.19Å; E745-W824 HydrophobicContact CG-CH2 3.75Å; E745-W824 HydrophobicContact CG-CZ2 3.68Å; E745-W824 HydrophobicContact CG-CZ3 4.02Å; E745-W824 WeakPolarHBondContact OE2-CH2 3.37Å
825	L	84.9	Confident	87	Confident	36 Å²	36	49.7 Å²	49.7	19%	0.188	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	158.1	-179.2	-69.5	175.7	0	0	0	112.1	L744 I746 L802 L823 I836	L744-L825 PolarHBondContact N-O 2.89Å; L744-L825 PolarHBondContact O-N 2.84Å; I746-L825 HydrophobicContact CD1-CD1 3.96Å; L802-L825 HydrophobicContact CD1-CD2 4.13Å; L823-L825 HydrophobicContact CD2-CD1 4.26Å; L823-L825 HydrophobicContact CD2-CG 4.43Å; L823-L825 HydrophobicContact CG-CG 4.36Å; L825-I836 HydrophobicContact CD1-CD1 3.66Å; L825-I836 HydrophobicContact CD1-CG1 4.04Å
826	R	86.8	Confident	87.5	Confident	161 Å²	161	46.7 Å²	46.7	61%	0.608	20%	0.202	S	C	*	.			trans	-131.5	86.6	170	-173.4	175.8	-65.1	165.1	3.2	109.5	G741	G741-R826 VanDerWaalsContact O-CD 3.31Å; G741-R826 WeakPolarHBondContact O-CD 3.36Å; G741-R826 VanDerWaalsContact O-CG 3.24Å; G741-R826 WeakPolarHBondContact O-CG 3.43Å
827	P	85.9	Confident	87.8	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.006	20%	0.201	C	C	.	.			trans	-85.8	158	-166.9	37.6	-38.9	0	0	0	112.6	V738 G741 E742 Y831 I858	V738-P827 HydrophobicContact CG1-CG 4.4Å; G741-P827 PolarHBondContact N-O 3.08Å; E742-P827 WeakPolarHBondContact O-CD 3.44Å; P827-Y831 HydrophobicContact CB-CD2 3.63Å; P827-Y831 HydrophobicContact CB-CE2 4.44Å; P827-Y831 HydrophobicContact CB-CG 4.34Å; P827-I858 HydrophobicContact CB-CD1 3.63Å; P827-I858 HydrophobicContact CG-CD1 4Å; P827-I858 HydrophobicContact CG-CG1 4.38Å
828	T	89.3	Confident	87.8	Confident	53 Å²	53	43.2 Å²	43.2	33%	0.325	18%	0.183	S	C	.	.			trans	-115.1	169.7	-179.5	67.1	0	0	0	0	111	R830 Y831 I858	T828-R830 PolarHBondContact O-N 2.83Å; T828-Y831 WeakPolarHBondContact O-CB 3.27Å; T828-Y831 PolarHBondContact O-N 3.43Å; T828-I858 VanDerWaalsContact O-CD1 3.26Å; T828-I858 WeakPolarHBondContact O-CD1 3.48Å
829	W	86	Confident	87.8	Confident	45 Å²	45	43.2 Å²	43.2	17%	0.17	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-50.2	-30.1	175.8	64.9	-113.8	0	0	0	114.5	S740 A769 Y773 Y831 H832 F860 Q863 Y865	S740-W829 PolarHBondContact OG-N 2.81Å; S740-W829 VanDerWaalsContact OG-N 3.09Å; A769-W829 HydrophobicContact CB-CE3 4.26Å; A769-W829 HydrophobicContact CB-CZ3 3.9Å; Y773-W829 AromaticContact CE2-CH2 3.91Å; Y773-W829 HydrophobicContact CE2-CH2 3.91Å; Y773-W829 HydrophobicContact CE2-CZ3 4.22Å; W829-Y831 PolarHBondContact O-N 3.03Å; W829-H832 WeakPolarHBondContact O-CB 3.29Å; W829-H832 PolarHBondContact O-N 3.08Å; W829-F860 HydrophobicContact CB-CB 3.7Å; W829-F860 HydrophobicContact CB-CD1 3.67Å; W829-F860 HydrophobicContact CB-CD2 3.74Å; W829-F860 HydrophobicContact CB-CE1 4.28Å; W829-F860 HydrophobicContact CB-CE2 4.33Å; W829-F860 HydrophobicContact CB-CG 3.41Å; W829-F860 VanDerWaalsContact CB-CG 3.41Å; W829-Q863 HydrophobicContact CD2-CG 4.25Å; W829-Q863 HydrophobicContact CG-CG 4.44Å; W829-Q863 HydrophobicContact CZ2-CG 4.49Å; W829-Y865 HydrophobicContact CE3-CE1 4.28Å; W829-Y865 AromaticContact CE3-CZ 3.98Å; W829-Y865 HydrophobicContact CH2-CE1 4.21Å; W829-Y865 AromaticContact CZ3-CE1 3.54Å; W829-Y865 HydrophobicContact CZ3-CE1 3.54Å; W829-Y865 AromaticContact CZ3-CZ 3.62Å; W829-Y865 WeakPolarHBondContact CZ3-OH 3.21Å
830	R	86.5	Confident	87.6	Confident	111 Å²	111	42.8 Å²	42.8	42%	0.419	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-64.6	-24.8	177.4	-70.4	176.9	178.7	162.1	-2.8	113.5	A769 H770 Y773 T828 H832	A769-R830 HydrophobicContact CB-CB 4.38Å; A769-R830 HydrophobicContact CB-CG 4.44Å; H770-R830 PolarHBondContact CE1-O 3.25Å; H770-R830 PolarHBondContact ND1-O 2.92Å; Y773-R830 PolarHBondContact OH-NH2 3.14Å; T828-R830 PolarHBondContact O-N 2.83Å; R830-H832 VanDerWaalsContact C-N 3.32Å
831	Y	88.6	Confident	87.2	Confident	72 Å²	72	43.3 Å²	43.3	28%	0.282	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-89.8	0.9	-176.4	-61.4	7.5	0	0	0	111.8	H763 H770 P827 T828 W829 M833 D834 L856	H763-Y831 AromaticContact CE1-CD1 3.99Å; H763-Y831 AromaticContact CE1-CD2 3.69Å; H763-Y831 AromaticContact CE1-CE1 3.83Å; H763-Y831 AromaticContact CE1-CE2 3.53Å; H763-Y831 AromaticContact CE1-CG 3.93Å; H763-Y831 AromaticContact CE1-CZ 3.6Å; H770-Y831 AromaticContact CE1-CD1 3.58Å; P827-Y831 HydrophobicContact CB-CD2 3.63Å; P827-Y831 HydrophobicContact CB-CE2 4.44Å; P827-Y831 HydrophobicContact CB-CG 4.34Å; T828-Y831 WeakPolarHBondContact O-CB 3.27Å; T828-Y831 PolarHBondContact O-N 3.43Å; W829-Y831 PolarHBondContact O-N 3.03Å; Y831-M833 PolarHBondContact O-N 3.25Å; Y831-D834 VanDerWaalsContact O-CB 3.31Å; Y831-D834 WeakPolarHBondContact O-CB 3.28Å; Y831-D834 PolarHBondContact O-N 3.02Å; Y831-D834 VanDerWaalsContact O-N 3.11Å; Y831-L856 WeakPolarHBondContact O-CB 3.12Å
832	H	86.2	Confident	86.9	Confident	21 Å²	21	43.3 Å²	43.3	10%	0.097	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	130.3	176.8	-177.4	31.8	0	0	0	109.7	G767 W829 R830 D834 L856 I858 F860 Y888 N890	G767-H832 WeakPolarHBondContact CA-O 3.32Å; W829-H832 WeakPolarHBondContact O-CB 3.29Å; W829-H832 PolarHBondContact O-N 3.08Å; R830-H832 VanDerWaalsContact C-N 3.32Å; H832-D834 VanDerWaalsContact C-N 3.27Å; H832-D834 PolarHBondContact O-N 2.89Å; H832-L856 PolarHBondContact ND1-O 2.71Å; H832-L856 VanDerWaalsContact ND1-O 3.09Å; H832-I858 HydrophobicContact CB-CB 4.29Å; H832-F860 HydrophobicContact CB-CE1 3.98Å; H832-F860 AromaticContact CD2-CE1 3.69Å; H832-Y888 AromaticContact CD2-CZ 3.83Å; H832-Y888 PolarHBondContact CD2-OH 2.7Å; H832-N890 PolarHBondContact CE1-ND2 2.61Å; H832-N890 PolarHBondContact NE2-ND2 3.33Å
833	M	84.6	Confident	86.2	Confident	34 Å²	34	46.3 Å²	46.3	17%	0.167	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.1	8	-174	-51.7	-66.7	-86.7	0	0	115.7	Y831 Q855 L856	Y831-M833 PolarHBondContact O-N 3.25Å; M833-Q855 PolarHBondContact O-NE2 3.21Å; M833-Q855 HydrophobicContact SD-CG 4.35Å; M833-L856 PolarHBondContact N-O 3.01Å
834	D	88.3	Confident	85.6	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	23%	0.234	C	C	.	.			trans	-67.5	164.2	160.5	-78	-5.2	0	0	0	111.3	H763 Y764 Q765 C766 G767 H770 Y831 H832 Q855 L856	H763-D834 IonicContact CE1-OD2 3.71Å; H763-D834 WeakPolarHBondContact NE2-CB 3.47Å; H763-D834 IonicContact NE2-OD1 3.73Å; H763-D834 IonicContact NE2-OD2 2.73Å; H763-D834 PolarHBondContact NE2-OD2 3.33Å; Y764-D834 WeakPolarHBondContact O-CB 3.44Å; Q765-D834 WeakPolarHBondContact CA-OD1 3.41Å; C766-D834 PolarHBondContact N-OD1 3.24Å; G767-D834 PolarHBondContact N-OD1 3.14Å; H770-D834 IonicContact CE1-OD1 2.77Å; H770-D834 IonicContact CE1-OD2 3.38Å; H770-D834 PolarHBondContact CE1-OD2 3.03Å; H770-D834 IonicContact CG-OD1 2.73Å; H770-D834 IonicContact ND1-OD1 2.75Å; H770-D834 PolarHBondContact ND1-OD1 2.83Å; H770-D834 IonicContact ND1-OD2 2.64Å; H770-D834 PolarHBondContact ND1-OD2 2.88Å; H770-D834 VanDerWaalsContact ND1-OD2 3.1Å; Y831-D834 VanDerWaalsContact O-CB 3.31Å; Y831-D834 WeakPolarHBondContact O-CB 3.28Å; Y831-D834 PolarHBondContact O-N 3.02Å; Y831-D834 VanDerWaalsContact O-N 3.11Å; H832-D834 VanDerWaalsContact C-N 3.27Å; H832-D834 PolarHBondContact O-N 2.89Å; D834-Q855 WeakPolarHBondContact O-CA 3.35Å; D834-L856 HydrophobicContact CB-CD1 4.3Å; D834-L856 PolarHBondContact O-N 3.14Å
835	F	86.3	Confident	84.7	Confident	66 Å²	66	47.9 Å²	47.9	29%	0.289	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	141.1	177.5	-59.7	-93.9	0	0	0	112.8	H763 Y764 C766 L854 Q855	H763-F835 WeakPolarHBondContact CA-O 3.03Å; H763-F835 PolarHBondContact CD2-O 2.84Å; Y764-F835 PolarHBondContact N-O 2.95Å; Y764-F835 PolarHBondContact O-N 2.81Å; Y764-F835 VanDerWaalsContact O-N 3.16Å; C766-F835 HydrophobicContact CB-CD2 4.09Å; C766-F835 HydrophobicContact CB-CE2 4.23Å; F835-L854 CarbonylContact C-O 3.53Å; F835-L854 WeakPolarHBondContact CA-O 3.46Å; F835-Q855 HydrophobicContact CD1-CB 3.79Å; F835-Q855 HydrophobicContact CD1-CG 4.03Å; F835-Q855 HydrophobicContact CE1-CB 3.7Å; F835-Q855 HydrophobicContact CE1-CG 3.75Å; F835-Q855 HydrophobicContact CZ-CG 4.08Å; F835-Q855 VanDerWaalsContact CZ-NE2 3.27Å
836	I	88.6	Confident	83.4	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	142.5	164.3	-56.6	-58.3	0	0	0	108.5	I746 W761 R762 H763 L802 L823 L825 R853 L854 L856	I746-I836 HydrophobicContact CD1-CB 4.37Å; I746-I836 HydrophobicContact CD1-CG1 4Å; I746-I836 HydrophobicContact CD1-CG2 4.17Å; W761-I836 HydrophobicContact CE3-CG2 4.04Å; W761-I836 HydrophobicContact CZ3-CG2 4.1Å; R762-I836 CarbonylContact O-C 3.58Å; R762-I836 WeakPolarHBondContact O-CA 3.04Å; H763-I836 HydrophobicContact CB-CD1 3.64Å; L802-I836 HydrophobicContact CD1-CD1 4.46Å; L823-I836 HydrophobicContact CD2-CG2 4.01Å; L825-I836 HydrophobicContact CD1-CD1 3.66Å; L825-I836 HydrophobicContact CD1-CG1 4.04Å; I836-R853 CarbonylContact O-C 3.59Å; I836-R853 WeakPolarHBondContact O-CA 3.46Å; I836-L854 PolarHBondContact N-O 2.97Å; I836-L854 PolarHBondContact O-N 3.01Å; I836-L856 HydrophobicContact CD1-CD1 4.46Å; I836-L856 HydrophobicContact CG1-CD1 4.35Å; I836-L856 HydrophobicContact CG1-CD2 4.11Å; I836-L856 HydrophobicContact CG1-CG 4.34Å
837	E	88.4	Confident	81.9	Confident	3 Å²	3	45 Å²	45	1%	0.014	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	143.5	176.1	171.4	175	-88.6	0	0	110.4	W761 R762 Y764 H851 D852 R853	W761-E837 CarbonylContact C-O 3.6Å; W761-E837 WeakPolarHBondContact CA-O 2.23Å; R762-E837 HydrophobicContact CB-CB 4.14Å; R762-E837 WeakPolarHBondContact CD-OE2 3.42Å; R762-E837 IonicContact CZ-OE2 2.95Å; R762-E837 PolarHBondContact N-O 3.43Å; R762-E837 IonicContact NH1-OE2 3.36Å; R762-E837 PolarHBondContact NH1-OE2 2.91Å; R762-E837 PolarHBondContact O-N 2.84Å; Y764-E837 HydrophobicContact CD2-CB 4.45Å; Y764-E837 HydrophobicContact CE2-CB 3.91Å; Y764-E837 PolarHBondContact OH-OE2 2.94Å; E837-H851 HydrophobicContact CG-CB 4.36Å; E837-H851 IonicContact OE1-CE1 3.84Å; E837-H851 IonicContact OE1-CG 3.02Å; E837-H851 IonicContact OE1-ND1 2.93Å; E837-H851 PolarHBondContact OE1-ND1 2.87Å; E837-D852 VanDerWaalsContact CA-O 3.32Å; E837-D852 WeakPolarHBondContact CA-O 2.23Å; E837-R853 HydrophobicContact CB-CG 4.11Å; E837-R853 HydrophobicContact CG-CG 4.28Å; E837-R853 IonicContact OE1-CZ 3.43Å; E837-R853 IonicContact OE1-NE 2.81Å; E837-R853 PolarHBondContact OE1-NE 2.73Å; E837-R853 IonicContact OE1-NH2 3.03Å; E837-R853 PolarHBondContact OE1-NH2 3.44Å
838	C	89.8	Confident	80.3	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	142.1	165.5	177.6	0	0	0	0	109	V728 L730 C748 I759 T760 W761 H851 D852	V728-C838 HydrophobicContact CG1-CB 4.47Å; L730-C838 HydrophobicContact CD1-CB 4.28Å; L730-C838 HydrophobicContact CD2-CB 3.55Å; L730-C838 HydrophobicContact CG-CB 3.97Å; C748-C838 HydrophobicContact CB-CB 3.86Å; C748-C838 WeakPolarHBondContact CB-SG 3.37Å; C748-C838 WeakPolarHBondContact SG-CB 3.38Å; C748-C838 CovalentContact SG-SG 2.04Å; C748-C838 PolarHBondContact SG-SG 2.81Å; I759-C838 WeakPolarHBondContact CG2-SG 3.41Å; T760-C838 WeakPolarHBondContact O-CA 3.45Å; W761-C838 HydrophobicContact CD2-CB 4.22Å; W761-C838 HydrophobicContact CE3-CB 3.96Å; W761-C838 HydrophobicContact CH2-CB 4.48Å; W761-C838 HydrophobicContact CZ3-CB 4.12Å; C838-H851 CarbonylContact O-C 3.43Å; C838-H851 WeakPolarHBondContact O-CA 3.41Å; C838-H851 WeakPolarHBondContact O-CB 3.34Å; C838-D852 PolarHBondContact N-O 2.91Å; C838-D852 VanDerWaalsContact N-O 3.13Å; C838-D852 PolarHBondContact O-N 2.72Å
839	Q	87.7	Confident	79	Confident	27 Å²	27	49.1 Å²	49.1	13%	0.126	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	152.9	-176.6	70.8	175.5	1.9	0	0	111.8	I759 T760 R762 I849 W850 H851	I759-Q839 CarbonylContact C-O 3.58Å; I759-Q839 VanDerWaalsContact CA-O 3.32Å; I759-Q839 WeakPolarHBondContact CA-O 3.43Å; T760-Q839 PolarHBondContact N-O 3.13Å; T760-Q839 PolarHBondContact O-N 3.31Å; T760-Q839 WeakPolarHBondContact OG1-CG 3.5Å; T760-Q839 PolarHBondContact OG1-NE2 3.28Å; R762-Q839 VanDerWaalsContact NH2-OE1 3.13Å; Q839-I849 HydrophobicContact CB-CG2 3.66Å; Q839-I849 HydrophobicContact CG-CG2 4.27Å; Q839-W850 CarbonylContact C-O 3.54Å; Q839-W850 VanDerWaalsContact CA-O 3.25Å; Q839-W850 WeakPolarHBondContact CA-O 3.34Å; Q839-H851 HydrophobicContact CB-CB 3.93Å
840	A	86.6	Confident	78.6	Confident	2 Å²	2	49.3 Å²	49.3	2%	0.017	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	155.1	177.9	0	0	0	0	0	114.3	V728 A750 V758 I759 I849 W850	V728-A840 HydrophobicContact CG2-CB 3.32Å; A750-A840 HydrophobicContact CB-CB 4.16Å; V758-A840 CarbonylContact O-C 3.24Å; V758-A840 WeakPolarHBondContact O-CA 3.23Å; V758-A840 WeakPolarHBondContact O-CB 2.22Å; I759-A840 HydrophobicContact CG1-CB 3.95Å; A840-I849 CarbonylContact O-C 3.27Å; A840-I849 WeakPolarHBondContact O-CA 2.23Å; A840-W850 PolarHBondContact N-O 2.84Å; A840-W850 PolarHBondContact O-N 3.07Å
841	E	82.1	Confident	78.6	Confident	97 Å²	97	48.8 Å²	48.8	45%	0.453	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	150.9	-169.7	-173.7	179.3	173.3	0	0	112.2	A757 V758	A757-E841 CarbonylContact C-O 3.53Å; A757-E841 WeakPolarHBondContact CA-O 3.46Å; A757-E841 WeakPolarHBondContact CB-O 3.37Å; V758-E841 PolarHBondContact N-O 3.24Å; V758-E841 PolarHBondContact O-N 2.88Å
842	N	82.5	Confident	78.3	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	122	-178.6	-173.5	-84.5	0	0	0	113.4	P725 P755 V756 V844 Y845 G846 W850	P725-N842 HydrophobicContact CG-CB 4.42Å; P755-N842 PolarHBondContact O-ND2 3.01Å; V756-N842 PolarHBondContact O-ND2 3.48Å; N842-V844 VanDerWaalsContact C-N 3.29Å; N842-V844 PolarHBondContact O-N 2.85Å; N842-V844 VanDerWaalsContact O-N 3.08Å; N842-V844 PolarHBondContact OD1-N 2.71Å; N842-Y845 PolarHBondContact O-N 2.93Å; N842-G846 PolarHBondContact O-N 2.91Å; N842-W850 HydrophobicContact CB-CH2 4.09Å; N842-W850 HydrophobicContact CB-CZ3 3.82Å
843	P	76.1	Confident	78.2	Confident	98 Å²	98	53.2 Å²	53.2	64%	0.636	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-23.1	-171.6	-26.7	35.2	0	0	0	117.2	V756	V756-P843 VanDerWaalsContact O-CD 3.28Å; V756-P843 WeakPolarHBondContact O-CD 3.26Å
844	V	75.4	Confident	78.2	Confident	98 Å²	98	52.8 Å²	52.8	59%	0.594	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-25.1	-175.3	173.2	0	0	0	0	112.4	P755 N842	P755-V844 HydrophobicContact CG-CB 4.41Å; P755-V844 HydrophobicContact CG-CG2 3.49Å; P755-V844 VanDerWaalsContact CG-CG2 3.49Å; N842-V844 VanDerWaalsContact C-N 3.29Å; N842-V844 PolarHBondContact O-N 2.85Å; N842-V844 VanDerWaalsContact O-N 3.08Å; N842-V844 PolarHBondContact OD1-N 2.71Å
845	Y	68.8	Low	78	Confident	80 Å²	80	56 Å²	56	31%	0.314	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-4.3	-176.9	-76	-96.4	0	0	0	113.8	P724 N842 P848	P724-Y845 HydrophobicContact CB-CD1 4.43Å; P724-Y845 HydrophobicContact CB-CD2 3.67Å; P724-Y845 HydrophobicContact CB-CE2 4.01Å; P724-Y845 HydrophobicContact CB-CG 3.9Å; P724-Y845 HydrophobicContact CG-CD1 4.19Å; P724-Y845 HydrophobicContact CG-CD2 4.14Å; P724-Y845 HydrophobicContact CG-CE1 4.19Å; P724-Y845 HydrophobicContact CG-CE2 4.14Å; P724-Y845 HydrophobicContact CG-CG 4.16Å; N842-Y845 PolarHBondContact O-N 2.93Å; Y845-P848 VanDerWaalsContact O-CD 3.23Å; Y845-P848 WeakPolarHBondContact O-CD 3.3Å
846	G	57.8	Low	77.9	Confident	28 Å²	28	53 Å²	53	29%	0.289	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	83.4	-140.9	174.7	0	0	0	0	0	112.9	N842 P848	N842-G846 PolarHBondContact O-N 2.91Å; G846-P848 WeakPolarHBondContact O-CD 3.5Å
847	P	54	Low	77.8	Confident	109 Å²	109	56.1 Å²	56.1	71%	0.708	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	17.2	-171.8	36.6	-38.6	0	0	0	117.9	I849	P847-I849 PolarHBondContact O-N 2.93Å
848	P	52.8	Low	77.8	Confident	60 Å²	60	56.1 Å²	56.1	39%	0.39	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	108.6	160.9	-26	37.1	0	0	0	110.4	Y845 G846 W850	Y845-P848 VanDerWaalsContact O-CD 3.23Å; Y845-P848 WeakPolarHBondContact O-CD 3.3Å; G846-P848 WeakPolarHBondContact O-CD 3.5Å; P848-W850 HydrophobicContact CB-CH2 3.82Å; P848-W850 HydrophobicContact CB-CZ2 4.15Å; P848-W850 HydrophobicContact CB-CZ3 4.18Å; P848-W850 VanDerWaalsContact O-CE3 3.23Å; P848-W850 WeakPolarHBondContact O-CZ3 3.16Å
849	I	61.6	Low	77.8	Confident	81 Å²	81	57 Å²	57	42%	0.415	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	112.4	176.5	-65.9	169.8	0	0	0	108	Q839 A840 P847	Q839-I849 HydrophobicContact CB-CG2 3.66Å; Q839-I849 HydrophobicContact CG-CG2 4.27Å; A840-I849 CarbonylContact O-C 3.27Å; A840-I849 WeakPolarHBondContact O-CA 2.23Å; P847-I849 PolarHBondContact O-N 2.93Å
850	W	78.2	Confident	77.9	Confident	49 Å²	49	56.2 Å²	56.2	19%	0.186	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	134.5	170.4	-63.9	-94.3	0	0	0	108.5	P724 P725 V728 Q839 A840 N842 P848	P724-W850 HydrophobicContact CB-CH2 3.77Å; P724-W850 HydrophobicContact CB-CZ2 3.94Å; P724-W850 HydrophobicContact CG-CZ2 4.39Å; P725-W850 HydrophobicContact CG-CD2 3.92Å; P725-W850 HydrophobicContact CG-CE3 3.63Å; P725-W850 HydrophobicContact CG-CH2 3.81Å; P725-W850 HydrophobicContact CG-CZ2 4.06Å; P725-W850 HydrophobicContact CG-CZ3 3.57Å; P725-W850 WeakPolarHBondContact O-CZ2 3.41Å; P725-W850 PolarHBondContact O-NE1 2.73Å; V728-W850 HydrophobicContact CB-CB 4.35Å; V728-W850 HydrophobicContact CG2-CB 3.68Å; V728-W850 WeakPolarHBondContact CG2-O 3.43Å; Q839-W850 CarbonylContact C-O 3.54Å; Q839-W850 VanDerWaalsContact CA-O 3.25Å; Q839-W850 WeakPolarHBondContact CA-O 3.34Å; A840-W850 PolarHBondContact N-O 2.84Å; A840-W850 PolarHBondContact O-N 3.07Å; N842-W850 HydrophobicContact CB-CH2 4.09Å; N842-W850 HydrophobicContact CB-CZ3 3.82Å; P848-W850 HydrophobicContact CB-CH2 3.82Å; P848-W850 HydrophobicContact CB-CZ2 4.15Å; P848-W850 HydrophobicContact CB-CZ3 4.18Å; P848-W850 VanDerWaalsContact O-CE3 3.23Å; P848-W850 WeakPolarHBondContact O-CZ3 3.16Å
851	H	85.7	Confident	77.9	Confident	100 Å²	100	57 Å²	57	46%	0.463	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	158.1	-179.4	72.2	121.1	0	0	0	111.9	E837 C838 Q839	E837-H851 HydrophobicContact CG-CB 4.36Å; E837-H851 IonicContact OE1-CE1 3.84Å; E837-H851 IonicContact OE1-CG 3.02Å; E837-H851 IonicContact OE1-ND1 2.93Å; E837-H851 PolarHBondContact OE1-ND1 2.87Å; C838-H851 CarbonylContact O-C 3.43Å; C838-H851 WeakPolarHBondContact O-CA 3.41Å; C838-H851 WeakPolarHBondContact O-CB 3.34Å; Q839-H851 HydrophobicContact CB-CB 3.93Å
852	D	83.6	Confident	78.1	Confident	54 Å²	54	52.3 Å²	52.3	29%	0.289	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	155.1	178	-165.9	8.7	0	0	0	110.2	V728 S729 L730 E837 C838	V728-D852 HydrophobicContact CG1-CB 4.38Å; S729-D852 WeakPolarHBondContact CA-OD2 3.39Å; L730-D852 HydrophobicContact CB-CB 4.44Å; L730-D852 HydrophobicContact CD1-CB 4.25Å; L730-D852 WeakPolarHBondContact CD1-O 3.44Å; L730-D852 HydrophobicContact CG-CB 4.11Å; L730-D852 PolarHBondContact N-OD2 3.34Å; E837-D852 VanDerWaalsContact CA-O 3.32Å; E837-D852 WeakPolarHBondContact CA-O 2.23Å; C838-D852 PolarHBondContact N-O 2.91Å; C838-D852 VanDerWaalsContact N-O 3.13Å; C838-D852 PolarHBondContact O-N 2.72Å
853	R	83.8	Confident	78.2	Confident	131 Å²	131	55 Å²	55	49%	0.494	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	138.5	-172.2	-68.4	-171.6	175.8	166.5	3.7	113.5	I836 E837	I836-R853 CarbonylContact O-C 3.59Å; I836-R853 WeakPolarHBondContact O-CA 3.46Å; E837-R853 HydrophobicContact CB-CG 4.11Å; E837-R853 HydrophobicContact CG-CG 4.28Å; E837-R853 IonicContact OE1-CZ 3.43Å; E837-R853 IonicContact OE1-NE 2.81Å; E837-R853 PolarHBondContact OE1-NE 2.73Å; E837-R853 IonicContact OE1-NH2 3.03Å; E837-R853 PolarHBondContact OE1-NH2 3.44Å
854	L	83.3	Confident	78.2	Confident	25 Å²	25	52.7 Å²	52.7	13%	0.131	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	118.9	-172.9	-169.4	65.4	0	0	0	110.8	L730 F732 I746 F835 I836	L730-L854 HydrophobicContact CD1-CB 3.86Å; F732-L854 HydrophobicContact CD1-CD2 3.9Å; F732-L854 HydrophobicContact CD2-CD1 4.33Å; F732-L854 HydrophobicContact CE1-CD1 4.26Å; F732-L854 HydrophobicContact CE1-CD2 3.57Å; F732-L854 HydrophobicContact CE1-CG 3.98Å; F732-L854 HydrophobicContact CE2-CD1 3.67Å; F732-L854 HydrophobicContact CE2-CD2 4.38Å; F732-L854 HydrophobicContact CE2-CG 4.29Å; F732-L854 HydrophobicContact CG-CD2 4.46Å; F732-L854 HydrophobicContact CZ-CD1 3.64Å; F732-L854 HydrophobicContact CZ-CD2 3.83Å; F732-L854 HydrophobicContact CZ-CG 3.75Å; I746-L854 HydrophobicContact CD1-CD2 4.29Å; I746-L854 HydrophobicContact CG1-CD2 4.45Å; I746-L854 HydrophobicContact CG2-CD2 3.54Å; F835-L854 CarbonylContact C-O 3.53Å; F835-L854 WeakPolarHBondContact CA-O 3.46Å; I836-L854 PolarHBondContact N-O 2.97Å; I836-L854 PolarHBondContact O-N 3.01Å
855	Q	84.3	Confident	77.7	Confident	67 Å²	67	49.3 Å²	49.3	31%	0.313	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	136.3	179.1	-164.6	170.1	33.7	0	0	111.6	M833 D834 F835 N857	M833-Q855 PolarHBondContact O-NE2 3.21Å; M833-Q855 HydrophobicContact SD-CG 4.35Å; D834-Q855 WeakPolarHBondContact O-CA 3.35Å; F835-Q855 HydrophobicContact CD1-CB 3.79Å; F835-Q855 HydrophobicContact CD1-CG 4.03Å; F835-Q855 HydrophobicContact CE1-CB 3.7Å; F835-Q855 HydrophobicContact CE1-CG 3.75Å; F835-Q855 HydrophobicContact CZ-CG 4.08Å; F835-Q855 VanDerWaalsContact CZ-NE2 3.27Å; Q855-N857 PolarHBondContact O-N 2.9Å
856	L	85.5	Confident	76.9	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.021	25%	0.247	C	C	.	.			trans	-85.2	110.2	-175.4	-63.5	-177.7	0	0	0	112.7	L744 Y831 H832 M833 D834 I836 I858	L744-L856 HydrophobicContact CD2-CD2 4.05Å; Y831-L856 WeakPolarHBondContact O-CB 3.12Å; H832-L856 PolarHBondContact ND1-O 2.71Å; H832-L856 VanDerWaalsContact ND1-O 3.09Å; M833-L856 PolarHBondContact N-O 3.01Å; D834-L856 HydrophobicContact CB-CD1 4.3Å; D834-L856 PolarHBondContact O-N 3.14Å; I836-L856 HydrophobicContact CD1-CD1 4.46Å; I836-L856 HydrophobicContact CG1-CD1 4.35Å; I836-L856 HydrophobicContact CG1-CD2 4.11Å; I836-L856 HydrophobicContact CG1-CG 4.34Å; L856-I858 HydrophobicContact CB-CD1 4.23Å; L856-I858 HydrophobicContact CB-CG1 4.3Å
857	N	86.8	Confident	76.6	Confident	66 Å²	66	49.1 Å²	49.1	35%	0.353	25%	0.254	S	S	.	.			trans	-95.7	108.8	171.5	-166.5	-6	0	0	0	110.3	V738 Q855 N890	V738-N857 PolarHBondContact N-O 3.14Å; Q855-N857 PolarHBondContact O-N 2.9Å; N857-N890 PolarHBondContact OD1-ND2 2.83Å
858	I	86.9	Confident	76.3	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	129.9	-171.1	-54.6	171.4	0	0	0	108.9	V738 P827 T828 H832 L856 F860 N890	V738-I858 CarbonylContact O-C 3.6Å; V738-I858 VanDerWaalsContact O-CA 3.25Å; V738-I858 WeakPolarHBondContact O-CA 3.2Å; P827-I858 HydrophobicContact CB-CD1 3.63Å; P827-I858 HydrophobicContact CG-CD1 4Å; P827-I858 HydrophobicContact CG-CG1 4.38Å; T828-I858 VanDerWaalsContact O-CD1 3.26Å; T828-I858 WeakPolarHBondContact O-CD1 3.48Å; H832-I858 HydrophobicContact CB-CB 4.29Å; L856-I858 HydrophobicContact CB-CD1 4.23Å; L856-I858 HydrophobicContact CB-CG1 4.3Å; I858-F860 WeakPolarHBondContact O-CD1 3.08Å; I858-F860 VanDerWaalsContact O-CE1 3.23Å; I858-F860 WeakPolarHBondContact O-CE1 3.25Å; I858-N890 WeakPolarHBondContact O-CB 3.16Å; I858-N890 PolarHBondContact O-ND2 2.94Å
859	T	90.1	Very high	76.1	Confident	19 Å²	19	49.8 Å²	49.8	12%	0.117	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	142.1	176.7	51.7	0	0	0	0	112.8	V737 V738 S740 N890 Q949	V737-T859 HydrophobicContact CG1-CG2 3.6Å; V738-T859 PolarHBondContact O-N 2.78Å; S740-T859 PolarHBondContact N-O 2.98Å; T859-N890 CarbonylContact C-O 3.55Å; T859-N890 WeakPolarHBondContact CA-O 3.3Å; T859-N890 VanDerWaalsContact CB-O 3.27Å; T859-N890 WeakPolarHBondContact CB-O 3.38Å; T859-Q949 PolarHBondContact OG1-OE1 2.75Å
860	F	89.5	Confident	75.5	Confident	10 Å²	10	49 Å²	49	4%	0.044	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	155.3	-174.1	52.3	-84.1	0	0	0	110.9	W829 H832 I858 Q863 Y888 N890 N947	W829-F860 HydrophobicContact CB-CB 3.7Å; W829-F860 HydrophobicContact CB-CD1 3.67Å; W829-F860 HydrophobicContact CB-CD2 3.74Å; W829-F860 HydrophobicContact CB-CE1 4.28Å; W829-F860 HydrophobicContact CB-CE2 4.33Å; W829-F860 HydrophobicContact CB-CG 3.41Å; W829-F860 VanDerWaalsContact CB-CG 3.41Å; H832-F860 HydrophobicContact CB-CE1 3.98Å; H832-F860 AromaticContact CD2-CE1 3.69Å; I858-F860 WeakPolarHBondContact O-CD1 3.08Å; I858-F860 VanDerWaalsContact O-CE1 3.23Å; I858-F860 WeakPolarHBondContact O-CE1 3.25Å; F860-Q863 HydrophobicContact CD2-CG 4.23Å; F860-Y888 HydrophobicContact CE1-CE1 4.32Å; F860-Y888 AromaticContact CE2-CD1 3.71Å; F860-Y888 HydrophobicContact CE2-CD1 3.71Å; F860-Y888 AromaticContact CE2-CE1 3.89Å; F860-Y888 HydrophobicContact CE2-CE1 3.89Å; F860-Y888 AromaticContact CZ-CD1 3.59Å; F860-Y888 HydrophobicContact CZ-CD1 3.59Å; F860-Y888 AromaticContact CZ-CE1 3.35Å; F860-Y888 HydrophobicContact CZ-CE1 3.35Å; F860-N890 HydrophobicContact CD1-CB 4.1Å; F860-N890 HydrophobicContact CE1-CB 3.5Å; F860-N890 VanDerWaalsContact CE1-CB 3.5Å; F860-N890 HydrophobicContact CZ-CB 3.84Å; F860-N890 PolarHBondContact N-O 2.74Å; F860-N890 VanDerWaalsContact O-O 3.07Å; F860-N947 PolarHBondContact O-ND2 2.8Å
861	A	87.5	Confident	74.7	Confident	18 Å²	18	51.8 Å²	51.8	15%	0.149	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	153.6	173	0	0	0	0	0	111.3	Q863 Q949 H950	A861-Q863 PolarHBondContact O-N 3.31Å; A861-Q863 PolarHBondContact O-NE2 2.77Å; A861-Q863 VanDerWaalsContact O-NE2 3.16Å; A861-Q949 HydrophobicContact CB-CB 4.47Å; A861-H950 HydrophobicContact CB-CB 3.47Å; A861-H950 VanDerWaalsContact CB-CB 3.47Å
862	P	87.2	Confident	73.8	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	136.9	-175.3	-22.7	34	0	0	0	111.9	A889 V893 V945 N947 H950 S952	P862-A889 HydrophobicContact CB-CB 3.93Å; P862-A889 HydrophobicContact CG-CB 4.03Å; P862-V893 HydrophobicContact CB-CG2 4.15Å; P862-V893 HydrophobicContact CG-CG2 4.1Å; P862-V945 HydrophobicContact CB-CB 4.29Å; P862-V945 HydrophobicContact CB-CG2 3.77Å; P862-V945 HydrophobicContact CG-CB 4.39Å; P862-V945 HydrophobicContact CG-CG2 4.26Å; P862-N947 HydrophobicContact CG-CB 4.13Å; P862-H950 WeakPolarHBondContact CD-O 3.29Å; P862-S952 WeakPolarHBondContact O-CB 3.39Å; P862-S952 PolarHBondContact O-OG 3.45Å
863	Q	84.5	Confident	73.6	Confident	56 Å²	56	50.5 Å²	50.5	26%	0.262	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	151.2	172.4	-44.4	-75.3	-87.6	0	0	109.1	W829 F860 A861 Y865 Y888	W829-Q863 HydrophobicContact CD2-CG 4.25Å; W829-Q863 HydrophobicContact CG-CG 4.44Å; W829-Q863 HydrophobicContact CZ2-CG 4.49Å; F860-Q863 HydrophobicContact CD2-CG 4.23Å; A861-Q863 PolarHBondContact O-N 3.31Å; A861-Q863 PolarHBondContact O-NE2 2.77Å; A861-Q863 VanDerWaalsContact O-NE2 3.16Å; Q863-Y865 HydrophobicContact CB-CD2 4.31Å; Q863-Y865 HydrophobicContact CB-CE2 3.56Å; Q863-Y865 HydrophobicContact CG-CE2 4.47Å; Q863-Y865 VanDerWaalsContact O-CD2 3.26Å; Q863-Y865 WeakPolarHBondContact O-CD2 3.42Å; Q863-Y865 WeakPolarHBondContact O-CE2 3.29Å; Q863-Y888 PolarHBondContact N-O 3.02Å; Q863-Y888 PolarHBondContact O-N 2.82Å; Q863-Y888 VanDerWaalsContact O-N 3.14Å
864	F	75.7	Confident	73.5	Confident	50 Å²	50	47.9 Å²	47.9	22%	0.219	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	119.7	177.3	-53.4	-86.9	0	0	0	109.2	F885 L887 V943 V945 N954	F864-F885 HydrophobicContact CD1-CB 4.27Å; F864-L887 HydrophobicContact CD1-CD2 3.55Å; F864-L887 HydrophobicContact CE1-CD2 3.6Å; F864-V943 HydrophobicContact CE1-CG1 3.67Å; F864-V943 HydrophobicContact CZ-CG1 3.98Å; F864-V945 HydrophobicContact CE1-CG2 3.99Å; F864-V945 HydrophobicContact CE2-CG2 4.42Å; F864-V945 HydrophobicContact CZ-CG2 3.63Å; F864-N954 HydrophobicContact CD1-CB 4.4Å; F864-N954 HydrophobicContact CD2-CB 4.05Å; F864-N954 HydrophobicContact CE1-CB 3.99Å; F864-N954 HydrophobicContact CE2-CB 3.62Å; F864-N954 HydrophobicContact CG-CB 4.43Å; F864-N954 HydrophobicContact CZ-CB 3.58Å
865	Y	63.4	Low	73.5	Confident	27 Å²	27	47.1 Å²	47.1	11%	0.106	25%	0.247	C	C	.	.			trans	-113.8	-19.3	179.8	-62.8	-107.9	0	0	0	112.7	A769 F772 W829 Q863 G886 Y888	A769-Y865 HydrophobicContact CB-CE1 3.97Å; F772-Y865 WeakPolarHBondContact CE2-O 3.24Å; F772-Y865 WeakPolarHBondContact CZ-O 3.18Å; W829-Y865 HydrophobicContact CE3-CE1 4.28Å; W829-Y865 AromaticContact CE3-CZ 3.98Å; W829-Y865 HydrophobicContact CH2-CE1 4.21Å; W829-Y865 AromaticContact CZ3-CE1 3.54Å; W829-Y865 HydrophobicContact CZ3-CE1 3.54Å; W829-Y865 AromaticContact CZ3-CZ 3.62Å; W829-Y865 WeakPolarHBondContact CZ3-OH 3.21Å; Q863-Y865 HydrophobicContact CB-CD2 4.31Å; Q863-Y865 HydrophobicContact CB-CE2 3.56Å; Q863-Y865 HydrophobicContact CG-CE2 4.47Å; Q863-Y865 VanDerWaalsContact O-CD2 3.26Å; Q863-Y865 WeakPolarHBondContact O-CD2 3.42Å; Q863-Y865 WeakPolarHBondContact O-CE2 3.29Å; Y865-G886 WeakPolarHBondContact CB-O 3.42Å; Y865-G886 PolarHBondContact N-O 2.94Å; Y865-Y888 HydrophobicContact CD2-CD1 4.34Å; Y865-Y888 HydrophobicContact CD2-CG 4.39Å; Y865-Y888 HydrophobicContact CE1-CD1 4.19Å; Y865-Y888 HydrophobicContact CE1-CE1 4.47Å; Y865-Y888 VanDerWaalsContact CE2-CB 3.47Å; Y865-Y888 AromaticContact CE2-CD1 3.41Å; Y865-Y888 HydrophobicContact CE2-CD1 3.41Å; Y865-Y888 VanDerWaalsContact CE2-CD1 3.41Å; Y865-Y888 HydrophobicContact CE2-CE1 4.37Å; Y865-Y888 AromaticContact CE2-CG 3.86Å; Y865-Y888 HydrophobicContact CE2-CG 3.86Å; Y865-Y888 AromaticContact CZ-CD1 3.33Å; Y865-Y888 AromaticContact CZ-CE1 3.85Å; Y865-Y888 WeakPolarHBondContact OH-CD1 3.48Å; Y865-Y888 WeakPolarHBondContact OH-CE1 3.26Å
866	G	52.5	Low	73.5	Confident	22 Å²	22	50.1 Å²	50.1	23%	0.227	26%	0.256	C	S	.	.	S	Bend	trans	-70.2	-180	173.5	0	0	0	0	0	111.9	Q868 F885 G886	G866-Q868 PolarHBondContact O-N 2.79Å; G866-F885 WeakPolarHBondContact CA-O 3.42Å; G866-F885 PolarHBondContact N-O 3.26Å; G866-G886 PolarHBondContact N-O 2.71Å
867	L	51.2	Low	73.6	Confident	82 Å²	82	52.6 Å²	52.6	43%	0.429	27%	0.267	S	S	.	.	S	Bend	trans	10.9	85.3	163.2	-83.5	171.6	0	0	0	114.3	V869 R873 L883	L867-V869 PolarHBondContact O-N 3.41Å; L867-R873 VanDerWaalsContact C-NH2 3.29Å; L867-R873 PolarHBondContact O-NH2 2.8Å; L867-L883 HydrophobicContact CD1-CD2 4.36Å
868	Q	47.8	Very low	73.5	Confident	108 Å²	108	51.9 Å²	51.9	51%	0.505	28%	0.275	S	S	.	.			trans	-40.9	134.3	-175.8	-76.4	-171.6	-105.8	0	0	111.6	H776 G866 D870 R873	H776-Q868 PolarHBondContact CE1-OE1 3.49Å; H776-Q868 PolarHBondContact NE2-OE1 2.73Å; G866-Q868 PolarHBondContact O-N 2.79Å; Q868-D870 PolarHBondContact O-N 2.75Å; Q868-R873 PolarHBondContact O-NH2 2.8Å
869	V	48.3	Very low	73.2	Confident	74 Å²	74	55.9 Å²	55.9	45%	0.448	29%	0.294	S	S	.	.			trans	-73.3	74.6	-174.6	-167.4	0	0	0	0	111.3	L867 N954	L867-V869 PolarHBondContact O-N 3.41Å; V869-N954 WeakPolarHBondContact CG1-OD1 3.42Å; V869-N954 WeakPolarHBondContact CG2-ND2 3.33Å
870	D	50.4	Low	72.9	Confident	66 Å²	66	58.5 Å²	58.5	35%	0.353	31%	0.31	S	S	.	.			trans	-69	135.3	145.8	-39.7	-68.4	0	0	0	106.8	Q868 H872 R873 F1817	Q868-D870 PolarHBondContact O-N 2.75Å; D870-H872 PolarHBondContact O-N 2.92Å; D870-R873 IonicContact OD2-NH1 3.49Å; D870-R873 PolarHBondContact OD2-NH1 3.05Å; D870-R873 VanDerWaalsContact OD2-NH1 3.13Å; D870-R873 IonicContact OD2-NH2 3.11Å; D870-F1817 HydrophobicContact CB-CE2 3.88Å; D870-F1817 HydrophobicContact CB-CZ 3.86Å
871	D	60.5	Low	72.5	Confident	107 Å²	107	60.1 Å²	60.1	57%	0.572	32%	0.321	S	S	*	.	S	Bend	trans	-68.6	7	-176.2	-59.5	-53.7	0	0	0	113.6	F957	D871-F957 WeakPolarHBondContact O-CB 3.41Å; D871-F957 PolarHBondContact O-N 2.69Å
872	H	67.5	Low	72.3	Confident	94 Å²	94	63.8 Å²	63.8	44%	0.435	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	142.7	-179.2	-51.3	-75.6	0	0	0	113	D870 F957 F1817	D870-H872 PolarHBondContact O-N 2.92Å; H872-F957 CarbonylContact C-O 3.59Å; H872-F957 VanDerWaalsContact CA-O 3.3Å; H872-F957 WeakPolarHBondContact CA-O 3.17Å; H872-F957 AromaticContact ND1-CD1 3.92Å; H872-F957 AromaticContact ND1-CG 3.95Å; H872-F1817 HydrophobicContact CB-CE1 4.46Å; H872-F1817 HydrophobicContact CB-CZ 4.08Å
873	R	78.2	Confident	71.9	Confident	32 Å²	32	64.7 Å²	64.7	12%	0.121	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	133.6	167.1	-70	-71.1	168.1	-113.2	1	109.6	L867 Q868 D870 F956 F957 N959	L867-R873 VanDerWaalsContact C-NH2 3.29Å; L867-R873 PolarHBondContact O-NH2 2.8Å; Q868-R873 PolarHBondContact O-NH2 2.8Å; D870-R873 IonicContact OD2-NH1 3.49Å; D870-R873 PolarHBondContact OD2-NH1 3.05Å; D870-R873 VanDerWaalsContact OD2-NH1 3.13Å; D870-R873 IonicContact OD2-NH2 3.11Å; R873-F956 HydrophobicContact CB-CD2 3.8Å; R873-F956 HydrophobicContact CB-CE2 3.83Å; R873-F956 HydrophobicContact CG-CD2 3.55Å; R873-F956 HydrophobicContact CG-CE2 3.77Å; R873-F956 HydrophobicContact CG-CG 4.22Å; R873-F957 PolarHBondContact N-O 3.4Å; R873-N959 PolarHBondContact O-N 2.67Å
874	V	82.8	Confident	71.3	Confident	76 Å²	76	66.1 Å²	66.1	46%	0.461	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.3	-177.9	-174.6	0	0	0	0	109.5	N959 T961	V874-N959 WeakPolarHBondContact CA-O 3.44Å; V874-N959 HydrophobicContact CG2-CB 4.46Å; V874-T961 HydrophobicContact CG1-CG2 3.73Å
875	I	82.9	Confident	71	Confident	10 Å²	10	64.1 Å²	64.1	5%	0.051	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	146.8	179.5	-69.1	-178.1	0	0	0	108.2	E879 T881 L883 L930 L958 N959 V960 T961	I875-E879 HydrophobicContact CG2-CB 3.88Å; I875-E879 HydrophobicContact CG2-CG 4.25Å; I875-T881 HydrophobicContact CD1-CG2 3.75Å; I875-L883 HydrophobicContact CD1-CD1 4.33Å; I875-L930 HydrophobicContact CD1-CD1 4.21Å; I875-L930 HydrophobicContact CD1-CD2 3.75Å; I875-L958 HydrophobicContact CB-CD1 4.18Å; I875-L958 HydrophobicContact CD1-CD1 3.85Å; I875-L958 HydrophobicContact CG1-CD1 4.11Å; I875-N959 PolarHBondContact N-O 2.94Å; I875-V960 CarbonylContact O-C 3.59Å; I875-V960 VanDerWaalsContact O-CA 3.29Å; I875-V960 WeakPolarHBondContact O-CA 3.05Å; I875-T961 PolarHBondContact O-N 2.9Å; I875-T961 PolarHBondContact O-OG1 3.02Å
876	R	85.3	Confident	71.2	Confident	130 Å²	130	63.9 Å²	63.9	49%	0.491	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	145.3	-177.3	-172.9	175	175.1	168.9	-0.1	112.4	G878 E879	R876-G878 PolarHBondContact O-N 3.15Å; R876-E879 HydrophobicContact CB-CB 4.31Å; R876-E879 PolarHBondContact N-OE2 3.05Å; R876-E879 WeakPolarHBondContact O-CB 3.49Å; R876-E879 PolarHBondContact O-N 2.98Å
877	E	86.8	Confident	72.3	Confident	56 Å²	56	64.9 Å²	64.9	26%	0.262	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	125.4	172.3	-176.1	157.3	-108.4	0	0	110.5	I933 R935 V960 T961 Y962	E877-I933 CarbonylContact C-O 3.56Å; E877-I933 WeakPolarHBondContact CA-O 3.47Å; E877-R935 WeakPolarHBondContact OE1-CB 3.24Å; E877-R935 WeakPolarHBondContact OE1-CG 3.22Å; E877-R935 PolarHBondContact OE1-N 3.5Å; E877-R935 IonicContact OE1-NE 2.79Å; E877-R935 PolarHBondContact OE1-NE 2.9Å; E877-R935 VanDerWaalsContact OE1-NE 3.11Å; E877-R935 IonicContact OE2-CZ 2.68Å; E877-R935 IonicContact OE2-NE 3.28Å; E877-R935 PolarHBondContact OE2-NE 3.16Å; E877-R935 IonicContact OE2-NH2 2.74Å; E877-R935 PolarHBondContact OE2-NH2 3.02Å; E877-V960 HydrophobicContact CB-CG1 4.06Å; E877-T961 WeakPolarHBondContact CB-O 3.46Å; E877-T961 PolarHBondContact N-O 3.47Å; E877-Y962 WeakPolarHBondContact OE2-CB 3.24Å
878	G	83.8	Confident	73.9	Confident	50 Å²	50	63.3 Å²	63.3	52%	0.515	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	-10.6	-171.9	0	0	0	0	0	115.6	R876 I933	R876-G878 PolarHBondContact O-N 3.15Å; G878-I933 PolarHBondContact N-O 2.84Å
879	E	80.6	Confident	75.6	Confident	86 Å²	86	59 Å²	59	40%	0.402	32%	0.317	S	S	.	.			trans	-69.1	156.4	-178.1	-167.8	169.3	-176.2	0	0	112.6	I875 R876 K932 I933	I875-E879 HydrophobicContact CG2-CB 3.88Å; I875-E879 HydrophobicContact CG2-CG 4.25Å; R876-E879 HydrophobicContact CB-CB 4.31Å; R876-E879 PolarHBondContact N-OE2 3.05Å; R876-E879 WeakPolarHBondContact O-CB 3.49Å; R876-E879 PolarHBondContact O-N 2.98Å; E879-K932 WeakPolarHBondContact O-CA 3.49Å; E879-K932 PolarHBondContact O-N 2.72Å; E879-K932 VanDerWaalsContact O-N 3.15Å; E879-I933 PolarHBondContact O-N 2.69Å; E879-I933 VanDerWaalsContact O-N 3.11Å
880	T	84.6	Confident	77.5	Confident	75 Å²	75	56.8 Å²	56.8	46%	0.46	30%	0.303	S	S	.	.			trans	-138.6	118.5	-180	-63.2	0	0	0	0	109.4	L930 H931 K932	T880-L930 CarbonylContact C-O 3.59Å; T880-L930 WeakPolarHBondContact CA-O 3.27Å; T880-H931 WeakPolarHBondContact CG2-ND1 3.41Å; T880-K932 PolarHBondContact OG1-N 3.41Å
881	T	81.4	Confident	79.3	Confident	43 Å²	43	55.3 Å²	55.3	26%	0.264	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	169.5	-169.6	-166.1	0	0	0	0	112.2	I875 L930	I875-T881 HydrophobicContact CD1-CG2 3.75Å; T881-L930 HydrophobicContact CG2-CB 4.27Å; T881-L930 HydrophobicContact CG2-CD1 4.16Å; T881-L930 PolarHBondContact N-O 3.14Å; T881-L930 WeakPolarHBondContact O-CB 3.38Å; T881-L930 PolarHBondContact O-N 3.2Å
882	H	82	Confident	80.3	Confident	95 Å²	95	55 Å²	55	44%	0.44	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	131.4	178	-58.7	57.3	0	0	0	109.1	L928 S929 H931	H882-L928 WeakPolarHBondContact CA-O 3.49Å; H882-S929 PolarHBondContact NE2-OG 2.99Å; H882-H931 AromaticContact CE1-CE1 3.56Å; H882-H931 AromaticContact NE2-CE1 3.86Å
883	L	79.4	Confident	81	Confident	20 Å²	20	52.2 Å²	52.2	11%	0.105	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	116.5	178.4	-59.9	178.2	0	0	0	110.7	L867 I875 F885 L928 L930 F956	L867-L883 HydrophobicContact CD1-CD2 4.36Å; I875-L883 HydrophobicContact CD1-CD1 4.33Å; L883-F885 HydrophobicContact CB-CD2 4.45Å; L883-F885 HydrophobicContact CB-CE2 3.59Å; L883-F885 HydrophobicContact CB-CZ 4.14Å; L883-F885 HydrophobicContact CD1-CZ 4.36Å; L883-L928 HydrophobicContact CB-CB 4.35Å; L883-L928 PolarHBondContact N-O 2.97Å; L883-L928 PolarHBondContact O-N 3.26Å; L883-L928 VanDerWaalsContact O-N 3.14Å; L883-L930 HydrophobicContact CD1-CD1 3.87Å; L883-L930 HydrophobicContact CG-CD1 3.75Å; L883-F956 HydrophobicContact CD1-CZ 4.21Å
884	D	72.9	Confident	81.2	Confident	86 Å²	86	55.2 Å²	55.2	46%	0.46	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	123.6	171.7	175.6	11.8	0	0	0	110.1	G886 L927	D884-G886 PolarHBondContact OD1-N 2.8Å; D884-L927 HydrophobicContact CB-CD2 3.78Å
885	F	69.3	Low	81.3	Confident	8 Å²	8	53.9 Å²	53.9	4%	0.035	31%	0.306	C	S	.	.			trans	-93.8	4.3	-178.8	-71.1	-95.5	0	0	0	113.5	F864 G866 L883 W898 L928 F956	F864-F885 HydrophobicContact CD1-CB 4.27Å; G866-F885 WeakPolarHBondContact CA-O 3.42Å; G866-F885 PolarHBondContact N-O 3.26Å; L883-F885 HydrophobicContact CB-CD2 4.45Å; L883-F885 HydrophobicContact CB-CE2 3.59Å; L883-F885 HydrophobicContact CB-CZ 4.14Å; L883-F885 HydrophobicContact CD1-CZ 4.36Å; F885-W898 AromaticContact CD2-CH2 3.68Å; F885-W898 HydrophobicContact CD2-CH2 3.68Å; F885-W898 AromaticContact CD2-CZ2 3.81Å; F885-W898 HydrophobicContact CD2-CZ2 3.81Å; F885-W898 HydrophobicContact CE1-CH2 4.49Å; F885-W898 AromaticContact CE2-CH2 3.39Å; F885-W898 HydrophobicContact CE2-CH2 3.39Å; F885-W898 AromaticContact CE2-CZ2 3.85Å; F885-W898 HydrophobicContact CE2-CZ2 3.85Å; F885-W898 HydrophobicContact CE2-CZ3 4.49Å; F885-W898 HydrophobicContact CG-CH2 4.39Å; F885-W898 AromaticContact CZ-CH2 3.85Å; F885-W898 HydrophobicContact CZ-CH2 3.85Å; F885-L928 HydrophobicContact CE2-CB 4.46Å; F885-F956 AromaticContact CE1-CD1 3.93Å; F885-F956 HydrophobicContact CE1-CD1 3.93Å; F885-F956 AromaticContact CE1-CE1 3.82Å; F885-F956 HydrophobicContact CE1-CE1 3.82Å; F885-F956 HydrophobicContact CE2-CE1 4.27Å; F885-F956 AromaticContact CZ-CD1 3.93Å; F885-F956 HydrophobicContact CZ-CD1 3.93Å; F885-F956 AromaticContact CZ-CE1 3.33Å; F885-F956 HydrophobicContact CZ-CE1 3.33Å; F885-F956 AromaticContact CZ-CZ 3.89Å; F885-F956 HydrophobicContact CZ-CZ 3.89Å
886	G	67.6	Low	81.5	Confident	21 Å²	21	54.2 Å²	54.2	22%	0.216	31%	0.308	C	S	.	.			trans	57.3	59.1	173.3	0	0	0	0	0	112.1	Y865 G866 D884	Y865-G886 WeakPolarHBondContact CB-O 3.42Å; Y865-G886 PolarHBondContact N-O 2.94Å; G866-G886 PolarHBondContact N-O 2.71Å; D884-G886 PolarHBondContact OD1-N 2.8Å
887	L	75.8	Confident	81.6	Confident	44 Å²	44	49.5 Å²	49.5	23%	0.23	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	131.7	178.1	-59.8	177.6	0	0	0	110.5	F864 V893 V896 E926 V945	F864-L887 HydrophobicContact CD1-CD2 3.55Å; F864-L887 HydrophobicContact CE1-CD2 3.6Å; L887-V893 HydrophobicContact CB-CG2 4.43Å; L887-V893 HydrophobicContact CD1-CG2 4.25Å; L887-V896 HydrophobicContact CD1-CG2 4.31Å; L887-E926 HydrophobicContact CD1-CB 3.55Å; L887-E926 HydrophobicContact CG-CB 4.49Å; L887-V945 HydrophobicContact CD1-CG1 3.79Å; L887-V945 HydrophobicContact CD2-CG1 4.02Å; L887-V945 HydrophobicContact CD2-CG2 4.24Å
888	Y	83.2	Confident	81.7	Confident	49 Å²	49	47 Å²	47	19%	0.192	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	132.1	165.7	161.5	-75	0	0	0	109.4	P768 H832 F860 Q863 Y865	P768-Y888 HydrophobicContact CB-CE2 3.81Å; P768-Y888 HydrophobicContact CG-CE2 3.88Å; H832-Y888 AromaticContact CD2-CZ 3.83Å; H832-Y888 PolarHBondContact CD2-OH 2.7Å; F860-Y888 HydrophobicContact CE1-CE1 4.32Å; F860-Y888 AromaticContact CE2-CD1 3.71Å; F860-Y888 HydrophobicContact CE2-CD1 3.71Å; F860-Y888 AromaticContact CE2-CE1 3.89Å; F860-Y888 HydrophobicContact CE2-CE1 3.89Å; F860-Y888 AromaticContact CZ-CD1 3.59Å; F860-Y888 HydrophobicContact CZ-CD1 3.59Å; F860-Y888 AromaticContact CZ-CE1 3.35Å; F860-Y888 HydrophobicContact CZ-CE1 3.35Å; Q863-Y888 PolarHBondContact N-O 3.02Å; Q863-Y888 PolarHBondContact O-N 2.82Å; Q863-Y888 VanDerWaalsContact O-N 3.14Å; Y865-Y888 HydrophobicContact CD2-CD1 4.34Å; Y865-Y888 HydrophobicContact CD2-CG 4.39Å; Y865-Y888 HydrophobicContact CE1-CD1 4.19Å; Y865-Y888 HydrophobicContact CE1-CE1 4.47Å; Y865-Y888 VanDerWaalsContact CE2-CB 3.47Å; Y865-Y888 AromaticContact CE2-CD1 3.41Å; Y865-Y888 HydrophobicContact CE2-CD1 3.41Å; Y865-Y888 VanDerWaalsContact CE2-CD1 3.41Å; Y865-Y888 HydrophobicContact CE2-CE1 4.37Å; Y865-Y888 AromaticContact CE2-CG 3.86Å; Y865-Y888 HydrophobicContact CE2-CG 3.86Å; Y865-Y888 AromaticContact CZ-CD1 3.33Å; Y865-Y888 AromaticContact CZ-CE1 3.85Å; Y865-Y888 WeakPolarHBondContact OH-CD1 3.48Å; Y865-Y888 WeakPolarHBondContact OH-CE1 3.26Å
889	A	85.4	Confident	81.9	Confident	18 Å²	18	46.8 Å²	46.8	15%	0.149	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	146.5	-165.4	0	0	0	0	0	108.6	P862 P891 V893	P862-A889 HydrophobicContact CB-CB 3.93Å; P862-A889 HydrophobicContact CG-CB 4.03Å; A889-P891 CarbonylContact C-O 3.44Å; A889-P891 VanDerWaalsContact C-O 3.27Å; A889-P891 WeakPolarHBondContact CB-O 3.31Å; A889-V893 HydrophobicContact CB-CG2 3.91Å
890	N	88	Confident	82.2	Confident	26 Å²	26	45.8 Å²	45.8	14%	0.139	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	116.5	169	-173.8	18.4	0	0	0	109.8	H832 N857 I858 T859 F860	H832-N890 PolarHBondContact CE1-ND2 2.61Å; H832-N890 PolarHBondContact NE2-ND2 3.33Å; N857-N890 PolarHBondContact OD1-ND2 2.83Å; I858-N890 WeakPolarHBondContact O-CB 3.16Å; I858-N890 PolarHBondContact O-ND2 2.94Å; T859-N890 CarbonylContact C-O 3.55Å; T859-N890 WeakPolarHBondContact CA-O 3.3Å; T859-N890 VanDerWaalsContact CB-O 3.27Å; T859-N890 WeakPolarHBondContact CB-O 3.38Å; F860-N890 HydrophobicContact CD1-CB 4.1Å; F860-N890 HydrophobicContact CE1-CB 3.5Å; F860-N890 VanDerWaalsContact CE1-CB 3.5Å; F860-N890 HydrophobicContact CZ-CB 3.84Å; F860-N890 PolarHBondContact N-O 2.74Å; F860-N890 VanDerWaalsContact O-O 3.07Å
891	P	86.6	Confident	81.7	Confident	36 Å²	36	47.1 Å²	47.1	23%	0.234	27%	0.266	C	S	.	.	S	Bend	cis	-64	171.1	-4	29.5	-35.6	0	0	0	112.7	A889 N947 S948	A889-P891 CarbonylContact C-O 3.44Å; A889-P891 VanDerWaalsContact C-O 3.27Å; A889-P891 WeakPolarHBondContact CB-O 3.31Å; P891-N947 PolarHBondContact O-ND2 2.87Å; P891-S948 WeakPolarHBondContact CG-OG 3.41Å
892	P	83	Confident	81.5	Confident	99 Å²	99	51.8 Å²	51.8	64%	0.643	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-51.8	160.3	176.1	-28.9	36.7	0	0	0	114.4	T894 N947	P892-T894 PolarHBondContact O-N 2.81Å; P892-N947 WeakPolarHBondContact O-CB 3.48Å
893	V	81.6	Confident	81.6	Confident	36 Å²	36	54.5 Å²	54.5	22%	0.218	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-63.2	130.9	179.9	179.5	0	0	0	0	110.3	P862 L887 A889 S895 V896 V945 S946	P862-V893 HydrophobicContact CB-CG2 4.15Å; P862-V893 HydrophobicContact CG-CG2 4.1Å; L887-V893 HydrophobicContact CB-CG2 4.43Å; L887-V893 HydrophobicContact CD1-CG2 4.25Å; A889-V893 HydrophobicContact CB-CG2 3.91Å; V893-S895 VanDerWaalsContact CG1-O 3.3Å; V893-S895 WeakPolarHBondContact CG1-O 3.16Å; V893-V896 HydrophobicContact CG1-CG2 4Å; V893-V945 HydrophobicContact CG1-CB 4.24Å; V893-V945 HydrophobicContact CG1-CG1 4.36Å; V893-S946 CarbonylContact C-O 3.6Å; V893-S946 WeakPolarHBondContact CA-O 3.42Å; V893-S946 WeakPolarHBondContact CG1-O 3.35Å
894	T	82.9	Confident	82	Confident	96 Å²	96	59 Å²	59	59%	0.589	33%	0.325	S	S	*	.	S	Bend	trans	-99.3	-18.9	-179.6	50.4	0	0	0	0	113.6	P892 S946 N947	P892-T894 PolarHBondContact O-N 2.81Å; T894-S946 PolarHBondContact N-O 2.85Å; T894-S946 PolarHBondContact OG1-O 3.5Å; T894-S946 PolarHBondContact OG1-OG 2.89Å; T894-N947 WeakPolarHBondContact OG1-CA 3.36Å
895	S	84.3	Confident	82.7	Confident	48 Å²	48	55.9 Å²	55.9	34%	0.336	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	143.2	171	69.5	0	0	0	0	111.2	V893 V945 S946	V893-S895 VanDerWaalsContact CG1-O 3.3Å; V893-S895 WeakPolarHBondContact CG1-O 3.16Å; S895-V945 WeakPolarHBondContact O-CA 3.39Å; S895-S946 PolarHBondContact O-N 2.02Å; S895-S946 PolarHBondContact OG-OG 2.78Å
896	V	87	Confident	83.4	Confident	16 Å²	16	59.1 Å²	59.1	10%	0.097	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	146.9	160.1	-167.5	0	0	0	0	108.1	L887 V893 V924 G925 E926 V943 I944 V945	L887-V896 HydrophobicContact CD1-CG2 4.31Å; V893-V896 HydrophobicContact CG1-CG2 4Å; V896-V924 WeakPolarHBondContact CB-O 3.46Å; V896-V924 HydrophobicContact CG2-CG2 3.78Å; V896-G925 VanDerWaalsContact CG1-O 3.28Å; V896-G925 WeakPolarHBondContact CG1-O 3.5Å; V896-E926 HydrophobicContact CG2-CB 4.04Å; V896-V943 HydrophobicContact CG1-CG2 3.68Å; V896-I944 CarbonylContact C-O 3.59Å; V896-I944 WeakPolarHBondContact CA-O 3.36Å; V896-V945 HydrophobicContact CB-CG1 4.24Å; V896-V945 HydrophobicContact CG1-CG1 3.81Å; V896-V945 HydrophobicContact CG2-CG1 3.98Å
897	S	87.1	Confident	84.2	Confident	32 Å²	32	63.6 Å²	63.6	22%	0.224	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	134.5	171.2	46.8	0	0	0	0	110.1	I944	S897-I944 PolarHBondContact N-O 2.88Å; S897-I944 PolarHBondContact O-N 3.14Å; S897-I944 PolarHBondContact OG-O 2.7Å
898	W	89	Confident	84.3	Confident	3 Å²	3	64.1 Å²	64.1	1%	0.011	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	134.5	-176	-79.2	101.2	0	0	0	110.7	F885 L904 L905 A920 G925 L928 V943 F956	F885-W898 AromaticContact CD2-CH2 3.68Å; F885-W898 HydrophobicContact CD2-CH2 3.68Å; F885-W898 AromaticContact CD2-CZ2 3.81Å; F885-W898 HydrophobicContact CD2-CZ2 3.81Å; F885-W898 HydrophobicContact CE1-CH2 4.49Å; F885-W898 AromaticContact CE2-CH2 3.39Å; F885-W898 HydrophobicContact CE2-CH2 3.39Å; F885-W898 AromaticContact CE2-CZ2 3.85Å; F885-W898 HydrophobicContact CE2-CZ2 3.85Å; F885-W898 HydrophobicContact CE2-CZ3 4.49Å; F885-W898 HydrophobicContact CG-CH2 4.39Å; F885-W898 AromaticContact CZ-CH2 3.85Å; F885-W898 HydrophobicContact CZ-CH2 3.85Å; W898-L904 CarbonylContact O-C 3.47Å; W898-L904 WeakPolarHBondContact O-CA 3.36Å; W898-L904 WeakPolarHBondContact O-CD1 3.31Å; W898-L905 HydrophobicContact CB-CB 4.16Å; W898-L905 HydrophobicContact CB-CD1 4.02Å; W898-L905 HydrophobicContact CB-CG 4.31Å; W898-L905 PolarHBondContact O-N 3.08Å; W898-A920 HydrophobicContact CG-CB 4.47Å; W898-G925 PolarHBondContact NE1-O 2.85Å; W898-L928 HydrophobicContact CD2-CB 4.48Å; W898-L928 HydrophobicContact CD2-CD1 3.72Å; W898-L928 HydrophobicContact CE3-CD1 3.84Å; W898-L928 HydrophobicContact CE3-CD2 4.29Å; W898-L928 HydrophobicContact CG-CD1 4.03Å; W898-L928 HydrophobicContact CH2-CB 4.06Å; W898-L928 HydrophobicContact CH2-CD2 4.3Å; W898-L928 HydrophobicContact CZ2-CB 3.84Å; W898-L928 HydrophobicContact CZ3-CB 4.45Å; W898-L928 HydrophobicContact CZ3-CD1 4.32Å; W898-L928 HydrophobicContact CZ3-CD2 4.01Å; W898-V943 HydrophobicContact CD2-CB 3.96Å; W898-V943 HydrophobicContact CD2-CG2 4.13Å; W898-V943 HydrophobicContact CE3-CB 3.76Å; W898-V943 HydrophobicContact CE3-CG2 4.44Å; W898-V943 HydrophobicContact CH2-CB 3.62Å; W898-V943 HydrophobicContact CH2-CG1 3.97Å; W898-V943 HydrophobicContact CH2-CG2 4.19Å; W898-V943 HydrophobicContact CZ2-CB 3.83Å; W898-V943 HydrophobicContact CZ2-CG1 4.43Å; W898-V943 HydrophobicContact CZ2-CG2 3.87Å; W898-V943 HydrophobicContact CZ3-CB 3.6Å; W898-V943 HydrophobicContact CZ3-CG1 4.18Å; W898-V943 HydrophobicContact CZ3-CG2 4.47Å; W898-F956 HydrophobicContact CH2-CE1 4.15Å; W898-F956 AromaticContact CZ3-CE1 3.85Å; W898-F956 HydrophobicContact CZ3-CE1 3.85Å
899	F	88.3	Confident	83.9	Confident	46 Å²	46	64.4 Å²	64.4	20%	0.202	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	142.3	-179.3	-61.3	-100.1	0	0	0	110.3	Q903 L904 Y941 T942 I944	F899-Q903 CarbonylContact C-O 3.58Å; F899-Q903 WeakPolarHBondContact CA-O 3.41Å; F899-L904 HydrophobicContact CD1-CB 4.32Å; F899-L904 HydrophobicContact CD1-CD1 4.34Å; F899-L904 HydrophobicContact CD2-CD1 4.47Å; F899-L904 HydrophobicContact CE1-CB 4.15Å; F899-L904 HydrophobicContact CE1-CD1 3.85Å; F899-L904 HydrophobicContact CE2-CD1 3.96Å; F899-L904 HydrophobicContact CZ-CD1 3.64Å; F899-Y941 CarbonylContact O-C 3.53Å; F899-Y941 VanDerWaalsContact O-CA 3.31Å; F899-Y941 WeakPolarHBondContact O-CA 3.41Å; F899-T942 PolarHBondContact N-O 2.95Å; F899-T942 PolarHBondContact O-N 2.9Å; F899-I944 HydrophobicContact CD2-CD1 3.97Å; F899-I944 HydrophobicContact CD2-CG1 4.24Å; F899-I944 HydrophobicContact CE2-CB 4.42Å; F899-I944 HydrophobicContact CE2-CD1 3.5Å; F899-I944 HydrophobicContact CE2-CG1 4.03Å; F899-I944 HydrophobicContact CZ-CD1 4.15Å
900	R	87.8	Confident	83	Confident	64 Å²	64	73.4 Å²	73.4	24%	0.242	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	119	167.8	-176	-168.9	-177.7	-151.7	-8.7	107.9	D902 Q903 L905 E936 N937 M938 N940 Y941	R900-D902 VanDerWaalsContact C-N 3.29Å; R900-D902 PolarHBondContact O-N 2.77Å; R900-Q903 PolarHBondContact N-O 3.3Å; R900-Q903 WeakPolarHBondContact O-CB 3.41Å; R900-Q903 PolarHBondContact O-N 3.21Å; R900-L905 HydrophobicContact CB-CD2 3.8Å; R900-L905 HydrophobicContact CB-CG 4.37Å; R900-E936 PolarHBondContact NH1-O 3.47Å; R900-E936 PolarHBondContact NH2-O 2.99Å; R900-N937 VanDerWaalsContact NH2-C 3.29Å; R900-N937 PolarHBondContact NH2-O 3.4Å; R900-M938 PolarHBondContact NH2-O 3.38Å; R900-N940 WeakPolarHBondContact CA-O 3.21Å; R900-Y941 HydrophobicContact CB-CD1 4.13Å; R900-Y941 HydrophobicContact CB-CE1 3.91Å; R900-Y941 VanDerWaalsContact CD-OH 3.3Å; R900-Y941 WeakPolarHBondContact CD-OH 3.3Å; R900-Y941 HydrophobicContact CG-CD1 4.33Å; R900-Y941 HydrophobicContact CG-CE1 3.87Å; R900-Y941 HydrophobicContact CG-CE2 4.13Å; R900-Y941 PolarHBondContact NE-OH 3.05Å
901	N	74.3	Confident	82	Confident	103 Å²	103	80 Å²	80	55%	0.551	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.4	51.9	-175	-56.1	-19.7	0	0	0	112.3	Q903 N940	N901-Q903 PolarHBondContact O-N 2.95Å; N901-N940 PolarHBondContact N-O 3.15Å
902	D	76	Confident	80.8	Confident	142 Å²	142	82.5 Å²	82.5	76%	0.759	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	2.2	-176.1	-57.1	-45	0	0	0	117.3	R900	R900-D902 VanDerWaalsContact C-N 3.29Å; R900-D902 PolarHBondContact O-N 2.77Å
903	Q	84.1	Confident	79.5	Confident	152 Å²	152	84.5 Å²	84.5	71%	0.71	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	131	171.1	-61.1	-175.2	-7.3	0	0	111	F899 R900 N901 L905	F899-Q903 CarbonylContact C-O 3.58Å; F899-Q903 WeakPolarHBondContact CA-O 3.41Å; R900-Q903 PolarHBondContact N-O 3.3Å; R900-Q903 WeakPolarHBondContact O-CB 3.41Å; R900-Q903 PolarHBondContact O-N 3.21Å; N901-Q903 PolarHBondContact O-N 2.95Å; Q903-L905 PolarHBondContact O-N 2.97Å
904	L	88	Confident	78.4	Confident	114 Å²	114	88.4 Å²	88.4	60%	0.597	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.4	131.2	177.5	-171.7	79.2	0	0	0	110.8	W898 F899	W898-L904 CarbonylContact O-C 3.47Å; W898-L904 WeakPolarHBondContact O-CA 3.36Å; W898-L904 WeakPolarHBondContact O-CD1 3.31Å; F899-L904 HydrophobicContact CD1-CB 4.32Å; F899-L904 HydrophobicContact CD1-CD1 4.34Å; F899-L904 HydrophobicContact CD2-CD1 4.47Å; F899-L904 HydrophobicContact CE1-CB 4.15Å; F899-L904 HydrophobicContact CE1-CD1 3.85Å; F899-L904 HydrophobicContact CE2-CD1 3.96Å; F899-L904 HydrophobicContact CZ-CD1 3.64Å
905	L	87.3	Confident	77.6	Confident	21 Å²	21	86.2 Å²	86.2	11%	0.11	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-75	145.4	174.3	-68.2	-175.4	0	0	0	111.9	W898 R900 Q903 V918 L928 Y941	W898-L905 HydrophobicContact CB-CB 4.16Å; W898-L905 HydrophobicContact CB-CD1 4.02Å; W898-L905 HydrophobicContact CB-CG 4.31Å; W898-L905 PolarHBondContact O-N 3.08Å; R900-L905 HydrophobicContact CB-CD2 3.8Å; R900-L905 HydrophobicContact CB-CG 4.37Å; Q903-L905 PolarHBondContact O-N 2.97Å; L905-V918 HydrophobicContact CD1-CG1 3.93Å; L905-L928 HydrophobicContact CD1-CD1 3.71Å; L905-Y941 HydrophobicContact CD1-CD1 3.9Å; L905-Y941 HydrophobicContact CD1-CE1 3.84Å; L905-Y941 HydrophobicContact CD2-CE1 4.43Å
906	P	85.3	Confident	77.4	Confident	75 Å²	75	90.4 Å²	90.4	49%	0.487	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-68.7	155	171.2	30.5	-34.7	0	0	0	111.5	F919 A920	P906-F919 HydrophobicContact CB-CD1 4.49Å; P906-F919 HydrophobicContact CG-CD1 3.86Å; P906-F919 HydrophobicContact CG-CE1 4.1Å; P906-F919 WeakPolarHBondContact O-CA 3.24Å; P906-A920 PolarHBondContact O-N 3.43Å
907	F	84.2	Confident	77.4	Confident	115 Å²	115	90 Å²	90	50%	0.504	46%	0.458	S	S	.	.	B	Isolated β-bridge	trans	-71.7	153.5	163.2	-88.2	-95.9	0	0	0	111	A920	F907-A920 CarbonylContact C-O 3.52Å; F907-A920 VanDerWaalsContact CA-O 3.27Å; F907-A920 WeakPolarHBondContact CA-O 3.4Å; F907-A920 HydrophobicContact CD1-CB 4.22Å; F907-A920 WeakPolarHBondContact CD1-O 3.32Å; F907-A920 HydrophobicContact CD2-CB 4.34Å; F907-A920 HydrophobicContact CE1-CB 4.26Å; F907-A920 HydrophobicContact CE2-CB 4.37Å; F907-A920 HydrophobicContact CG-CB 4.27Å; F907-A920 HydrophobicContact CZ-CB 4.34Å
908	E	77.1	Confident	77.5	Confident	56 Å²	56	89.1 Å²	89.1	26%	0.262	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-54.8	121.3	178	-166.5	165.6	-118	0	0	111.8	W915 F919 A920 A921 S929 H931	E908-W915 HydrophobicContact CG-CH2 3.83Å; E908-W915 HydrophobicContact CG-CZ2 4.22Å; E908-W915 HydrophobicContact CG-CZ3 4Å; E908-F919 HydrophobicContact CB-CB 4.18Å; E908-A920 PolarHBondContact N-O 3.18Å; E908-A921 HydrophobicContact CB-CB 4.41Å; E908-S929 VanDerWaalsContact OE1-CB 3.23Å; E908-S929 WeakPolarHBondContact OE1-CB 3.21Å; E908-S929 PolarHBondContact OE1-OG 2.93Å; E908-H931 VanDerWaalsContact CG-NE2 3.27Å; E908-H931 WeakPolarHBondContact CG-NE2 3.44Å; E908-H931 IonicContact OE1-CD2 2.74Å; E908-H931 IonicContact OE1-CE1 3.76Å; E908-H931 PolarHBondContact OE1-CE1 3.08Å; E908-H931 CovalentContact OE1-NE2 1.8Å; E908-H931 IonicContact OE1-NE2 2.67Å; E908-H931 PolarHBondContact OE1-NE2 2.81Å; E908-H931 IonicContact OE2-NE2 3.03Å
909	P	74.3	Confident	77.5	Confident	54 Å²	54	90.3 Å²	90.3	35%	0.351	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-74.9	156.7	-175.5	29.7	-34	0	0	0	111.9	W915 F919	P909-W915 WeakPolarHBondContact O-CZ2 3.4Å; P909-W915 PolarHBondContact O-NE1 3.05Å; P909-F919 HydrophobicContact CG-CE1 4.23Å
910	K	67.4	Low	77.4	Confident	207 Å²	207	88.3 Å²	88.3	90%	0.9	45%	0.448	S	S	*	.	S	Bend	trans	-80.6	-17.4	-171.9	-68.5	-172.4	177.2	-176.8	0	116.2
911	E	66.9	Low	77.2	Confident	165 Å²	165	85.3 Å²	85.3	77%	0.771	44%	0.437	S	S	*	.			trans	-104.3	117.8	-174.6	-66.1	178.1	171.5	0	0	109.9	D913 W915	E911-D913 PolarHBondContact O-N 2.71Å; E911-W915 PolarHBondContact O-NE1 2.83Å
912	T	61.5	Low	77.3	Confident	88 Å²	88	82 Å²	82	54%	0.54	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-70.3	-25.8	-161.3	42.5	0	0	0	0	116.4	T914 W915	T912-T914 VanDerWaalsContact C-N 3.29Å; T912-T914 PolarHBondContact O-N 2.65Å; T912-W915 HydrophobicContact CG2-CZ2 4.14Å; T912-W915 PolarHBondContact O-N 3.34Å
913	D	55	Low	77.2	Confident	142 Å²	142	77.7 Å²	77.7	76%	0.759	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-81.1	-10.7	-153.9	-67.8	7.4	0	0	0	113.9	E911	E911-D913 PolarHBondContact O-N 2.71Å
914	T	59.3	Low	76.6	Confident	117 Å²	117	73.2 Å²	73.2	72%	0.718	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-111.2	8.8	-178.4	59	0	0	0	0	114.3	T912 Q916	T912-T914 VanDerWaalsContact C-N 3.29Å; T912-T914 PolarHBondContact O-N 2.65Å; T914-Q916 PolarHBondContact O-N 3.42Å; T914-Q916 VanDerWaalsContact O-N 3.08Å
915	W	66.4	Low	76	Confident	50 Å²	50	67.8 Å²	67.8	19%	0.189	36%	0.363	C	S	.	.			trans	-67.3	111.5	-171.3	-67.4	15.1	0	0	0	112.6	E908 P909 E911 T912 H931 K932	E908-W915 HydrophobicContact CG-CH2 3.83Å; E908-W915 HydrophobicContact CG-CZ2 4.22Å; E908-W915 HydrophobicContact CG-CZ3 4Å; P909-W915 WeakPolarHBondContact O-CZ2 3.4Å; P909-W915 PolarHBondContact O-NE1 3.05Å; E911-W915 PolarHBondContact O-NE1 2.83Å; T912-W915 HydrophobicContact CG2-CZ2 4.14Å; T912-W915 PolarHBondContact O-N 3.34Å; W915-H931 HydrophobicContact CB-CB 4.03Å; W915-H931 AromaticContact CE3-CD2 3.58Å; W915-H931 AromaticContact CE3-CE1 3.76Å; W915-H931 AromaticContact CE3-CG 3.93Å; W915-H931 AromaticContact CE3-ND1 3.82Å; W915-H931 AromaticContact CE3-NE2 3.4Å; W915-H931 AromaticContact CZ3-CE1 3.65Å; W915-H931 AromaticContact CZ3-NE2 3.4Å; W915-H931 WeakPolarHBondContact CZ3-NE2 3.34Å; W915-K932 WeakPolarHBondContact O-CD 3.42Å
916	Q	79.8	Confident	75.6	Confident	136 Å²	136	68.7 Å²	68.7	64%	0.636	37%	0.366	S	S	*	.			trans	-145.8	139.6	170.2	-67.3	-172.1	-27.6	0	0	108.8	T914 F919 H931 K932	T914-Q916 PolarHBondContact O-N 3.42Å; T914-Q916 VanDerWaalsContact O-N 3.08Å; Q916-F919 WeakPolarHBondContact O-CE2 3.34Å; Q916-F919 WeakPolarHBondContact O-CZ 3.34Å; Q916-H931 CarbonylContact C-O 3.46Å; Q916-H931 WeakPolarHBondContact CA-O 3.38Å; Q916-K932 HydrophobicContact CG-CB 4.2Å; Q916-K932 HydrophobicContact CG-CD 4.21Å
917	G	85.6	Confident	75.5	Confident	9 Å²	9	67.4 Å²	67.4	9%	0.093	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	104.2	-160.7	178.5	0	0	0	0	0	114.4	H931 I933	G917-H931 PolarHBondContact N-O 3.41Å; G917-H931 PolarHBondContact O-N 2.83Å; G917-I933 VanDerWaalsContact O-CD1 3.29Å; G917-I933 WeakPolarHBondContact O-CD1 2.98Å
918	V	89	Confident	75.6	Confident	13 Å²	13	61.9 Å²	61.9	8%	0.079	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	131.4	-171.6	-173.7	0	0	0	0	111	L905 L928 S929 L930 I933 N937 Y941 L958	L905-V918 HydrophobicContact CD1-CG1 3.93Å; V918-L928 HydrophobicContact CG1-CD1 3.48Å; V918-L928 VanDerWaalsContact CG1-CD1 3.48Å; V918-L928 HydrophobicContact CG1-CD2 3.94Å; V918-L928 HydrophobicContact CG1-CG 3.62Å; V918-S929 WeakPolarHBondContact CA-O 3.43Å; V918-L930 HydrophobicContact CG1-CD2 4.5Å; V918-L930 HydrophobicContact CG1-CG 4.25Å; V918-L930 HydrophobicContact CG2-CD2 3.91Å; V918-L930 HydrophobicContact CG2-CG 4.22Å; V918-I933 HydrophobicContact CG2-CD1 3.57Å; V918-N937 HydrophobicContact CG2-CB 4.35Å; V918-Y941 HydrophobicContact CB-CE1 3.95Å; V918-Y941 HydrophobicContact CG1-CD1 4.31Å; V918-Y941 HydrophobicContact CG1-CE1 3.66Å; V918-Y941 HydrophobicContact CG2-CE1 4.2Å; V918-Y941 WeakPolarHBondContact CG2-OH 3.23Å; V918-L958 HydrophobicContact CG2-CD2 4.25Å
919	F	89.2	Confident	76.1	Confident	28 Å²	28	59.2 Å²	59.2	12%	0.123	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	150.4	-171.1	-56.9	-93.4	0	0	0	111.6	P906 E908 P909 Q916 S929 H931	P906-F919 HydrophobicContact CB-CD1 4.49Å; P906-F919 HydrophobicContact CG-CD1 3.86Å; P906-F919 HydrophobicContact CG-CE1 4.1Å; P906-F919 WeakPolarHBondContact O-CA 3.24Å; E908-F919 HydrophobicContact CB-CB 4.18Å; P909-F919 HydrophobicContact CG-CE1 4.23Å; Q916-F919 WeakPolarHBondContact O-CE2 3.34Å; Q916-F919 WeakPolarHBondContact O-CZ 3.34Å; F919-S929 PolarHBondContact N-O 2.95Å; F919-S929 PolarHBondContact O-N 3.43Å; F919-H931 AromaticContact CD2-CD2 3.77Å
920	A	88.1	Confident	76.8	Confident	3 Å²	3	56.7 Å²	56.7	3%	0.025	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	134	163.6	0	0	0	0	0	109.5	W898 P906 F907 E908	W898-A920 HydrophobicContact CG-CB 4.47Å; P906-A920 PolarHBondContact O-N 3.43Å; F907-A920 CarbonylContact C-O 3.52Å; F907-A920 VanDerWaalsContact CA-O 3.27Å; F907-A920 WeakPolarHBondContact CA-O 3.4Å; F907-A920 HydrophobicContact CD1-CB 4.22Å; F907-A920 WeakPolarHBondContact CD1-O 3.32Å; F907-A920 HydrophobicContact CD2-CB 4.34Å; F907-A920 HydrophobicContact CE1-CB 4.26Å; F907-A920 HydrophobicContact CE2-CB 4.37Å; F907-A920 HydrophobicContact CG-CB 4.27Å; F907-A920 HydrophobicContact CZ-CB 4.34Å; E908-A920 PolarHBondContact N-O 3.18Å
921	A	83.3	Confident	77.7	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.008	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	151.8	-171.4	0	0	0	0	0	114.5	E908 G925 L927 S929 Y1503	E908-A921 HydrophobicContact CB-CB 4.41Å; A921-G925 VanDerWaalsContact O-CA 3.32Å; A921-G925 WeakPolarHBondContact O-CA 3.34Å; A921-L927 HydrophobicContact CB-CB 4.19Å; A921-L927 PolarHBondContact N-O 3.24Å; A921-S929 VanDerWaalsContact CB-CB 3.47Å; A921-Y1503 PolarHBondContact O-OH 2.87Å
922	G	75.3	Confident	78.5	Confident	34 Å²	34	44.7 Å²	44.7	35%	0.351	25%	0.247	S	C	.	.	S	Bend	trans	75.4	164.9	-177.7	0	0	0	0	0	115.5	V924 G925 Y1503	G922-V924 PolarHBondContact O-N 3.22Å; G922-G925 PolarHBondContact O-N 2.96Å; G922-Y1503 WeakPolarHBondContact CA-OH 3.12Å; G922-Y1503 PolarHBondContact O-OH 3.43Å
923	S	73.3	Confident	79.7	Confident	51 Å²	51	40.5 Å²	40.5	36%	0.357	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	19.5	-77.5	152	39.2	0	0	0	0	117.1	E926 Y1503	S923-E926 PolarHBondContact OG-OE1 3.09Å; S923-Y1503 VanDerWaalsContact C-CE2 3.46Å; S923-Y1503 VanDerWaalsContact C-CZ 3.48Å; S923-Y1503 WeakPolarHBondContact CA-OH 3.5Å; S923-Y1503 WeakPolarHBondContact CB-OH 3.13Å; S923-Y1503 PolarHBondContact N-OH 2.91Å; S923-Y1503 WeakPolarHBondContact OG-CD1 3.39Å; S923-Y1503 WeakPolarHBondContact OG-CD2 3.42Å; S923-Y1503 WeakPolarHBondContact OG-CE1 3.41Å; S923-Y1503 WeakPolarHBondContact OG-CE2 3.19Å; S923-Y1503 PolarHBondContact OG-OH 3.1Å
924	V	73.1	Confident	81.4	Confident	59 Å²	59	36.1 Å²	36.1	36%	0.358	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.8	6.5	175.5	-54	0	0	0	0	114	V896 G922 Y1503	V896-V924 WeakPolarHBondContact CB-O 3.46Å; V896-V924 HydrophobicContact CG2-CG2 3.78Å; G922-V924 PolarHBondContact O-N 3.22Å; V924-Y1503 HydrophobicContact CB-CE2 4.3Å; V924-Y1503 HydrophobicContact CG1-CE2 4.28Å; V924-Y1503 HydrophobicContact CG2-CE2 3.92Å; V924-Y1503 VanDerWaalsContact N-CZ 3.29Å; V924-Y1503 PolarHBondContact N-OH 2.81Å
925	G	74.3	Confident	82.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.179	C	C	.	.	S	Bend	trans	92.6	20.1	176.5	0	0	0	0	0	116.6	V896 W898 A921 G922 L927	V896-G925 VanDerWaalsContact CG1-O 3.28Å; V896-G925 WeakPolarHBondContact CG1-O 3.5Å; W898-G925 PolarHBondContact NE1-O 2.85Å; A921-G925 VanDerWaalsContact O-CA 3.32Å; A921-G925 WeakPolarHBondContact O-CA 3.34Å; G922-G925 PolarHBondContact O-N 2.96Å; G925-L927 PolarHBondContact O-N 2.64Å
926	E	79.1	Confident	83.8	Confident	40 Å²	40	38.9 Å²	38.9	19%	0.187	20%	0.202	C	C	.	.			trans	-67.1	-21.4	176.8	70.9	-81.8	-165.2	0	0	114.4	L887 V896 S923 Y1503	L887-E926 HydrophobicContact CD1-CB 3.55Å; L887-E926 HydrophobicContact CG-CB 4.49Å; V896-E926 HydrophobicContact CG2-CB 4.04Å; S923-E926 PolarHBondContact OG-OE1 3.09Å; E926-Y1503 VanDerWaalsContact CD-CE2 3.43Å; E926-Y1503 VanDerWaalsContact CD-CZ 3.44Å; E926-Y1503 WeakPolarHBondContact OE1-CE2 3.37Å; E926-Y1503 PolarHBondContact OE1-OH 2.98Å; E926-Y1503 WeakPolarHBondContact OE2-CE2 3.36Å; E926-Y1503 PolarHBondContact OE2-OH 3.23Å
927	L	83.1	Confident	84.2	Confident	47 Å²	47	33.4 Å²	33.4	25%	0.246	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	136.6	174.6	-56.6	-179	0	0	0	110.2	D884 A921 G925	D884-L927 HydrophobicContact CB-CD2 3.78Å; A921-L927 HydrophobicContact CB-CB 4.19Å; A921-L927 PolarHBondContact N-O 3.24Å; G925-L927 PolarHBondContact O-N 2.64Å
928	L	87.3	Confident	84.4	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	113.2	163.2	-167.9	68.8	0	0	0	108	H882 L883 F885 W898 L905 V918 L930 Y941 F956	H882-L928 WeakPolarHBondContact CA-O 3.49Å; L883-L928 HydrophobicContact CB-CB 4.35Å; L883-L928 PolarHBondContact N-O 2.97Å; L883-L928 PolarHBondContact O-N 3.26Å; L883-L928 VanDerWaalsContact O-N 3.14Å; F885-L928 HydrophobicContact CE2-CB 4.46Å; W898-L928 HydrophobicContact CD2-CB 4.48Å; W898-L928 HydrophobicContact CD2-CD1 3.72Å; W898-L928 HydrophobicContact CE3-CD1 3.84Å; W898-L928 HydrophobicContact CE3-CD2 4.29Å; W898-L928 HydrophobicContact CG-CD1 4.03Å; W898-L928 HydrophobicContact CH2-CB 4.06Å; W898-L928 HydrophobicContact CH2-CD2 4.3Å; W898-L928 HydrophobicContact CZ2-CB 3.84Å; W898-L928 HydrophobicContact CZ3-CB 4.45Å; W898-L928 HydrophobicContact CZ3-CD1 4.32Å; W898-L928 HydrophobicContact CZ3-CD2 4.01Å; L905-L928 HydrophobicContact CD1-CD1 3.71Å; V918-L928 HydrophobicContact CG1-CD1 3.48Å; V918-L928 VanDerWaalsContact CG1-CD1 3.48Å; V918-L928 HydrophobicContact CG1-CD2 3.94Å; V918-L928 HydrophobicContact CG1-CG 3.62Å; L928-L930 HydrophobicContact CG-CD1 4.38Å; L928-L930 WeakPolarHBondContact O-CD1 3.44Å; L928-Y941 HydrophobicContact CD2-CD1 4.2Å; L928-F956 HydrophobicContact CD2-CE1 4.37Å; L928-F956 HydrophobicContact CD2-CZ 3.79Å
929	S	86.7	Confident	84.3	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	135.6	179.2	-169.9	0	0	0	0	110.3	H882 E908 V918 F919 A921 H931	H882-S929 PolarHBondContact NE2-OG 2.99Å; E908-S929 VanDerWaalsContact OE1-CB 3.23Å; E908-S929 WeakPolarHBondContact OE1-CB 3.21Å; E908-S929 PolarHBondContact OE1-OG 2.93Å; V918-S929 WeakPolarHBondContact CA-O 3.43Å; F919-S929 PolarHBondContact N-O 2.95Å; F919-S929 PolarHBondContact O-N 3.43Å; A921-S929 VanDerWaalsContact CB-CB 3.47Å; S929-H931 PolarHBondContact OG-CE1 3.11Å; S929-H931 PolarHBondContact OG-NE2 2.77Å
930	L	88.8	Confident	84.2	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	118.4	-172.2	-69.1	108.1	0	0	0	109	I875 T880 T881 L883 V918 L928 I933 L958	I875-L930 HydrophobicContact CD1-CD1 4.21Å; I875-L930 HydrophobicContact CD1-CD2 3.75Å; T880-L930 CarbonylContact C-O 3.59Å; T880-L930 WeakPolarHBondContact CA-O 3.27Å; T881-L930 HydrophobicContact CG2-CB 4.27Å; T881-L930 HydrophobicContact CG2-CD1 4.16Å; T881-L930 PolarHBondContact N-O 3.14Å; T881-L930 WeakPolarHBondContact O-CB 3.38Å; T881-L930 PolarHBondContact O-N 3.2Å; L883-L930 HydrophobicContact CD1-CD1 3.87Å; L883-L930 HydrophobicContact CG-CD1 3.75Å; V918-L930 HydrophobicContact CG1-CD2 4.5Å; V918-L930 HydrophobicContact CG1-CG 4.25Å; V918-L930 HydrophobicContact CG2-CD2 3.91Å; V918-L930 HydrophobicContact CG2-CG 4.22Å; L928-L930 HydrophobicContact CG-CD1 4.38Å; L928-L930 WeakPolarHBondContact O-CD1 3.44Å; L930-I933 HydrophobicContact CB-CD1 3.74Å; L930-I933 HydrophobicContact CB-CG1 3.7Å; L930-I933 HydrophobicContact CD2-CD1 3.89Å; L930-I933 HydrophobicContact CD2-CG1 3.89Å; L930-I933 HydrophobicContact CG-CD1 4.22Å; L930-I933 HydrophobicContact CG-CG1 4.38Å; L930-L958 HydrophobicContact CD2-CD1 4.22Å; L930-L958 HydrophobicContact CD2-CD2 3.73Å
931	H	86.2	Confident	84.2	Confident	16 Å²	16	36.2 Å²	36.2	7%	0.074	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	124.8	-176.9	-61.1	-56.9	0	0	0	111.4	T880 H882 E908 W915 Q916 G917 F919 S929 I933	T880-H931 WeakPolarHBondContact CG2-ND1 3.41Å; H882-H931 AromaticContact CE1-CE1 3.56Å; H882-H931 AromaticContact NE2-CE1 3.86Å; E908-H931 VanDerWaalsContact CG-NE2 3.27Å; E908-H931 WeakPolarHBondContact CG-NE2 3.44Å; E908-H931 IonicContact OE1-CD2 2.74Å; E908-H931 IonicContact OE1-CE1 3.76Å; E908-H931 PolarHBondContact OE1-CE1 3.08Å; E908-H931 CovalentContact OE1-NE2 1.8Å; E908-H931 IonicContact OE1-NE2 2.67Å; E908-H931 PolarHBondContact OE1-NE2 2.81Å; E908-H931 IonicContact OE2-NE2 3.03Å; W915-H931 HydrophobicContact CB-CB 4.03Å; W915-H931 AromaticContact CE3-CD2 3.58Å; W915-H931 AromaticContact CE3-CE1 3.76Å; W915-H931 AromaticContact CE3-CG 3.93Å; W915-H931 AromaticContact CE3-ND1 3.82Å; W915-H931 AromaticContact CE3-NE2 3.4Å; W915-H931 AromaticContact CZ3-CE1 3.65Å; W915-H931 AromaticContact CZ3-NE2 3.4Å; W915-H931 WeakPolarHBondContact CZ3-NE2 3.34Å; Q916-H931 CarbonylContact C-O 3.46Å; Q916-H931 WeakPolarHBondContact CA-O 3.38Å; G917-H931 PolarHBondContact N-O 3.41Å; G917-H931 PolarHBondContact O-N 2.83Å; F919-H931 AromaticContact CD2-CD2 3.77Å; S929-H931 PolarHBondContact OG-CE1 3.11Å; S929-H931 PolarHBondContact OG-NE2 2.77Å; H931-I933 VanDerWaalsContact C-N 3.27Å; H931-I933 PolarHBondContact O-N 3.13Å
932	K	84	Confident	84.5	Confident	104 Å²	104	37 Å²	37	45%	0.452	20%	0.196	S	C	.	.	S	Bend	trans	43.4	50.8	175.4	-59.6	174.6	-168.6	147.7	0	112.8	E879 T880 W915 Q916	E879-K932 WeakPolarHBondContact O-CA 3.49Å; E879-K932 PolarHBondContact O-N 2.72Å; E879-K932 VanDerWaalsContact O-N 3.15Å; T880-K932 PolarHBondContact OG1-N 3.41Å; W915-K932 WeakPolarHBondContact O-CD 3.42Å; Q916-K932 HydrophobicContact CG-CB 4.2Å; Q916-K932 HydrophobicContact CG-CD 4.21Å
933	I	87.6	Confident	85	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.18	C	C	.	.			trans	-60.6	134.1	-166.4	-65.7	-57	0	0	0	112.5	E877 G878 E879 G917 V918 L930 H931 N937 V960	E877-I933 CarbonylContact C-O 3.56Å; E877-I933 WeakPolarHBondContact CA-O 3.47Å; G878-I933 PolarHBondContact N-O 2.84Å; E879-I933 PolarHBondContact O-N 2.69Å; E879-I933 VanDerWaalsContact O-N 3.11Å; G917-I933 VanDerWaalsContact O-CD1 3.29Å; G917-I933 WeakPolarHBondContact O-CD1 2.98Å; V918-I933 HydrophobicContact CG2-CD1 3.57Å; L930-I933 HydrophobicContact CB-CD1 3.74Å; L930-I933 HydrophobicContact CB-CG1 3.7Å; L930-I933 HydrophobicContact CD2-CD1 3.89Å; L930-I933 HydrophobicContact CD2-CG1 3.89Å; L930-I933 HydrophobicContact CG-CD1 4.22Å; L930-I933 HydrophobicContact CG-CG1 4.38Å; H931-I933 VanDerWaalsContact C-N 3.27Å; H931-I933 PolarHBondContact O-N 3.13Å; I933-N937 WeakPolarHBondContact CA-OD1 3.04Å; I933-N937 WeakPolarHBondContact CD1-OD1 3.23Å; I933-N937 HydrophobicContact CG2-CB 4.03Å; I933-V960 HydrophobicContact CG2-CB 4.39Å; I933-V960 HydrophobicContact CG2-CG1 3.9Å; I933-V960 HydrophobicContact CG2-CG2 3.54Å
934	N	89.1	Confident	85.8	Confident	49 Å²	49	34.1 Å²	34.1	26%	0.262	17%	0.168	S	C	.	.			trans	-108.6	164.5	175.2	79.2	2.8	0	0	0	111.8	E936 N937	N934-E936 PolarHBondContact ND2-OE2 2.99Å; N934-E936 PolarHBondContact O-N 3.17Å; N934-E936 VanDerWaalsContact O-N 3.14Å; N934-E936 WeakPolarHBondContact OD1-CA 3.45Å; N934-E936 VanDerWaalsContact OD1-CB 3.26Å; N934-E936 WeakPolarHBondContact OD1-CB 3.13Å; N934-E936 PolarHBondContact OD1-N 3.34Å; N934-N937 PolarHBondContact N-OD1 2.96Å; N934-N937 WeakPolarHBondContact O-CB 3.07Å; N934-N937 PolarHBondContact O-N 3.01Å; N934-N937 PolarHBondContact OD1-N 2.79Å; N934-N937 VanDerWaalsContact OD1-N 3.08Å; N934-N937 PolarHBondContact OD1-ND2 3Å; N934-N937 PolarHBondContact OD1-OD1 3Å
935	R	88.3	Confident	86.5	Confident	82 Å²	82	31.3 Å²	31.3	31%	0.309	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-55.6	-26.9	175.6	63.2	-172.2	66.9	-164.1	0.5	114.4	E877 N937 M938 Y962 D989	E877-R935 WeakPolarHBondContact OE1-CB 3.24Å; E877-R935 WeakPolarHBondContact OE1-CG 3.22Å; E877-R935 PolarHBondContact OE1-N 3.5Å; E877-R935 IonicContact OE1-NE 2.79Å; E877-R935 PolarHBondContact OE1-NE 2.9Å; E877-R935 VanDerWaalsContact OE1-NE 3.11Å; E877-R935 IonicContact OE2-CZ 2.68Å; E877-R935 IonicContact OE2-NE 3.28Å; E877-R935 PolarHBondContact OE2-NE 3.16Å; E877-R935 IonicContact OE2-NH2 2.74Å; E877-R935 PolarHBondContact OE2-NH2 3.02Å; R935-N937 PolarHBondContact O-N 2.82Å; R935-M938 VanDerWaalsContact O-CB 3.26Å; R935-M938 WeakPolarHBondContact O-CB 3.23Å; R935-M938 PolarHBondContact O-N 3.2Å; R935-Y962 HydrophobicContact CB-CD1 3.84Å; R935-Y962 HydrophobicContact CB-CE1 3.71Å; R935-Y962 VanDerWaalsContact CZ-CD2 3.49Å; R935-Y962 VanDerWaalsContact NH2-CG 3.34Å; R935-D989 IonicContact CZ-OD2 3.24Å; R935-D989 IonicContact NH1-OD2 3.78Å; R935-D989 PolarHBondContact NH1-OD2 3.11Å
936	E	87.6	Confident	87.2	Confident	143 Å²	143	32.7 Å²	32.7	67%	0.668	16%	0.161	S	C	*	.	G	3₁₀ helix	trans	-72.5	-11.8	176.4	-43.9	175.7	134.6	0	0	113	R900 N934 M938	R900-E936 PolarHBondContact NH1-O 3.47Å; R900-E936 PolarHBondContact NH2-O 2.99Å; N934-E936 PolarHBondContact ND2-OE2 2.99Å; N934-E936 PolarHBondContact O-N 3.17Å; N934-E936 VanDerWaalsContact O-N 3.14Å; N934-E936 WeakPolarHBondContact OD1-CA 3.45Å; N934-E936 VanDerWaalsContact OD1-CB 3.26Å; N934-E936 WeakPolarHBondContact OD1-CB 3.13Å; N934-E936 PolarHBondContact OD1-N 3.34Å; E936-M938 VanDerWaalsContact C-N 3.34Å
937	N	89.5	Confident	87.6	Confident	21 Å²	21	31.2 Å²	31.2	11%	0.112	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-83.4	-8.8	174.4	-54	153	0	0	0	113	R900 V918 I933 N934 R935 Y941	R900-N937 VanDerWaalsContact NH2-C 3.29Å; R900-N937 PolarHBondContact NH2-O 3.4Å; V918-N937 HydrophobicContact CG2-CB 4.35Å; I933-N937 WeakPolarHBondContact CA-OD1 3.04Å; I933-N937 WeakPolarHBondContact CD1-OD1 3.23Å; I933-N937 HydrophobicContact CG2-CB 4.03Å; N934-N937 PolarHBondContact N-OD1 2.96Å; N934-N937 WeakPolarHBondContact O-CB 3.07Å; N934-N937 PolarHBondContact O-N 3.01Å; N934-N937 PolarHBondContact OD1-N 2.79Å; N934-N937 VanDerWaalsContact OD1-N 3.08Å; N934-N937 PolarHBondContact OD1-ND2 3Å; N934-N937 PolarHBondContact OD1-OD1 3Å; R935-N937 PolarHBondContact O-N 2.82Å; N937-Y941 WeakPolarHBondContact O-CE2 3.48Å; N937-Y941 PolarHBondContact O-OH 2.72Å
938	M	88.8	Confident	87.8	Confident	26 Å²	26	33 Å²	33	13%	0.128	17%	0.171	C	C	.	.			trans	-58.1	145.7	178.2	-161.3	-170.9	-64.8	0	0	112.3	R900 R935 E936 F957 L958 V960 N991 F1047	R900-M938 PolarHBondContact NH2-O 3.38Å; R935-M938 VanDerWaalsContact O-CB 3.26Å; R935-M938 WeakPolarHBondContact O-CB 3.23Å; R935-M938 PolarHBondContact O-N 3.2Å; E936-M938 VanDerWaalsContact C-N 3.34Å; M938-F957 HydrophobicContact CG-CE1 3.66Å; M938-F957 HydrophobicContact CG-CZ 3.6Å; M938-F957 HydrophobicContact SD-CE1 3.87Å; M938-F957 HydrophobicContact SD-CZ 3.69Å; M938-L958 WeakPolarHBondContact CA-O 3.29Å; M938-L958 WeakPolarHBondContact CG-O 3.23Å; M938-V960 HydrophobicContact CB-CG2 4.34Å; M938-V960 HydrophobicContact CE-CB 4.44Å; M938-V960 WeakPolarHBondContact CE-O 3.48Å; M938-N991 WeakPolarHBondContact CE-ND2 3.2Å; M938-F1047 HydrophobicContact CE-CE1 3.84Å; M938-F1047 HydrophobicContact CE-CE2 4.49Å; M938-F1047 HydrophobicContact CE-CZ 3.61Å; M938-F1047 HydrophobicContact SD-CE1 4.22Å; M938-F1047 HydrophobicContact SD-CE2 4.45Å; M938-F1047 HydrophobicContact SD-CZ 3.55Å; M938-F1047 VanDerWaalsContact SD-CZ 3.55Å
939	G	87.1	Confident	87.7	Confident	8 Å²	8	35.6 Å²	35.6	8%	0.082	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	145.8	-171.4	175.7	0	0	0	0	0	114.5	Y941 F957 L958	G939-Y941 WeakPolarHBondContact O-CD2 3.43Å; G939-F957 CarbonylContact O-C 3.55Å; G939-F957 WeakPolarHBondContact O-CA 3.25Å; G939-L958 PolarHBondContact N-O 3.13Å; G939-L958 VanDerWaalsContact N-O 3.12Å; G939-L958 PolarHBondContact O-N 2.93Å
940	N	87.4	Confident	87.6	Confident	77 Å²	77	41.8 Å²	41.8	41%	0.412	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	126.9	179.3	-76.9	-18.4	0	0	0	111.6	R900 N901 T955 F957	R900-N940 WeakPolarHBondContact CA-O 3.21Å; N901-N940 PolarHBondContact N-O 3.15Å; N940-T955 HydrophobicContact CB-CG2 4.36Å; N940-F957 WeakPolarHBondContact OD1-CD2 3.33Å
941	Y	89	Confident	87.4	Confident	2 Å²	2	46 Å²	46	1%	0.008	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	124.9	175.1	-72	-98.5	0	0	0	109.3	F899 R900 L905 V918 L928 N937 G939 T955 F956 L958	F899-Y941 CarbonylContact O-C 3.53Å; F899-Y941 VanDerWaalsContact O-CA 3.31Å; F899-Y941 WeakPolarHBondContact O-CA 3.41Å; R900-Y941 HydrophobicContact CB-CD1 4.13Å; R900-Y941 HydrophobicContact CB-CE1 3.91Å; R900-Y941 VanDerWaalsContact CD-OH 3.3Å; R900-Y941 WeakPolarHBondContact CD-OH 3.3Å; R900-Y941 HydrophobicContact CG-CD1 4.33Å; R900-Y941 HydrophobicContact CG-CE1 3.87Å; R900-Y941 HydrophobicContact CG-CE2 4.13Å; R900-Y941 PolarHBondContact NE-OH 3.05Å; L905-Y941 HydrophobicContact CD1-CD1 3.9Å; L905-Y941 HydrophobicContact CD1-CE1 3.84Å; L905-Y941 HydrophobicContact CD2-CE1 4.43Å; V918-Y941 HydrophobicContact CB-CE1 3.95Å; V918-Y941 HydrophobicContact CG1-CD1 4.31Å; V918-Y941 HydrophobicContact CG1-CE1 3.66Å; V918-Y941 HydrophobicContact CG2-CE1 4.2Å; V918-Y941 WeakPolarHBondContact CG2-OH 3.23Å; L928-Y941 HydrophobicContact CD2-CD1 4.2Å; N937-Y941 WeakPolarHBondContact O-CE2 3.48Å; N937-Y941 PolarHBondContact O-OH 2.72Å; G939-Y941 WeakPolarHBondContact O-CD2 3.43Å; Y941-T955 CarbonylContact O-C 3.57Å; Y941-T955 VanDerWaalsContact O-CA 3.32Å; Y941-T955 WeakPolarHBondContact O-CA 3.02Å; Y941-F956 HydrophobicContact CG-CZ 4.47Å; Y941-F956 PolarHBondContact N-O 3.23Å; Y941-F956 PolarHBondContact O-N 2.7Å; Y941-L958 HydrophobicContact CD2-CB 3.62Å; Y941-L958 HydrophobicContact CD2-CD2 4.37Å; Y941-L958 HydrophobicContact CE2-CB 3.57Å; Y941-L958 HydrophobicContact CE2-CD2 3.69Å; Y941-L958 HydrophobicContact CE2-CG 4.26Å
942	T	88.3	Confident	87.3	Confident	16 Å²	16	46.3 Å²	46.3	10%	0.098	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	126.4	-178.9	-63.3	0	0	0	0	109.8	F899 I944 R953 N954 T955	F899-T942 PolarHBondContact N-O 2.95Å; F899-T942 PolarHBondContact O-N 2.9Å; T942-I944 HydrophobicContact CG2-CG1 4.33Å; T942-R953 HydrophobicContact CG2-CG 3.84Å; T942-N954 CarbonylContact C-O 3.5Å; T942-N954 VanDerWaalsContact CA-O 3.29Å; T942-N954 WeakPolarHBondContact CA-O 3.09Å; T942-T955 WeakPolarHBondContact CG2-OG1 3.47Å; T942-T955 WeakPolarHBondContact OG1-CG2 3.17Å; T942-T955 PolarHBondContact OG1-OG1 2.99Å
943	V	87.5	Confident	87.4	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.024	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	136	169.2	60.1	0	0	0	0	110.3	F864 V896 W898 V945 R953 N954	F864-V943 HydrophobicContact CE1-CG1 3.67Å; F864-V943 HydrophobicContact CZ-CG1 3.98Å; V896-V943 HydrophobicContact CG1-CG2 3.68Å; W898-V943 HydrophobicContact CD2-CB 3.96Å; W898-V943 HydrophobicContact CD2-CG2 4.13Å; W898-V943 HydrophobicContact CE3-CB 3.76Å; W898-V943 HydrophobicContact CE3-CG2 4.44Å; W898-V943 HydrophobicContact CH2-CB 3.62Å; W898-V943 HydrophobicContact CH2-CG1 3.97Å; W898-V943 HydrophobicContact CH2-CG2 4.19Å; W898-V943 HydrophobicContact CZ2-CB 3.83Å; W898-V943 HydrophobicContact CZ2-CG1 4.43Å; W898-V943 HydrophobicContact CZ2-CG2 3.87Å; W898-V943 HydrophobicContact CZ3-CB 3.6Å; W898-V943 HydrophobicContact CZ3-CG1 4.18Å; W898-V943 HydrophobicContact CZ3-CG2 4.47Å; V943-V945 HydrophobicContact CG2-CG1 4.03Å; V943-R953 WeakPolarHBondContact O-CA 3.26Å; V943-N954 HydrophobicContact CG1-CB 3.85Å; V943-N954 PolarHBondContact N-O 3.38Å; V943-N954 PolarHBondContact O-N 3.47Å
944	I	89	Confident	87.2	Confident	21 Å²	21	48.8 Å²	48.8	11%	0.108	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	121.8	171.5	-56.9	176.8	0	0	0	107.8	V896 S897 F899 T942 E951 R953	V896-I944 CarbonylContact C-O 3.59Å; V896-I944 WeakPolarHBondContact CA-O 3.36Å; S897-I944 PolarHBondContact N-O 2.88Å; S897-I944 PolarHBondContact O-N 3.14Å; S897-I944 PolarHBondContact OG-O 2.7Å; F899-I944 HydrophobicContact CD2-CD1 3.97Å; F899-I944 HydrophobicContact CD2-CG1 4.24Å; F899-I944 HydrophobicContact CE2-CB 4.42Å; F899-I944 HydrophobicContact CE2-CD1 3.5Å; F899-I944 HydrophobicContact CE2-CG1 4.03Å; F899-I944 HydrophobicContact CZ-CD1 4.15Å; T942-I944 HydrophobicContact CG2-CG1 4.33Å; I944-E951 HydrophobicContact CG2-CG 3.44Å; I944-E951 VanDerWaalsContact CG2-CG 3.44Å; I944-R953 VanDerWaalsContact CD1-NH2 3.31Å; I944-R953 HydrophobicContact CG1-CG 4.34Å
945	V	88.6	Confident	86.9	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	138.5	177.3	-73.3	0	0	0	0	110.8	P862 F864 L887 V893 S895 V896 V943 E951 S952	P862-V945 HydrophobicContact CB-CB 4.29Å; P862-V945 HydrophobicContact CB-CG2 3.77Å; P862-V945 HydrophobicContact CG-CB 4.39Å; P862-V945 HydrophobicContact CG-CG2 4.26Å; F864-V945 HydrophobicContact CE1-CG2 3.99Å; F864-V945 HydrophobicContact CE2-CG2 4.42Å; F864-V945 HydrophobicContact CZ-CG2 3.63Å; L887-V945 HydrophobicContact CD1-CG1 3.79Å; L887-V945 HydrophobicContact CD2-CG1 4.02Å; L887-V945 HydrophobicContact CD2-CG2 4.24Å; V893-V945 HydrophobicContact CG1-CB 4.24Å; V893-V945 HydrophobicContact CG1-CG1 4.36Å; S895-V945 WeakPolarHBondContact O-CA 3.39Å; V896-V945 HydrophobicContact CB-CG1 4.24Å; V896-V945 HydrophobicContact CG1-CG1 3.81Å; V896-V945 HydrophobicContact CG2-CG1 3.98Å; V943-V945 HydrophobicContact CG2-CG1 4.03Å; V945-E951 CarbonylContact O-C 3.51Å; V945-E951 WeakPolarHBondContact O-CA 3.42Å; V945-S952 VanDerWaalsContact CG2-O 3.31Å; V945-S952 WeakPolarHBondContact CG2-O 3.41Å; V945-S952 PolarHBondContact N-O 2.85Å; V945-S952 PolarHBondContact O-N 3.45Å
946	S	88.4	Confident	86.6	Confident	30 Å²	30	45.3 Å²	45.3	21%	0.21	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	151.9	176.3	80	0	0	0	0	112.2	V893 T894 S895	V893-S946 CarbonylContact C-O 3.6Å; V893-S946 WeakPolarHBondContact CA-O 3.42Å; V893-S946 WeakPolarHBondContact CG1-O 3.35Å; T894-S946 PolarHBondContact N-O 2.85Å; T894-S946 PolarHBondContact OG1-O 3.5Å; T894-S946 PolarHBondContact OG1-OG 2.89Å; S895-S946 PolarHBondContact O-N 2.02Å; S895-S946 PolarHBondContact OG-OG 2.78Å
947	N	88	Confident	86.4	Confident	9 Å²	9	40.5 Å²	40.5	5%	0.048	21%	0.21	C	C	.	.			trans	-134.1	-174.6	153.5	75.1	0.9	0	0	0	109	F860 P862 P891 P892 T894 Q949 H950	F860-N947 PolarHBondContact O-ND2 2.8Å; P862-N947 HydrophobicContact CG-CB 4.13Å; P891-N947 PolarHBondContact O-ND2 2.87Å; P892-N947 WeakPolarHBondContact O-CB 3.48Å; T894-N947 WeakPolarHBondContact OG1-CA 3.36Å; N947-Q949 PolarHBondContact O-N 2.94Å; N947-Q949 WeakPolarHBondContact OD1-CA 3.42Å; N947-Q949 VanDerWaalsContact OD1-CB 3.3Å; N947-Q949 WeakPolarHBondContact OD1-CB 3.38Å; N947-Q949 PolarHBondContact OD1-N 3.11Å; N947-H950 PolarHBondContact N-O 2.89Å; N947-H950 VanDerWaalsContact N-O 3.17Å; N947-H950 PolarHBondContact O-N 3.22Å; N947-H950 PolarHBondContact OD1-N 2.85Å
948	S	86.7	Confident	86.3	Confident	85 Å²	85	39.5 Å²	39.5	59%	0.594	20%	0.204	S	C	*	.	S	Bend	trans	-66.1	-1.6	179.9	68.5	0	0	0	0	115.6	P891	P891-S948 WeakPolarHBondContact CG-OG 3.41Å
949	Q	84.5	Confident	86.2	Confident	54 Å²	54	39.8 Å²	39.8	25%	0.252	21%	0.206	S	C	.	.	S	Bend	trans	-98.1	-50.8	176.1	-48.5	-58.6	-77.4	0	0	111.4	T859 A861 N947	T859-Q949 PolarHBondContact OG1-OE1 2.75Å; A861-Q949 HydrophobicContact CB-CB 4.47Å; N947-Q949 PolarHBondContact O-N 2.94Å; N947-Q949 WeakPolarHBondContact OD1-CA 3.42Å; N947-Q949 VanDerWaalsContact OD1-CB 3.3Å; N947-Q949 WeakPolarHBondContact OD1-CB 3.38Å; N947-Q949 PolarHBondContact OD1-N 3.11Å
950	H	84.6	Confident	86.3	Confident	130 Å²	130	39.4 Å²	39.4	60%	0.602	20%	0.202	S	C	*	.			trans	-164.5	171.9	174.2	-140	56.3	0	0	0	114.1	A861 P862 N947	A861-H950 HydrophobicContact CB-CB 3.47Å; A861-H950 VanDerWaalsContact CB-CB 3.47Å; P862-H950 WeakPolarHBondContact CD-O 3.29Å; N947-H950 PolarHBondContact N-O 2.89Å; N947-H950 VanDerWaalsContact N-O 3.17Å; N947-H950 PolarHBondContact O-N 3.22Å; N947-H950 PolarHBondContact OD1-N 2.85Å
951	E	85.4	Confident	86.5	Confident	87 Å²	87	36.6 Å²	36.6	41%	0.407	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	147.1	159.9	-173.5	-175.8	124.8	0	0	110.3	I944 V945 R953	I944-E951 HydrophobicContact CG2-CG 3.44Å; I944-E951 VanDerWaalsContact CG2-CG 3.44Å; V945-E951 CarbonylContact O-C 3.51Å; V945-E951 WeakPolarHBondContact O-CA 3.42Å; E951-R953 IonicContact OE1-CZ 2.9Å; E951-R953 IonicContact OE1-NE 3.98Å; E951-R953 PolarHBondContact OE1-NE 2.7Å; E951-R953 IonicContact OE1-NH2 3.44Å; E951-R953 PolarHBondContact OE1-NH2 3.08Å
952	S	84	Confident	86.5	Confident	24 Å²	24	36.8 Å²	36.8	17%	0.168	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	143.3	164.2	-69.4	0	0	0	0	109.8	P862 V945	P862-S952 WeakPolarHBondContact O-CB 3.39Å; P862-S952 PolarHBondContact O-OG 3.45Å; V945-S952 VanDerWaalsContact CG2-O 3.31Å; V945-S952 WeakPolarHBondContact CG2-O 3.41Å; V945-S952 PolarHBondContact N-O 2.85Å; V945-S952 PolarHBondContact O-N 3.45Å
953	R	86.6	Confident	86.7	Confident	137 Å²	137	38.6 Å²	38.6	52%	0.517	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	143.8	-168.9	-177.7	179.7	-59	-116.3	-4.9	110.1	T942 V943 I944 E951	T942-R953 HydrophobicContact CG2-CG 3.84Å; V943-R953 WeakPolarHBondContact O-CA 3.26Å; I944-R953 VanDerWaalsContact CD1-NH2 3.31Å; I944-R953 HydrophobicContact CG1-CG 4.34Å; E951-R953 IonicContact OE1-CZ 2.9Å; E951-R953 IonicContact OE1-NE 3.98Å; E951-R953 PolarHBondContact OE1-NE 2.7Å; E951-R953 IonicContact OE1-NH2 3.44Å; E951-R953 PolarHBondContact OE1-NH2 3.08Å
954	N	82.7	Confident	86.9	Confident	20 Å²	20	38.7 Å²	38.7	11%	0.107	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	147.8	171.2	-171.8	23.2	0	0	0	110.4	F864 V869 T942 V943	F864-N954 HydrophobicContact CD1-CB 4.4Å; F864-N954 HydrophobicContact CD2-CB 4.05Å; F864-N954 HydrophobicContact CE1-CB 3.99Å; F864-N954 HydrophobicContact CE2-CB 3.62Å; F864-N954 HydrophobicContact CG-CB 4.43Å; F864-N954 HydrophobicContact CZ-CB 3.58Å; V869-N954 WeakPolarHBondContact CG1-OD1 3.42Å; V869-N954 WeakPolarHBondContact CG2-ND2 3.33Å; T942-N954 CarbonylContact C-O 3.5Å; T942-N954 VanDerWaalsContact CA-O 3.29Å; T942-N954 WeakPolarHBondContact CA-O 3.09Å; V943-N954 HydrophobicContact CG1-CB 3.85Å; V943-N954 PolarHBondContact N-O 3.38Å; V943-N954 PolarHBondContact O-N 3.47Å
955	T	82.8	Confident	87.1	Confident	52 Å²	52	40 Å²	40	32%	0.319	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	137.5	-179.1	-60.2	0	0	0	0	109.7	N940 Y941 T942	N940-T955 HydrophobicContact CB-CG2 4.36Å; Y941-T955 CarbonylContact O-C 3.57Å; Y941-T955 VanDerWaalsContact O-CA 3.32Å; Y941-T955 WeakPolarHBondContact O-CA 3.02Å; T942-T955 WeakPolarHBondContact CG2-OG1 3.47Å; T942-T955 WeakPolarHBondContact OG1-CG2 3.17Å; T942-T955 PolarHBondContact OG1-OG1 2.99Å
956	F	81.5	Confident	87.3	Confident	6 Å²	6	41.3 Å²	41.3	3%	0.026	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	156.1	172	72.5	-87	0	0	0	111	R873 L883 F885 W898 L928 Y941 L958	R873-F956 HydrophobicContact CB-CD2 3.8Å; R873-F956 HydrophobicContact CB-CE2 3.83Å; R873-F956 HydrophobicContact CG-CD2 3.55Å; R873-F956 HydrophobicContact CG-CE2 3.77Å; R873-F956 HydrophobicContact CG-CG 4.22Å; L883-F956 HydrophobicContact CD1-CZ 4.21Å; F885-F956 AromaticContact CE1-CD1 3.93Å; F885-F956 HydrophobicContact CE1-CD1 3.93Å; F885-F956 AromaticContact CE1-CE1 3.82Å; F885-F956 HydrophobicContact CE1-CE1 3.82Å; F885-F956 HydrophobicContact CE2-CE1 4.27Å; F885-F956 AromaticContact CZ-CD1 3.93Å; F885-F956 HydrophobicContact CZ-CD1 3.93Å; F885-F956 AromaticContact CZ-CE1 3.33Å; F885-F956 HydrophobicContact CZ-CE1 3.33Å; F885-F956 AromaticContact CZ-CZ 3.89Å; F885-F956 HydrophobicContact CZ-CZ 3.89Å; W898-F956 HydrophobicContact CH2-CE1 4.15Å; W898-F956 AromaticContact CZ3-CE1 3.85Å; W898-F956 HydrophobicContact CZ3-CE1 3.85Å; L928-F956 HydrophobicContact CD2-CE1 4.37Å; L928-F956 HydrophobicContact CD2-CZ 3.79Å; Y941-F956 HydrophobicContact CG-CZ 4.47Å; Y941-F956 PolarHBondContact N-O 3.23Å; Y941-F956 PolarHBondContact O-N 2.7Å; F956-L958 HydrophobicContact CE2-CB 4.18Å
957	F	84.6	Confident	87.4	Confident	41 Å²	41	43.2 Å²	43.2	18%	0.18	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	117.4	174.2	-175.3	-83.3	0	0	0	110.5	D871 H872 R873 M938 G939 N940 N959	D871-F957 WeakPolarHBondContact O-CB 3.41Å; D871-F957 PolarHBondContact O-N 2.69Å; H872-F957 CarbonylContact C-O 3.59Å; H872-F957 VanDerWaalsContact CA-O 3.3Å; H872-F957 WeakPolarHBondContact CA-O 3.17Å; H872-F957 AromaticContact ND1-CD1 3.92Å; H872-F957 AromaticContact ND1-CG 3.95Å; R873-F957 PolarHBondContact N-O 3.4Å; M938-F957 HydrophobicContact CG-CE1 3.66Å; M938-F957 HydrophobicContact CG-CZ 3.6Å; M938-F957 HydrophobicContact SD-CE1 3.87Å; M938-F957 HydrophobicContact SD-CZ 3.69Å; G939-F957 CarbonylContact O-C 3.55Å; G939-F957 WeakPolarHBondContact O-CA 3.25Å; N940-F957 WeakPolarHBondContact OD1-CD2 3.33Å; F957-N959 HydrophobicContact CD1-CB 4.06Å; F957-N959 HydrophobicContact CE1-CB 3.98Å; F957-N959 PolarHBondContact O-N 3.22Å
958	L	87.5	Confident	87.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	114.4	168.5	177.9	61.5	0	0	0	109.1	I875 V918 L930 M938 G939 Y941 F956 V960	I875-L958 HydrophobicContact CB-CD1 4.18Å; I875-L958 HydrophobicContact CD1-CD1 3.85Å; I875-L958 HydrophobicContact CG1-CD1 4.11Å; V918-L958 HydrophobicContact CG2-CD2 4.25Å; L930-L958 HydrophobicContact CD2-CD1 4.22Å; L930-L958 HydrophobicContact CD2-CD2 3.73Å; M938-L958 WeakPolarHBondContact CA-O 3.29Å; M938-L958 WeakPolarHBondContact CG-O 3.23Å; G939-L958 PolarHBondContact N-O 3.13Å; G939-L958 VanDerWaalsContact N-O 3.12Å; G939-L958 PolarHBondContact O-N 2.93Å; Y941-L958 HydrophobicContact CD2-CB 3.62Å; Y941-L958 HydrophobicContact CD2-CD2 4.37Å; Y941-L958 HydrophobicContact CE2-CB 3.57Å; Y941-L958 HydrophobicContact CE2-CD2 3.69Å; Y941-L958 HydrophobicContact CE2-CG 4.26Å; F956-L958 HydrophobicContact CE2-CB 4.18Å; L958-V960 HydrophobicContact CD2-CG2 4.47Å; L958-V960 HydrophobicContact CG-CG2 4.2Å
959	N	87.3	Confident	87.4	Confident	32 Å²	32	48.9 Å²	48.9	17%	0.171	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	117.3	173.9	-173.9	26	0	0	0	110.2	R873 V874 I875 F957 N991	R873-N959 PolarHBondContact O-N 2.67Å; V874-N959 WeakPolarHBondContact CA-O 3.44Å; V874-N959 HydrophobicContact CG2-CB 4.46Å; I875-N959 PolarHBondContact N-O 2.94Å; F957-N959 HydrophobicContact CD1-CB 4.06Å; F957-N959 HydrophobicContact CE1-CB 3.98Å; F957-N959 PolarHBondContact O-N 3.22Å; N959-N991 PolarHBondContact OD1-ND2 2.98Å
960	V	88.7	Confident	87.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	111.9	-179.2	-175.5	0	0	0	0	110.2	I875 E877 I933 M938 L958 Y962 N991	I875-V960 CarbonylContact O-C 3.59Å; I875-V960 VanDerWaalsContact O-CA 3.29Å; I875-V960 WeakPolarHBondContact O-CA 3.05Å; E877-V960 HydrophobicContact CB-CG1 4.06Å; I933-V960 HydrophobicContact CG2-CB 4.39Å; I933-V960 HydrophobicContact CG2-CG1 3.9Å; I933-V960 HydrophobicContact CG2-CG2 3.54Å; M938-V960 HydrophobicContact CB-CG2 4.34Å; M938-V960 HydrophobicContact CE-CB 4.44Å; M938-V960 WeakPolarHBondContact CE-O 3.48Å; L958-V960 HydrophobicContact CD2-CG2 4.47Å; L958-V960 HydrophobicContact CG-CG2 4.2Å; V960-Y962 WeakPolarHBondContact O-CD1 3.43Å; V960-N991 PolarHBondContact O-ND2 3.38Å
961	T	90.4	Very high	87.7	Confident	19 Å²	19	51 Å²	51	12%	0.117	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	142.8	-177.5	52.8	0	0	0	0	112.4	V874 I875 E877 N991	V874-T961 HydrophobicContact CG1-CG2 3.73Å; I875-T961 PolarHBondContact O-N 2.9Å; I875-T961 PolarHBondContact O-OG1 3.02Å; E877-T961 WeakPolarHBondContact CB-O 3.46Å; E877-T961 PolarHBondContact N-O 3.47Å; T961-N991 CarbonylContact C-O 3.57Å; T961-N991 VanDerWaalsContact CA-O 3.26Å; T961-N991 WeakPolarHBondContact CA-O 3.46Å; T961-N991 VanDerWaalsContact CB-O 3.23Å; T961-N991 WeakPolarHBondContact CB-O 3.2Å
962	Y	90.2	Very high	87.9	Confident	6 Å²	6	50 Å²	50	2%	0.024	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	154.6	-169.2	51.6	-104.5	0	0	0	112.7	E877 R935 V960 D989 N991 F1047 N1072	E877-Y962 WeakPolarHBondContact OE2-CB 3.24Å; R935-Y962 HydrophobicContact CB-CD1 3.84Å; R935-Y962 HydrophobicContact CB-CE1 3.71Å; R935-Y962 VanDerWaalsContact CZ-CD2 3.49Å; R935-Y962 VanDerWaalsContact NH2-CG 3.34Å; V960-Y962 WeakPolarHBondContact O-CD1 3.43Å; Y962-D989 WeakPolarHBondContact CE2-OD2 3.34Å; Y962-N991 HydrophobicContact CD1-CB 3.71Å; Y962-N991 HydrophobicContact CD2-CB 4.18Å; Y962-N991 HydrophobicContact CE1-CB 3.41Å; Y962-N991 VanDerWaalsContact CE1-CB 3.41Å; Y962-N991 HydrophobicContact CE2-CB 3.93Å; Y962-N991 HydrophobicContact CG-CB 4.08Å; Y962-N991 PolarHBondContact N-O 2.99Å; Y962-N991 VanDerWaalsContact O-O 3.13Å; Y962-F1047 VanDerWaalsContact OH-CB 3.28Å; Y962-F1047 WeakPolarHBondContact OH-CB 3.44Å; Y962-F1047 VanDerWaalsContact OH-CG 3.23Å; Y962-F1047 WeakPolarHBondContact OH-CG 3.11Å; Y962-N1072 PolarHBondContact O-ND2 3.41Å
963	P	92	Very high	88.1	Confident	53 Å²	53	53.7 Å²	53.7	34%	0.344	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	148.3	179.5	26.7	-37.4	0	0	0	112.8	I1074	P963-I1074 VanDerWaalsContact CA-O 3.23Å; P963-I1074 WeakPolarHBondContact CA-O 3.34Å; P963-I1074 HydrophobicContact CB-CG2 4.4Å; P963-I1074 WeakPolarHBondContact CB-O 3.38Å
964	A	91.8	Very high	88.2	Confident	6 Å²	6	49.2 Å²	49.2	5%	0.05	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	140	173.3	0	0	0	0	0	111.9	D989 A990 T998 V1070 N1072	A964-D989 CarbonylContact C-O 3.54Å; A964-D989 WeakPolarHBondContact CA-O 3.32Å; A964-A990 HydrophobicContact CB-CB 3.91Å; A964-T998 HydrophobicContact CB-CG2 4.39Å; A964-V1070 HydrophobicContact CB-CG1 3.9Å; A964-N1072 HydrophobicContact CB-CB 4.33Å; A964-N1072 PolarHBondContact N-OD1 3.46Å; A964-N1072 VanDerWaalsContact N-OD1 3.16Å
965	S	92.7	Very high	88.4	Confident	49 Å²	49	52 Å²	52	34%	0.343	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	136.1	-179.5	62.7	0	0	0	0	111.4	A988 D989	S965-A988 CarbonylContact O-C 3.47Å; S965-A988 WeakPolarHBondContact O-CA 3.43Å; S965-A988 VanDerWaalsContact O-CB 3.25Å; S965-A988 WeakPolarHBondContact O-CB 3.3Å; S965-D989 PolarHBondContact N-O 2.75Å; S965-D989 PolarHBondContact O-N 2.9Å; S965-D989 PolarHBondContact OG-O 3.48Å
966	I	92.8	Very high	88.4	Confident	28 Å²	28	51.8 Å²	51.8	14%	0.144	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	131.7	-177.5	-74.2	154.7	0	0	0	110.9	L970 V1070 V1078 K1080	I966-L970 HydrophobicContact CB-CD2 4.26Å; I966-L970 HydrophobicContact CD1-CD2 4.11Å; I966-L970 HydrophobicContact CG2-CD2 4.21Å; I966-V1070 HydrophobicContact CD1-CG2 4.2Å; I966-V1070 HydrophobicContact CG1-CG2 3.84Å; I966-V1078 HydrophobicContact CD1-CB 3.91Å; I966-V1078 HydrophobicContact CD1-CG2 3.67Å; I966-V1078 HydrophobicContact CG1-CB 4.48Å; I966-V1078 HydrophobicContact CG1-CG2 3.76Å; I966-K1080 HydrophobicContact CD1-CB 4Å; I966-K1080 HydrophobicContact CG2-CB 4.34Å; I966-K1080 HydrophobicContact CG2-CD 4.36Å
967	V	90.3	Very high	88	Confident	69 Å²	69	56.7 Å²	56.7	42%	0.418	32%	0.317	S	S	.	.			trans	-95	103.4	175.7	179.4	0	0	0	0	109.1	K987 D989	V967-K987 HydrophobicContact CB-CB 4.07Å; V967-K987 PolarHBondContact N-O 2.86Å; V967-D989 HydrophobicContact CG2-CB 4.27Å
968	G	87.1	Confident	87.5	Confident	61 Å²	61	58 Å²	58	63%	0.629	33%	0.326	S	S	*	.	S	Bend	trans	129.9	-159.1	176	0	0	0	0	0	113.5
969	K	87.4	Confident	87.1	Confident	153 Å²	153	64.4 Å²	64.4	67%	0.665	35%	0.354	S	S	*	.			trans	-74.4	143.7	173.9	-65.5	179	-179.5	175	0	110.6	E971 K1080	K969-E971 WeakPolarHBondContact CB-O 3.44Å; K969-K1080 WeakPolarHBondContact O-CD 3.43Å; K969-K1080 VanDerWaalsContact O-CE 3.3Å; K969-K1080 WeakPolarHBondContact O-CE 3.4Å
970	L	88.5	Confident	86.8	Confident	106 Å²	106	67.8 Å²	67.8	56%	0.555	37%	0.372	S	S	*	.	S	Bend	trans	-76.7	-20.5	175.1	-63.2	177.9	0	0	0	113.3	I966 K1080 T1081	I966-L970 HydrophobicContact CB-CD2 4.26Å; I966-L970 HydrophobicContact CD1-CD2 4.11Å; I966-L970 HydrophobicContact CG2-CD2 4.21Å; L970-K1080 CarbonylContact O-C 3.44Å; L970-K1080 WeakPolarHBondContact O-CA 3.49Å; L970-T1081 PolarHBondContact O-N 2.86Å
971	E	88.1	Confident	86.6	Confident	121 Å²	121	72.9 Å²	72.9	57%	0.565	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.3	139.7	172.2	-57.2	-156.3	129.7	0	0	110.7	K969 T1081	K969-E971 WeakPolarHBondContact CB-O 3.44Å; E971-T1081 WeakPolarHBondContact CA-O 3.25Å
972	E	89.2	Confident	86.6	Confident	66 Å²	66	72.1 Å²	72.1	31%	0.308	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	138.9	-175.7	-167.9	154.3	-127.3	0	0	111.8	I974 K1080 T1081 F1082 N1083	E972-I974 HydrophobicContact CG-CD1 3.98Å; E972-K1080 VanDerWaalsContact OE2-CE 3.28Å; E972-K1080 WeakPolarHBondContact OE2-CE 3.37Å; E972-K1080 IonicContact OE2-NZ 2.68Å; E972-K1080 PolarHBondContact OE2-NZ 3.1Å; E972-T1081 PolarHBondContact N-O 2.81Å; E972-F1082 HydrophobicContact CB-CD1 4.17Å; E972-F1082 CarbonylContact O-C 3.52Å; E972-F1082 VanDerWaalsContact O-CA 3.27Å; E972-F1082 WeakPolarHBondContact O-CA 3.38Å; E972-N1083 PolarHBondContact O-N 2.78Å
973	N	88.9	Confident	86.6	Confident	103 Å²	103	73.6 Å²	73.6	55%	0.551	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	122.3	177.5	-67.8	-3.2	0	0	0	109.1	N1083 L1085	N973-N1083 WeakPolarHBondContact OD1-CB 3.29Å; N973-N1083 PolarHBondContact OD1-ND2 2.79Å; N973-L1085 HydrophobicContact CB-CD1 4.49Å
974	I	88.8	Confident	86.6	Confident	42 Å²	42	71 Å²	71	22%	0.215	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	102.6	-179.8	-57.8	-59.3	0	0	0	108.2	E972 L984 F1082 N1083 L1084 L1085	E972-I974 HydrophobicContact CG-CD1 3.98Å; I974-L984 HydrophobicContact CB-CD2 4Å; I974-L984 HydrophobicContact CG1-CD2 3.74Å; I974-L984 HydrophobicContact CG2-CD2 4.09Å; I974-F1082 HydrophobicContact CG1-CD1 4.22Å; I974-N1083 PolarHBondContact N-O 2.86Å; I974-L1084 HydrophobicContact CG2-CD1 4.25Å; I974-L1085 PolarHBondContact O-N 2.82Å
975	T	86.3	Confident	86.7	Confident	79 Å²	79	74.6 Å²	74.6	49%	0.485	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	117	176.1	-51.5	0	0	0	0	109.9	L1085	T975-L1085 CarbonylContact C-O 3.54Å; T975-L1085 WeakPolarHBondContact CA-O 3.1Å; T975-L1085 HydrophobicContact CG2-CB 4.31Å
976	Q	82.5	Confident	86.8	Confident	47 Å²	47	72.2 Å²	72.2	22%	0.22	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	128.4	-178.2	-175.5	62.2	-23.6	0	0	111.5	N978 Y981 A982 L1058 L1085	Q976-N978 WeakPolarHBondContact CG-O 3.47Å; Q976-Y981 WeakPolarHBondContact CG-O 3.48Å; Q976-Y981 PolarHBondContact NE2-O 3.19Å; Q976-A982 HydrophobicContact CB-CB 4.37Å; Q976-A982 HydrophobicContact CG-CB 4.28Å; Q976-L1058 HydrophobicContact CB-CD1 4.17Å; Q976-L1058 HydrophobicContact CG-CD1 3.6Å; Q976-L1085 PolarHBondContact N-O 3.3Å
977	T	73.6	Confident	86.8	Confident	110 Å²	110	75 Å²	75	68%	0.675	40%	0.397	S	S	*	.			trans	-102.4	-23.8	-177.7	53.4	0	0	0	0	113.2
978	N	74.2	Confident	87	Confident	68 Å²	68	71.8 Å²	71.8	36%	0.364	38%	0.377	S	S	.	.			trans	-81.5	147	173.2	-170.2	4.6	0	0	0	110.8	Q976 D980 L1058	Q976-N978 WeakPolarHBondContact CG-O 3.47Å; N978-D980 PolarHBondContact ND2-OD2 3.17Å; N978-D980 PolarHBondContact OD1-N 3.19Å; N978-D980 PolarHBondContact OD1-OD2 3.25Å; N978-L1058 WeakPolarHBondContact O-CD1 3.46Å
979	K	77.6	Confident	87.3	Confident	135 Å²	135	70.1 Å²	70.1	59%	0.587	35%	0.354	S	S	*	.	S	Bend	trans	-84.4	-18.8	177.8	-53.1	-165.9	178	-172.7	0	113.3	Q1057 L1058 Y1086	K979-Q1057 CarbonylContact O-C 3.52Å; K979-Q1057 WeakPolarHBondContact O-CA 3.48Å; K979-L1058 PolarHBondContact O-N 3.27Å; K979-Y1086 WeakPolarHBondContact CD-OH 3.24Å; K979-Y1086 VanDerWaalsContact CE-OH 3.27Å; K979-Y1086 WeakPolarHBondContact CE-OH 3.48Å; K979-Y1086 HydrophobicContact CG-CE2 4.03Å
980	D	81.8	Confident	87.5	Confident	102 Å²	102	62.9 Å²	62.9	55%	0.545	32%	0.322	S	S	.	.	S	Bend	trans	-61	-51.6	-170.2	-64.5	-29.6	0	0	0	113.1	N978 Y1056 Q1057	N978-D980 PolarHBondContact ND2-OD2 3.17Å; N978-D980 PolarHBondContact OD1-N 3.19Å; N978-D980 PolarHBondContact OD1-OD2 3.25Å; D980-Y1056 WeakPolarHBondContact O-CA 3.17Å; D980-Q1057 PolarHBondContact O-N 2.82Å
981	Y	85	Confident	87.6	Confident	108 Å²	108	58.4 Å²	58.4	42%	0.424	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.3	163.9	175.4	67.7	-79.7	0	0	0	112.9	Q976 A983 Y1054 I1055 Y1056	Q976-Y981 WeakPolarHBondContact CG-O 3.48Å; Q976-Y981 PolarHBondContact NE2-O 3.19Å; Y981-A983 HydrophobicContact CE2-CB 4.49Å; Y981-Y1054 HydrophobicContact CD2-CD1 4.11Å; Y981-Y1054 HydrophobicContact CE2-CD1 4.45Å; Y981-Y1054 HydrophobicContact CE2-CE1 4.49Å; Y981-I1055 CarbonylContact C-O 3.58Å; Y981-I1055 WeakPolarHBondContact CA-O 3.46Å; Y981-I1055 WeakPolarHBondContact CB-O 3.36Å; Y981-Y1056 HydrophobicContact CG-CD1 4.48Å
982	A	89	Confident	87.8	Confident	2 Å²	2	54.9 Å²	54.9	2%	0.017	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	158.7	157.3	0	0	0	0	0	110	Q976 Y1054 I1055 L1058 L1084	Q976-A982 HydrophobicContact CB-CB 4.37Å; Q976-A982 HydrophobicContact CG-CB 4.28Å; A982-Y1054 CarbonylContact O-C 3.36Å; A982-Y1054 WeakPolarHBondContact O-CA 3.41Å; A982-I1055 PolarHBondContact N-O 3.18Å; A982-I1055 PolarHBondContact O-N 3.1Å; A982-L1058 HydrophobicContact CB-CD1 3.95Å; A982-L1058 HydrophobicContact CB-CD2 4.14Å; A982-L1084 HydrophobicContact CB-CD1 3.72Å
983	A	90	Very high	87.7	Confident	37 Å²	37	52.2 Å²	52.2	31%	0.306	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	134.7	174.5	0	0	0	0	0	110	Y981 T1052 F1053 Y1054	Y981-A983 HydrophobicContact CE2-CB 4.49Å; A983-T1052 HydrophobicContact CB-CG2 3.95Å; A983-F1053 CarbonylContact C-O 3.53Å; A983-F1053 WeakPolarHBondContact CA-O 2.98Å; A983-Y1054 HydrophobicContact CB-CD1 4.04Å; A983-Y1054 HydrophobicContact CB-CE1 4.04Å
984	L	93.4	Very high	87.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	117.2	179.4	-44.1	177.6	0	0	0	109.5	I974 W1001 T1052 F1053 I1055 Y1066 F1082	I974-L984 HydrophobicContact CB-CD2 4Å; I974-L984 HydrophobicContact CG1-CD2 3.74Å; I974-L984 HydrophobicContact CG2-CD2 4.09Å; L984-W1001 HydrophobicContact CB-CH2 3.69Å; L984-W1001 HydrophobicContact CB-CZ3 3.84Å; L984-W1001 HydrophobicContact CD1-CZ3 3.98Å; L984-W1001 VanDerWaalsContact O-CH2 3.29Å; L984-W1001 WeakPolarHBondContact O-CH2 3.39Å; L984-T1052 WeakPolarHBondContact O-CA 3.33Å; L984-F1053 HydrophobicContact CB-CB 4.22Å; L984-F1053 HydrophobicContact CD1-CD1 3.91Å; L984-F1053 HydrophobicContact CG-CD1 4.42Å; L984-F1053 PolarHBondContact N-O 2.86Å; L984-F1053 PolarHBondContact O-N 3.42Å; L984-I1055 HydrophobicContact CD1-CD1 4.48Å; L984-Y1066 HydrophobicContact CD1-CD1 4.32Å; L984-Y1066 HydrophobicContact CD1-CD2 4.36Å; L984-Y1066 HydrophobicContact CD1-CG 3.95Å; L984-F1082 HydrophobicContact CB-CD1 3.93Å; L984-F1082 HydrophobicContact CB-CD2 4.45Å; L984-F1082 HydrophobicContact CB-CE1 3.98Å; L984-F1082 HydrophobicContact CB-CG 4.16Å; L984-F1082 HydrophobicContact CB-CZ 4.27Å; L984-F1082 HydrophobicContact CD1-CB 4.07Å; L984-F1082 HydrophobicContact CD1-CG 4.23Å; L984-F1082 HydrophobicContact CD2-CB 4.29Å; L984-F1082 HydrophobicContact CD2-CD1 4.32Å; L984-F1082 HydrophobicContact CD2-CG 4.48Å
985	D	92.7	Very high	87.5	Confident	80 Å²	80	49.9 Å²	49.9	43%	0.428	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	119.5	-175.6	-84.8	-23.6	0	0	0	113.2	T1052 K1080 F1082	D985-T1052 WeakPolarHBondContact OD1-CB 3.3Å; D985-T1052 VanDerWaalsContact OD1-CG2 3.25Å; D985-T1052 WeakPolarHBondContact OD1-CG2 3.3Å; D985-T1052 PolarHBondContact OD1-OG1 2.73Å; D985-K1080 PolarHBondContact O-NZ 2.9Å; D985-F1082 WeakPolarHBondContact O-CE1 3.3Å; D985-F1082 VanDerWaalsContact O-CZ 3.26Å; D985-F1082 WeakPolarHBondContact O-CZ 3.11Å
986	C	94.7	Very high	87.3	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	121.9	174.6	-166.2	0	0	0	0	109.7	F999 W1001 S1050 S1051 C1068 F1082	C986-F999 HydrophobicContact CB-CE1 4.27Å; C986-W1001 HydrophobicContact CB-CH2 3.85Å; C986-W1001 HydrophobicContact CB-CZ2 3.52Å; C986-S1050 CarbonylContact O-C 3.55Å; C986-S1050 VanDerWaalsContact O-CA 3.29Å; C986-S1050 WeakPolarHBondContact O-CA 3.32Å; C986-S1051 PolarHBondContact N-O 3.39Å; C986-S1051 PolarHBondContact O-N 2.69Å; C986-C1068 HydrophobicContact CB-CB 3.68Å; C986-C1068 WeakPolarHBondContact CB-SG 3.48Å; C986-C1068 WeakPolarHBondContact SG-CB 3.44Å; C986-C1068 CovalentContact SG-SG 2.04Å; C986-C1068 PolarHBondContact SG-SG 3.29Å; C986-F1082 HydrophobicContact CB-CZ 4.29Å
987	K	94.3	Very high	87.3	Confident	86 Å²	86	53.3 Å²	53.3	37%	0.374	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	146.1	179.6	-60.2	-169.3	-176.8	-170.6	0	110.1	V967	V967-K987 HydrophobicContact CB-CB 4.07Å; V967-K987 PolarHBondContact N-O 2.86Å
988	A	94	Very high	88	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.008	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	155.2	-179.7	0	0	0	0	0	113.1	S965 F999 I1049 V1070	S965-A988 CarbonylContact O-C 3.47Å; S965-A988 WeakPolarHBondContact O-CA 3.43Å; S965-A988 VanDerWaalsContact O-CB 3.25Å; S965-A988 WeakPolarHBondContact O-CB 3.3Å; A988-F999 HydrophobicContact CB-CE1 4.21Å; A988-F999 HydrophobicContact CB-CZ 4.05Å; A988-I1049 HydrophobicContact CB-CD1 4.46Å; A988-I1049 HydrophobicContact CB-CG1 4.07Å; A988-I1049 PolarHBondContact N-O 2.74Å; A988-I1049 WeakPolarHBondContact O-CG1 3.24Å; A988-I1049 PolarHBondContact O-N 3.36Å; A988-I1049 VanDerWaalsContact O-O 3.12Å; A988-V1070 HydrophobicContact CB-CG1 3.69Å; A988-V1070 HydrophobicContact CB-CG2 4.5Å
989	D	93.3	Very high	88.8	Confident	27 Å²	27	45.1 Å²	45.1	14%	0.144	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	128.1	172.7	177	79.2	0	0	0	109.3	R935 Y962 A964 S965 V967	R935-D989 IonicContact CZ-OD2 3.24Å; R935-D989 IonicContact NH1-OD2 3.78Å; R935-D989 PolarHBondContact NH1-OD2 3.11Å; Y962-D989 WeakPolarHBondContact CE2-OD2 3.34Å; A964-D989 CarbonylContact C-O 3.54Å; A964-D989 WeakPolarHBondContact CA-O 3.32Å; S965-D989 PolarHBondContact N-O 2.75Å; S965-D989 PolarHBondContact O-N 2.9Å; S965-D989 PolarHBondContact OG-O 3.48Å; V967-D989 HydrophobicContact CG2-CB 4.27Å
990	A	90.9	Very high	89.5	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	151.7	-170.8	0	0	0	0	0	112.7	A964 A993 F1047 I1049 N1072	A964-A990 HydrophobicContact CB-CB 3.91Å; A990-A993 WeakPolarHBondContact O-CB 3.45Å; A990-F1047 PolarHBondContact N-O 3.17Å; A990-F1047 WeakPolarHBondContact O-CA 3.35Å; A990-I1049 HydrophobicContact CB-CD1 4.29Å; A990-N1072 HydrophobicContact CB-CB 4.37Å
991	N	91.9	Very high	90	Very high	12 Å²	12	34.4 Å²	34.4	6%	0.064	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	110.1	164.6	-172	22.2	0	0	0	110.5	M938 N959 V960 T961 Y962 F1047 N1072	M938-N991 WeakPolarHBondContact CE-ND2 3.2Å; N959-N991 PolarHBondContact OD1-ND2 2.98Å; V960-N991 PolarHBondContact O-ND2 3.38Å; T961-N991 CarbonylContact C-O 3.57Å; T961-N991 VanDerWaalsContact CA-O 3.26Å; T961-N991 WeakPolarHBondContact CA-O 3.46Å; T961-N991 VanDerWaalsContact CB-O 3.23Å; T961-N991 WeakPolarHBondContact CB-O 3.2Å; Y962-N991 HydrophobicContact CD1-CB 3.71Å; Y962-N991 HydrophobicContact CD2-CB 4.18Å; Y962-N991 HydrophobicContact CE1-CB 3.41Å; Y962-N991 VanDerWaalsContact CE1-CB 3.41Å; Y962-N991 HydrophobicContact CE2-CB 3.93Å; Y962-N991 HydrophobicContact CG-CB 4.08Å; Y962-N991 PolarHBondContact N-O 2.99Å; Y962-N991 VanDerWaalsContact O-O 3.13Å; N991-F1047 HydrophobicContact CB-CD1 3.83Å; N991-F1047 HydrophobicContact CB-CE1 4.12Å; N991-N1072 PolarHBondContact O-ND2 2.8Å
992	P	91	Very high	90.3	Very high	47 Å²	47	31.1 Å²	31.1	31%	0.305	16%	0.162	S	C	.	.	S	Bend	cis	-69.1	149	7.5	29.4	-36.1	0	0	0	113.5	I994 N1072	P992-I994 HydrophobicContact CB-CD1 4.13Å; P992-I994 HydrophobicContact CB-CG1 4.26Å; P992-N1072 WeakPolarHBondContact O-CB 3.27Å; P992-N1072 PolarHBondContact O-ND2 3.29Å
993	A	88	Confident	90.3	Very high	10 Å²	10	33.4 Å²	33.4	8%	0.083	17%	0.17	C	C	.	.			trans	-107.9	87.6	177.7	0	0	0	0	0	109.8	A990 K1046 I1049	A990-A993 WeakPolarHBondContact O-CB 3.45Å; A993-K1046 WeakPolarHBondContact CB-O 3.14Å; A993-I1049 HydrophobicContact CB-CG2 3.6Å
994	I	87.6	Confident	90.1	Very high	81 Å²	81	34.9 Å²	34.9	42%	0.415	17%	0.168	S	C	.	.			trans	-123.9	89.6	-176.2	-57.4	173.3	0	0	0	108.3	P992 D996 R997 T998	P992-I994 HydrophobicContact CB-CD1 4.13Å; P992-I994 HydrophobicContact CB-CG1 4.26Å; I994-D996 VanDerWaalsContact C-N 3.33Å; I994-D996 PolarHBondContact O-N 2.77Å; I994-R997 HydrophobicContact CG2-CB 4.2Å; I994-R997 HydrophobicContact CG2-CG 4.26Å; I994-R997 PolarHBondContact O-N 3.13Å; I994-R997 VanDerWaalsContact O-N 3.11Å; I994-T998 VanDerWaalsContact O-CB 3.28Å; I994-T998 WeakPolarHBondContact O-CB 3.16Å; I994-T998 PolarHBondContact O-N 2.97Å; I994-T998 VanDerWaalsContact O-N 3.12Å; I994-T998 PolarHBondContact O-OG1 3.16Å
995	P	85.7	Confident	89.2	Confident	15 Å²	15	37.6 Å²	37.6	10%	0.097	18%	0.18	C	C	.	.	H	α-helix	trans	-50.7	-49.2	-169.2	-24.1	28.3	0	0	0	113.4	R997 T998 F999 C1027 C1041 Q1043 I1049	P995-R997 PolarHBondContact O-N 3.04Å; P995-T998 PolarHBondContact O-N 2.84Å; P995-F999 HydrophobicContact CB-CD2 4.47Å; P995-F999 PolarHBondContact O-N 2.67Å; P995-C1027 PolarHBondContact O-SG 3.05Å; P995-C1027 VanDerWaalsContact O-SG 3.35Å; P995-C1041 HydrophobicContact CB-CB 3.86Å; P995-Q1043 HydrophobicContact CG-CB 3.83Å; P995-I1049 HydrophobicContact CG-CB 4.06Å; P995-I1049 HydrophobicContact CG-CG2 3.76Å
996	D	82.1	Confident	87.9	Confident	94 Å²	94	35 Å²	35	50%	0.503	17%	0.168	S	C	.	.	H	α-helix	trans	-64.1	-12.8	-175	-69.8	-18.5	0	0	0	115.5	I994 C1027 N1028	I994-D996 VanDerWaalsContact C-N 3.33Å; I994-D996 PolarHBondContact O-N 2.77Å; D996-C1027 HydrophobicContact CB-CB 4.31Å; D996-C1027 WeakPolarHBondContact OD1-CB 3.45Å; D996-N1028 PolarHBondContact OD1-ND2 3.42Å; D996-N1028 VanDerWaalsContact OD1-ND2 3.1Å
997	R	81.8	Confident	86.2	Confident	105 Å²	105	35.5 Å²	35.5	40%	0.396	17%	0.171	S	C	.	.	H	α-helix	trans	-116.1	-4.9	173.8	-64.9	-172.8	-179.3	177.2	2.3	113.4	I994 P995	I994-R997 HydrophobicContact CG2-CB 4.2Å; I994-R997 HydrophobicContact CG2-CG 4.26Å; I994-R997 PolarHBondContact O-N 3.13Å; I994-R997 VanDerWaalsContact O-N 3.11Å; P995-R997 PolarHBondContact O-N 3.04Å
998	T	88	Confident	84.2	Confident	5 Å²	5	39.6 Å²	39.6	3%	0.031	19%	0.188	C	C	.	.	H	α-helix	trans	-105.5	-28.2	-169.9	-55.2	0	0	0	0	112.9	A964 I994 P995 I1049 V1070 S1071 N1072	A964-T998 HydrophobicContact CB-CG2 4.39Å; I994-T998 VanDerWaalsContact O-CB 3.28Å; I994-T998 WeakPolarHBondContact O-CB 3.16Å; I994-T998 PolarHBondContact O-N 2.97Å; I994-T998 VanDerWaalsContact O-N 3.12Å; I994-T998 PolarHBondContact O-OG1 3.16Å; P995-T998 PolarHBondContact O-N 2.84Å; T998-I1049 HydrophobicContact CG2-CD1 3.33Å; T998-V1070 HydrophobicContact CG2-CG1 3.62Å; T998-V1070 CarbonylContact O-C 3.59Å; T998-V1070 VanDerWaalsContact O-CA 3.28Å; T998-V1070 WeakPolarHBondContact O-CA 3.47Å; T998-S1071 WeakPolarHBondContact CA-O 3.48Å; T998-S1071 PolarHBondContact O-N 2.85Å; T998-N1072 HydrophobicContact CG2-CB 4.12Å
999	F	92.1	Very high	81.9	Confident	1 Å²	1	41.8 Å²	41.8	0%	0.004	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	132.4	178.1	-67.5	-75.4	0	0	0	113	C986 A988 P995 I1049 V1070	C986-F999 HydrophobicContact CB-CE1 4.27Å; A988-F999 HydrophobicContact CB-CE1 4.21Å; A988-F999 HydrophobicContact CB-CZ 4.05Å; P995-F999 HydrophobicContact CB-CD2 4.47Å; P995-F999 PolarHBondContact O-N 2.67Å; F999-I1049 HydrophobicContact CD2-CD1 4.44Å; F999-I1049 HydrophobicContact CE2-CB 3.87Å; F999-I1049 HydrophobicContact CE2-CD1 3.72Å; F999-I1049 HydrophobicContact CE2-CG1 3.71Å; F999-I1049 HydrophobicContact CZ-CB 4.33Å; F999-I1049 HydrophobicContact CZ-CD1 4.02Å; F999-I1049 HydrophobicContact CZ-CG1 3.8Å; F999-V1070 HydrophobicContact CD1-CG1 4.21Å; F999-V1070 HydrophobicContact CD1-CG2 3.85Å; F999-V1070 HydrophobicContact CE1-CG1 3.99Å; F999-V1070 HydrophobicContact CE1-CG2 3.76Å
1000	T	91.7	Very high	79.9	Confident	11 Å²	11	42 Å²	42	7%	0.067	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	129	169.3	-57.3	0	0	0	0	110.2	Y1002 P1024 Y1026 E1069	T1000-Y1002 HydrophobicContact CG2-CD2 4.29Å; T1000-Y1002 HydrophobicContact CG2-CE1 4.34Å; T1000-Y1002 HydrophobicContact CG2-CE2 3.57Å; T1000-P1024 HydrophobicContact CG2-CB 3.43Å; T1000-P1024 VanDerWaalsContact CG2-CB 3.43Å; T1000-Y1026 HydrophobicContact CG2-CD1 3.9Å; T1000-Y1026 HydrophobicContact CG2-CE1 3.46Å; T1000-Y1026 VanDerWaalsContact CG2-CE1 3.46Å; T1000-Y1026 WeakPolarHBondContact OG1-CE1 3.49Å; T1000-E1069 PolarHBondContact N-O 3Å; T1000-E1069 PolarHBondContact O-N 2.88Å
1001	W	92.8	Very high	78.3	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	143.6	178.1	-70.8	87.6	0	0	0	112.1	L984 C986 I1025 S1051 F1053 V1067 C1068 F1082	L984-W1001 HydrophobicContact CB-CH2 3.69Å; L984-W1001 HydrophobicContact CB-CZ3 3.84Å; L984-W1001 HydrophobicContact CD1-CZ3 3.98Å; L984-W1001 VanDerWaalsContact O-CH2 3.29Å; L984-W1001 WeakPolarHBondContact O-CH2 3.39Å; C986-W1001 HydrophobicContact CB-CH2 3.85Å; C986-W1001 HydrophobicContact CB-CZ2 3.52Å; W1001-I1025 HydrophobicContact CB-CB 4.27Å; W1001-I1025 PolarHBondContact N-O 3.23Å; W1001-I1025 PolarHBondContact O-N 3.35Å; W1001-S1051 PolarHBondContact NE1-OG 3.37Å; W1001-F1053 HydrophobicContact CB-CD2 3.9Å; W1001-F1053 HydrophobicContact CB-CE2 4.01Å; W1001-F1053 HydrophobicContact CD2-CB 3.66Å; W1001-F1053 AromaticContact CD2-CD2 3.94Å; W1001-F1053 HydrophobicContact CD2-CD2 3.94Å; W1001-F1053 AromaticContact CD2-CG 3.92Å; W1001-F1053 HydrophobicContact CD2-CG 3.92Å; W1001-F1053 HydrophobicContact CE3-CB 3.78Å; W1001-F1053 HydrophobicContact CE3-CD1 4.44Å; W1001-F1053 HydrophobicContact CE3-CD2 4.35Å; W1001-F1053 AromaticContact CE3-CG 3.97Å; W1001-F1053 HydrophobicContact CE3-CG 3.97Å; W1001-F1053 HydrophobicContact CG-CB 4.3Å; W1001-F1053 AromaticContact CG-CD2 3.73Å; W1001-F1053 HydrophobicContact CG-CD2 3.73Å; W1001-F1053 HydrophobicContact CG-CE2 4.34Å; W1001-F1053 HydrophobicContact CG-CG 4.22Å; W1001-F1053 HydrophobicContact CH2-CB 3.76Å; W1001-F1053 HydrophobicContact CZ2-CB 3.66Å; W1001-F1053 HydrophobicContact CZ3-CB 3.82Å; W1001-F1053 HydrophobicContact CZ3-CG 4.39Å; W1001-V1067 CarbonylContact C-O 3.46Å; W1001-V1067 WeakPolarHBondContact CA-O 3.25Å; W1001-C1068 HydrophobicContact CD2-CB 4.07Å; W1001-C1068 HydrophobicContact CE3-CB 3.93Å; W1001-C1068 HydrophobicContact CH2-CB 3.87Å; W1001-C1068 HydrophobicContact CZ2-CB 3.98Å; W1001-C1068 HydrophobicContact CZ3-CB 3.84Å; W1001-F1082 HydrophobicContact CH2-CD2 4.12Å; W1001-F1082 AromaticContact CH2-CE2 3.41Å; W1001-F1082 HydrophobicContact CH2-CE2 3.41Å; W1001-F1082 VanDerWaalsContact CH2-CE2 3.41Å; W1001-F1082 AromaticContact CH2-CZ 3.69Å; W1001-F1082 HydrophobicContact CH2-CZ 3.69Å; W1001-F1082 AromaticContact CZ3-CD2 3.67Å; W1001-F1082 HydrophobicContact CZ3-CD2 3.67Å; W1001-F1082 AromaticContact CZ3-CE2 3.39Å; W1001-F1082 HydrophobicContact CZ3-CE2 3.39Å; W1001-F1082 HydrophobicContact CZ3-CZ 4.11Å
1002	Y	91.7	Very high	76.6	Confident	39 Å²	39	47 Å²	47	15%	0.153	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	155.8	176.6	-58.1	-92	0	0	0	110.6	T1000 L1021 S1022 P1024 Y1066 V1067 E1069	T1000-Y1002 HydrophobicContact CG2-CD2 4.29Å; T1000-Y1002 HydrophobicContact CG2-CE1 4.34Å; T1000-Y1002 HydrophobicContact CG2-CE2 3.57Å; Y1002-L1021 HydrophobicContact CD1-CB 4.04Å; Y1002-L1021 HydrophobicContact CG-CB 4.47Å; Y1002-L1021 HydrophobicContact CG-CD2 4.23Å; Y1002-S1022 WeakPolarHBondContact CD1-O 3.43Å; Y1002-P1024 HydrophobicContact CD1-CB 4.24Å; Y1002-P1024 HydrophobicContact CE1-CB 3.63Å; Y1002-P1024 HydrophobicContact CE1-CG 4.39Å; Y1002-Y1066 CarbonylContact O-C 3.6Å; Y1002-Y1066 WeakPolarHBondContact O-CA 3.47Å; Y1002-V1067 PolarHBondContact N-O 3.28Å; Y1002-V1067 PolarHBondContact O-N 3.38Å; Y1002-E1069 HydrophobicContact CD2-CB 4.37Å; Y1002-E1069 HydrophobicContact CE2-CB 3.86Å
1003	R	88.6	Confident	75.1	Confident	50 Å²	50	45.1 Å²	45.1	19%	0.189	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	138.8	167.1	-171.9	-176.9	-177.6	-159	-7.8	110.1	S1022 D1061 D1062 V1063 Y1066	R1003-S1022 PolarHBondContact N-OG 3.48Å; R1003-S1022 WeakPolarHBondContact O-CB 3.35Å; R1003-S1022 PolarHBondContact O-N 2.99Å; R1003-D1061 PolarHBondContact NH1-O 3.07Å; R1003-D1061 PolarHBondContact NH2-O 3.36Å; R1003-D1062 PolarHBondContact NH2-O 2.89Å; R1003-V1063 PolarHBondContact NH2-O 3.27Å; R1003-Y1066 HydrophobicContact CB-CD1 3.89Å; R1003-Y1066 HydrophobicContact CB-CE1 3.82Å; R1003-Y1066 WeakPolarHBondContact CD-OH 3.21Å; R1003-Y1066 HydrophobicContact CG-CD1 3.9Å; R1003-Y1066 HydrophobicContact CG-CE1 3.6Å; R1003-Y1066 HydrophobicContact CG-CE2 4.26Å; R1003-Y1066 HydrophobicContact CG-CG 4.37Å; R1003-Y1066 PolarHBondContact NE-OH 3.38Å
1004	Y	84.9	Confident	73.6	Confident	69 Å²	69	45 Å²	45	27%	0.271	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	125.7	167.7	-77.7	-79.8	0	0	0	110.9	L1019 Q1020 L1021 K1065 V1067	Y1004-L1019 HydrophobicContact CD1-CB 3.91Å; Y1004-Q1020 CarbonylContact C-O 3.54Å; Y1004-Q1020 WeakPolarHBondContact CA-O 3.15Å; Y1004-L1021 HydrophobicContact CD1-CD2 4.21Å; Y1004-L1021 HydrophobicContact CD2-CD2 4.35Å; Y1004-L1021 HydrophobicContact CE1-CD2 3.87Å; Y1004-L1021 HydrophobicContact CE1-CG 4.13Å; Y1004-L1021 HydrophobicContact CE2-CD2 4.03Å; Y1004-L1021 HydrophobicContact CG-CD2 4.45Å; Y1004-K1065 HydrophobicContact CD2-CB 3.9Å; Y1004-K1065 HydrophobicContact CD2-CD 3.87Å; Y1004-K1065 HydrophobicContact CD2-CG 3.72Å; Y1004-K1065 HydrophobicContact CE2-CD 3.92Å; Y1004-K1065 HydrophobicContact CE2-CG 4.09Å; Y1004-K1065 PolarHBondContact N-O 2.81Å; Y1004-V1067 HydrophobicContact CD2-CG2 4.1Å; Y1004-V1067 HydrophobicContact CE2-CG2 3.47Å; Y1004-V1067 VanDerWaalsContact CE2-CG2 3.47Å
1005	F	75.7	Confident	72.3	Confident	57 Å²	57	43.6 Å²	43.6	25%	0.25	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	154.3	-178.8	80.9	-69.8	0	0	0	112.2	Q1020 L1021	F1005-Q1020 HydrophobicContact CD1-CB 4.24Å; F1005-Q1020 WeakPolarHBondContact CD1-O 3.47Å; F1005-Q1020 HydrophobicContact CE1-CB 3.67Å; F1005-Q1020 HydrophobicContact CZ-CB 4.12Å; F1005-Q1020 PolarHBondContact N-O 3.38Å; F1005-Q1020 PolarHBondContact O-N 2.82Å; F1005-L1021 WeakPolarHBondContact CE1-O 3.24Å
1006	P	64.4	Low	71	Confident	26 Å²	26	46.4 Å²	46.4	17%	0.169	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-66.1	141.9	172.3	-18.3	31.8	0	0	0	111.5	V1014 L1019	P1006-V1014 HydrophobicContact CB-CG2 4.1Å; P1006-L1019 HydrophobicContact CG-CD2 4.33Å
1007	P	60.1	Low	69.5	Low	9 Å²	9	46.1 Å²	46.1	6%	0.058	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-57.9	149.1	179.8	-21.2	31.5	0	0	0	112.8	G1009 W1010 A1018 Q1020	P1007-G1009 PolarHBondContact O-N 3.09Å; P1007-W1010 HydrophobicContact CB-CG 4.09Å; P1007-W1010 HydrophobicContact CG-CG 4.43Å; P1007-W1010 VanDerWaalsContact O-CB 3.26Å; P1007-W1010 WeakPolarHBondContact O-CB 3.23Å; P1007-W1010 PolarHBondContact O-N 3.25Å; P1007-A1018 WeakPolarHBondContact CG-O 3.21Å; P1007-Q1020 HydrophobicContact CG-CG 4.07Å
1008	K	50.9	Low	68.2	Low	172 Å²	172	41.8 Å²	41.8	75%	0.748	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	124.8	-173.9	-77.8	177.8	178.2	165.4	0	112.4
1009	G	47.3	Very low	67.1	Low	48 Å²	48	42.4 Å²	42.4	50%	0.495	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	7	-179.1	0	0	0	0	0	115.1	P1007 R1211	P1007-G1009 PolarHBondContact O-N 3.09Å; G1009-R1211 VanDerWaalsContact C-NH2 3.35Å; G1009-R1211 VanDerWaalsContact O-CZ 3.31Å; G1009-R1211 PolarHBondContact O-NH1 3.38Å; G1009-R1211 PolarHBondContact O-NH2 2.9Å
1010	W	49.9	Very low	66	Low	32 Å²	32	46.9 Å²	46.9	12%	0.121	26%	0.256	C	S	.	.	S	Bend	trans	-92.3	155.9	168.2	-69.4	67.5	0	0	0	110.5	P1007 V1014 R1260 G1262 E1264	P1007-W1010 HydrophobicContact CB-CG 4.09Å; P1007-W1010 HydrophobicContact CG-CG 4.43Å; P1007-W1010 VanDerWaalsContact O-CB 3.26Å; P1007-W1010 WeakPolarHBondContact O-CB 3.23Å; P1007-W1010 PolarHBondContact O-N 3.25Å; W1010-V1014 HydrophobicContact CB-CG2 4.34Å; W1010-R1260 HydrophobicContact CE3-CG 4.42Å; W1010-R1260 HydrophobicContact CH2-CB 3.89Å; W1010-R1260 HydrophobicContact CH2-CG 3.87Å; W1010-R1260 HydrophobicContact CZ3-CB 3.48Å; W1010-R1260 VanDerWaalsContact CZ3-CB 3.48Å; W1010-R1260 HydrophobicContact CZ3-CG 3.48Å; W1010-R1260 VanDerWaalsContact CZ3-CG 3.48Å; W1010-G1262 WeakPolarHBondContact CH2-O 3.34Å; W1010-G1262 VanDerWaalsContact CZ3-CA 3.44Å; W1010-G1262 WeakPolarHBondContact CZ3-O 3.31Å; W1010-E1264 HydrophobicContact CZ2-CG 4.03Å; W1010-E1264 WeakPolarHBondContact CZ2-OE1 3.1Å; W1010-E1264 PolarHBondContact NE1-OE1 2.95Å
1011	T	57.5	Low	65.4	Low	39 Å²	39	49.7 Å²	49.7	24%	0.239	27%	0.27	C	S	.	.			trans	-75.1	166.5	174.3	68.7	0	0	0	0	110.5	E1013 V1014 L1095 N1261	T1011-E1013 WeakPolarHBondContact CB-OE2 3.29Å; T1011-E1013 PolarHBondContact O-N 3.06Å; T1011-E1013 PolarHBondContact OG1-OE2 3.42Å; T1011-V1014 WeakPolarHBondContact O-CG2 3.39Å; T1011-L1095 HydrophobicContact CG2-CD2 4.08Å; T1011-N1261 PolarHBondContact OG1-ND2 3.44Å
1012	E	57.7	Low	64.9	Low	78 Å²	78	50.8 Å²	50.8	36%	0.364	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-3.7	-170.3	-57.6	-174	118.3	0	0	114.5	V1014 R1116 R1160	E1012-V1014 PolarHBondContact O-N 2.96Å; E1012-R1116 IonicContact OE1-CZ 3.5Å; E1012-R1116 IonicContact OE1-NH1 3.25Å; E1012-R1116 PolarHBondContact OE1-NH1 2.94Å; E1012-R1116 WeakPolarHBondContact OE2-CD 3.06Å; E1012-R1116 IonicContact OE2-CZ 3.53Å; E1012-R1116 IonicContact OE2-NE 2.67Å; E1012-R1116 IonicContact OE2-NH1 3.31Å; E1012-R1116 PolarHBondContact OE2-NH1 2.81Å; E1012-R1160 PolarHBondContact O-NH2 2.87Å
1013	E	59.5	Low	64.3	Low	6 Å²	6	56.2 Å²	56.2	3%	0.028	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	18.3	-171.5	-59.2	133.6	120.7	0	0	114	T1011 D1015 I1093 L1095 Y1114 N1261	T1011-E1013 WeakPolarHBondContact CB-OE2 3.29Å; T1011-E1013 PolarHBondContact O-N 3.06Å; T1011-E1013 PolarHBondContact OG1-OE2 3.42Å; E1013-D1015 PolarHBondContact O-N 3.17Å; E1013-I1093 HydrophobicContact CG-CB 4.46Å; E1013-I1093 HydrophobicContact CG-CD1 3.39Å; E1013-I1093 HydrophobicContact CG-CG2 4.41Å; E1013-I1093 WeakPolarHBondContact OE1-CB 3.21Å; E1013-I1093 VanDerWaalsContact OE1-CG2 3.24Å; E1013-I1093 WeakPolarHBondContact OE1-CG2 3.49Å; E1013-L1095 WeakPolarHBondContact OE1-CD1 3.35Å; E1013-L1095 WeakPolarHBondContact OE1-CG 3.39Å; E1013-L1095 WeakPolarHBondContact OE2-CD1 3.47Å; E1013-Y1114 HydrophobicContact CB-CD1 3.84Å; E1013-Y1114 HydrophobicContact CB-CE1 4.08Å; E1013-Y1114 HydrophobicContact CB-CG 4.13Å; E1013-Y1114 HydrophobicContact CG-CD1 3.92Å; E1013-Y1114 HydrophobicContact CG-CD2 4.33Å; E1013-Y1114 HydrophobicContact CG-CG 3.76Å; E1013-N1261 PolarHBondContact OE2-ND2 3Å
1014	V	56.5	Low	64.1	Low	7 Å²	7	55.5 Å²	55.5	4%	0.042	31%	0.307	C	S	.	.			trans	-67.5	119.9	179.3	-175.1	0	0	0	0	109.4	P1006 W1010 T1011 E1012 A1018 L1019	P1006-V1014 HydrophobicContact CB-CG2 4.1Å; W1010-V1014 HydrophobicContact CB-CG2 4.34Å; T1011-V1014 WeakPolarHBondContact O-CG2 3.39Å; E1012-V1014 PolarHBondContact O-N 2.96Å; V1014-A1018 HydrophobicContact CG1-CB 3.33Å; V1014-A1018 WeakPolarHBondContact CG1-O 3.42Å; V1014-L1019 HydrophobicContact CB-CD2 4.22Å; V1014-L1019 HydrophobicContact CG1-CD2 4.45Å
1015	D	58.9	Low	64.1	Low	52 Å²	52	53.8 Å²	53.8	28%	0.278	30%	0.302	S	S	.	.			trans	-55.2	150.5	170.5	-71.7	-42.5	0	0	0	110.5	E1013 G1017 A1018	E1013-D1015 PolarHBondContact O-N 3.17Å; D1015-G1017 PolarHBondContact O-N 3.09Å; D1015-A1018 PolarHBondContact O-N 3.45Å
1016	E	59	Low	64.5	Low	75 Å²	75	52.5 Å²	52.5	35%	0.35	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-50.3	-37.7	-169.9	-64.2	-144.7	116	0	0	114.3	A1018 L1019 K1065 I1159 R1160	E1016-A1018 PolarHBondContact O-N 2.85Å; E1016-L1019 HydrophobicContact CB-CD1 4.46Å; E1016-L1019 PolarHBondContact O-N 3.48Å; E1016-K1065 WeakPolarHBondContact OE1-CE 3.31Å; E1016-K1065 IonicContact OE1-NZ 2.67Å; E1016-K1065 PolarHBondContact OE1-NZ 3.42Å; E1016-K1065 IonicContact OE2-NZ 2.85Å; E1016-K1065 PolarHBondContact OE2-NZ 2.96Å; E1016-I1159 VanDerWaalsContact CG-O 3.24Å; E1016-I1159 WeakPolarHBondContact CG-O 3.25Å; E1016-R1160 HydrophobicContact CG-CB 4.32Å
1017	G	50.9	Low	65.2	Low	87 Å²	87	51.7 Å²	51.7	90%	0.897	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-67.1	-1.3	-179.8	0	0	0	0	0	116.1	D1015	D1015-G1017 PolarHBondContact O-N 3.09Å
1018	A	53.6	Low	65.5	Low	14 Å²	14	54.9 Å²	54.9	12%	0.116	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-127.6	6.9	173	0	0	0	0	0	113.9	P1007 V1014 D1015 E1016	P1007-A1018 WeakPolarHBondContact CG-O 3.21Å; V1014-A1018 HydrophobicContact CG1-CB 3.33Å; V1014-A1018 WeakPolarHBondContact CG1-O 3.42Å; D1015-A1018 PolarHBondContact O-N 3.45Å; E1016-A1018 PolarHBondContact O-N 2.85Å
1019	L	65.6	Low	65.8	Low	18 Å²	18	48.1 Å²	48.1	9%	0.094	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-67.2	144.6	164.2	-60.4	172.5	0	0	0	110	Y1004 P1006 V1014 E1016	Y1004-L1019 HydrophobicContact CD1-CB 3.91Å; P1006-L1019 HydrophobicContact CG-CD2 4.33Å; V1014-L1019 HydrophobicContact CB-CD2 4.22Å; V1014-L1019 HydrophobicContact CG1-CD2 4.45Å; E1016-L1019 HydrophobicContact CB-CD1 4.46Å; E1016-L1019 PolarHBondContact O-N 3.48Å
1020	Q	69	Low	65.8	Low	96 Å²	96	49.3 Å²	49.3	45%	0.449	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	152.5	174.2	-73.3	172.5	-13.9	0	0	110.1	Y1004 F1005 P1007	Y1004-Q1020 CarbonylContact C-O 3.54Å; Y1004-Q1020 WeakPolarHBondContact CA-O 3.15Å; F1005-Q1020 HydrophobicContact CD1-CB 4.24Å; F1005-Q1020 WeakPolarHBondContact CD1-O 3.47Å; F1005-Q1020 HydrophobicContact CE1-CB 3.67Å; F1005-Q1020 HydrophobicContact CZ-CB 4.12Å; F1005-Q1020 PolarHBondContact N-O 3.38Å; F1005-Q1020 PolarHBondContact O-N 2.82Å; P1007-Q1020 HydrophobicContact CG-CG 4.07Å
1021	L	78.7	Confident	65.6	Low	69 Å²	69	53.6 Å²	53.6	36%	0.361	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	134.2	166	-70.8	164	0	0	0	108.2	Y1002 Y1004 F1005 V1067	Y1002-L1021 HydrophobicContact CD1-CB 4.04Å; Y1002-L1021 HydrophobicContact CG-CB 4.47Å; Y1002-L1021 HydrophobicContact CG-CD2 4.23Å; Y1004-L1021 HydrophobicContact CD1-CD2 4.21Å; Y1004-L1021 HydrophobicContact CD2-CD2 4.35Å; Y1004-L1021 HydrophobicContact CE1-CD2 3.87Å; Y1004-L1021 HydrophobicContact CE1-CG 4.13Å; Y1004-L1021 HydrophobicContact CE2-CD2 4.03Å; Y1004-L1021 HydrophobicContact CG-CD2 4.45Å; F1005-L1021 WeakPolarHBondContact CE1-O 3.24Å; L1021-V1067 HydrophobicContact CD2-CG2 4.29Å
1022	S	82.1	Confident	64.9	Low	24 Å²	24	55 Å²	55	17%	0.168	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-56.9	169.5	178.5	67.2	0	0	0	0	112.6	Y1002 R1003	Y1002-S1022 WeakPolarHBondContact CD1-O 3.43Å; R1003-S1022 PolarHBondContact N-OG 3.48Å; R1003-S1022 WeakPolarHBondContact O-CB 3.35Å; R1003-S1022 PolarHBondContact O-N 2.99Å
1023	E	79	Confident	64.2	Low	152 Å²	152	56.6 Å²	56.6	71%	0.71	32%	0.317	S	S	*	.	S	Bend	trans	-50.7	136.2	156.4	-60.2	-59.6	161.2	0	0	109.1
1024	P	84.9	Confident	63.6	Low	35 Å²	35	65.4 Å²	65.4	23%	0.227	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-67.7	137	-176.8	24.2	-33.7	0	0	0	112.2	T1000 Y1002 Y1026	T1000-P1024 HydrophobicContact CG2-CB 3.43Å; T1000-P1024 VanDerWaalsContact CG2-CB 3.43Å; Y1002-P1024 HydrophobicContact CD1-CB 4.24Å; Y1002-P1024 HydrophobicContact CE1-CB 3.63Å; Y1002-P1024 HydrophobicContact CE1-CG 4.39Å; P1024-Y1026 HydrophobicContact CB-CE1 3.89Å; P1024-Y1026 HydrophobicContact CB-CE2 4Å; P1024-Y1026 VanDerWaalsContact CB-CZ 3.49Å; P1024-Y1026 VanDerWaalsContact CB-OH 3.3Å; P1024-Y1026 WeakPolarHBondContact CB-OH 3.35Å; P1024-Y1026 HydrophobicContact CG-CE1 4.4Å; P1024-Y1026 HydrophobicContact CG-CE2 3.9Å; P1024-Y1026 WeakPolarHBondContact CG-OH 3.26Å; P1024-Y1026 WeakPolarHBondContact O-CE2 3.24Å
1025	I	85.2	Confident	63.9	Low	33 Å²	33	66.2 Å²	66.2	17%	0.169	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	119.2	-179	-47.9	170	0	0	0	108.6	W1001 M1037 F1053	W1001-I1025 HydrophobicContact CB-CB 4.27Å; W1001-I1025 PolarHBondContact N-O 3.23Å; W1001-I1025 PolarHBondContact O-N 3.35Å; I1025-M1037 HydrophobicContact CD1-SD 4.35Å; I1025-F1053 HydrophobicContact CB-CE2 4.19Å; I1025-F1053 HydrophobicContact CD1-CE2 3.79Å; I1025-F1053 HydrophobicContact CD1-CZ 3.67Å; I1025-F1053 HydrophobicContact CG2-CE2 3.95Å
1026	Y	84	Confident	64.9	Low	31 Å²	31	67.3 Å²	67.3	12%	0.122	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	159.3	-171.6	-54.3	-72.8	0	0	0	113.1	L219 L292 T1000 P1024 N1028 Q1029	L219-Y1026 HydrophobicContact CB-CE1 4.19Å; L219-Y1026 HydrophobicContact CD1-CD1 3.91Å; L219-Y1026 HydrophobicContact CD1-CE1 3.25Å; L219-Y1026 HydrophobicContact CD2-CE1 4.17Å; L219-Y1026 VanDerWaalsContact CD2-OH 3.24Å; L219-Y1026 WeakPolarHBondContact CD2-OH 3.49Å; L219-Y1026 HydrophobicContact CG-CE1 4Å; L292-Y1026 HydrophobicContact CD2-CE2 4.29Å; T1000-Y1026 HydrophobicContact CG2-CD1 3.9Å; T1000-Y1026 HydrophobicContact CG2-CE1 3.46Å; T1000-Y1026 VanDerWaalsContact CG2-CE1 3.46Å; T1000-Y1026 WeakPolarHBondContact OG1-CE1 3.49Å; P1024-Y1026 HydrophobicContact CB-CE1 3.89Å; P1024-Y1026 HydrophobicContact CB-CE2 4Å; P1024-Y1026 VanDerWaalsContact CB-CZ 3.49Å; P1024-Y1026 VanDerWaalsContact CB-OH 3.3Å; P1024-Y1026 WeakPolarHBondContact CB-OH 3.35Å; P1024-Y1026 HydrophobicContact CG-CE1 4.4Å; P1024-Y1026 HydrophobicContact CG-CE2 3.9Å; P1024-Y1026 WeakPolarHBondContact CG-OH 3.26Å; P1024-Y1026 WeakPolarHBondContact O-CE2 3.24Å; Y1026-N1028 PolarHBondContact O-N 3.03Å; Y1026-Q1029 VanDerWaalsContact CD2-NE2 3.32Å; Y1026-Q1029 PolarHBondContact O-N 3.19Å
1027	C	79.9	Confident	66.1	Low	8 Å²	8	66.1 Å²	66.1	5%	0.054	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-41.9	130.3	169.7	-61.5	0	0	0	0	112.7	P995 D996 Q1029 C1041	P995-C1027 PolarHBondContact O-SG 3.05Å; P995-C1027 VanDerWaalsContact O-SG 3.35Å; D996-C1027 HydrophobicContact CB-CB 4.31Å; D996-C1027 WeakPolarHBondContact OD1-CB 3.45Å; C1027-Q1029 PolarHBondContact O-N 2.89Å; C1027-C1041 WeakPolarHBondContact CA-SG 3.35Å; C1027-C1041 HydrophobicContact CB-CB 3.6Å; C1027-C1041 WeakPolarHBondContact CB-SG 3.17Å; C1027-C1041 WeakPolarHBondContact SG-CB 3.3Å; C1027-C1041 CovalentContact SG-SG 2.02Å; C1027-C1041 PolarHBondContact SG-SG 2.8Å
1028	N	65.9	Low	67.7	Low	77 Å²	77	63.1 Å²	63.1	41%	0.412	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	20.7	172.1	-56.2	-41.2	0	0	0	114.4	D996 Y1026 S1030 A1039	D996-N1028 PolarHBondContact OD1-ND2 3.42Å; D996-N1028 VanDerWaalsContact OD1-ND2 3.1Å; Y1026-N1028 PolarHBondContact O-N 3.03Å; N1028-S1030 PolarHBondContact O-N 2.79Å; N1028-A1039 PolarHBondContact N-O 3.36Å
1029	Q	56.6	Low	69.3	Low	30 Å²	30	62.5 Å²	62.5	14%	0.14	32%	0.315	C	S	.	.			trans	-88.6	77.3	167.8	-69.1	-165.5	14.3	0	0	111.3	Y1026 C1027 Q1031	Y1026-Q1029 VanDerWaalsContact CD2-NE2 3.32Å; Y1026-Q1029 PolarHBondContact O-N 3.19Å; C1027-Q1029 PolarHBondContact O-N 2.89Å; Q1029-Q1031 PolarHBondContact O-N 3.34Å
1030	S	47	Very low	70.4	Confident	73 Å²	73	64.3 Å²	64.3	51%	0.51	32%	0.323	S	S	.	.			trans	-73.8	114.1	163.7	57.2	0	0	0	0	110.1	N1028	N1028-S1030 PolarHBondContact O-N 2.79Å
1031	Q	46.4	Very low	71.4	Confident	121 Å²	121	60.3 Å²	60.3	57%	0.565	31%	0.306	S	S	*	.			trans	-64.9	154.2	159.1	-71.8	-167.2	-8	0	0	110	H275 Q1029 D1033 P1035	H275-Q1031 PolarHBondContact NE2-NE2 3.32Å; Q1029-Q1031 PolarHBondContact O-N 3.34Å; Q1031-D1033 PolarHBondContact O-N 3.05Å; Q1031-P1035 HydrophobicContact CB-CB 4.24Å; Q1031-P1035 VanDerWaalsContact O-CD 3.32Å; Q1031-P1035 WeakPolarHBondContact O-CD 3.33Å
1032	I	42.6	Very low	71.8	Confident	69 Å²	69	61.4 Å²	61.4	35%	0.354	31%	0.308	S	S	.	.	S	Bend	trans	-53.5	129.9	-164.5	-61.1	163.2	0	0	0	112.2	L248 M264 L268	L248-I1032 HydrophobicContact CD1-CD1 3.72Å; L248-I1032 HydrophobicContact CD1-CG1 4.19Å; M264-I1032 HydrophobicContact SD-CG2 4.42Å; L268-I1032 HydrophobicContact CD1-CD1 4.5Å; L268-I1032 HydrophobicContact CD2-CD1 4.11Å; L268-I1032 HydrophobicContact CG-CD1 4.41Å
1033	D	42.2	Very low	72	Confident	112 Å²	112	65.4 Å²	65.4	60%	0.599	32%	0.324	S	S	*	.	S	Bend	trans	49.8	91.5	171.5	-146.5	-10.2	0	0	0	116.2	Q1031	Q1031-D1033 PolarHBondContact O-N 3.05Å
1034	K	48.5	Very low	71.9	Confident	190 Å²	190	63 Å²	63	83%	0.826	31%	0.312	S	S	*	.	S	Bend	trans	53.5	72.5	-176.5	-64.1	-173.4	178.9	-176.7	0	113.8	K1036	K1034-K1036 PolarHBondContact O-N 3.13Å
1035	P	62.3	Low	71.8	Confident	25 Å²	25	66.1 Å²	66.1	16%	0.162	33%	0.327	C	S	.	.			trans	-63.6	140	174.3	31.3	-35.4	0	0	0	110	Q1031 M1037	Q1031-P1035 HydrophobicContact CB-CB 4.24Å; Q1031-P1035 VanDerWaalsContact O-CD 3.32Å; Q1031-P1035 WeakPolarHBondContact O-CD 3.33Å; P1035-M1037 WeakPolarHBondContact CB-O 3.25Å; P1035-M1037 PolarHBondContact O-N 2.69Å; P1035-M1037 VanDerWaalsContact O-N 3.09Å
1036	K	79.1	Confident	71.6	Confident	75 Å²	75	69.9 Å²	69.9	33%	0.326	34%	0.343	S	S	.	.	S	Bend	trans	-59.5	-22.3	176.2	-158.5	-172.8	-176.5	-164.8	0	112.5	K1034 I1055 Y1056 Q1057 T1059 D1062	K1034-K1036 PolarHBondContact O-N 3.13Å; K1036-I1055 CarbonylContact O-C 3.21Å; K1036-I1055 VanDerWaalsContact O-CA 3.3Å; K1036-I1055 WeakPolarHBondContact O-CA 3.49Å; K1036-Y1056 WeakPolarHBondContact CE-O 3.47Å; K1036-Y1056 WeakPolarHBondContact CG-O 3.19Å; K1036-Y1056 PolarHBondContact O-N 2.91Å; K1036-Q1057 WeakPolarHBondContact CE-O 3.26Å; K1036-T1059 PolarHBondContact NZ-OG1 2.81Å; K1036-T1059 VanDerWaalsContact NZ-OG1 3.1Å; K1036-D1062 WeakPolarHBondContact CE-OD1 3.11Å; K1036-D1062 WeakPolarHBondContact CE-OD2 3.22Å; K1036-D1062 IonicContact NZ-OD1 3.36Å; K1036-D1062 PolarHBondContact NZ-OD1 3.09Å; K1036-D1062 IonicContact NZ-OD2 3.5Å; K1036-D1062 PolarHBondContact NZ-OD2 3.32Å
1037	M	83.7	Confident	71.8	Confident	49 Å²	49	70.4 Å²	70.4	24%	0.241	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	134.3	-175.2	-50.4	176.3	105.2	0	0	109.6	I1025 P1035 F1053 Y1054 I1055 Y1066	I1025-M1037 HydrophobicContact CD1-SD 4.35Å; P1035-M1037 WeakPolarHBondContact CB-O 3.25Å; P1035-M1037 PolarHBondContact O-N 2.69Å; P1035-M1037 VanDerWaalsContact O-N 3.09Å; M1037-F1053 HydrophobicContact CB-CE2 4.42Å; M1037-F1053 HydrophobicContact CB-CZ 3.87Å; M1037-F1053 HydrophobicContact CE-CE1 4.04Å; M1037-F1053 HydrophobicContact CE-CZ 3.94Å; M1037-F1053 HydrophobicContact CG-CZ 4.46Å; M1037-F1053 HydrophobicContact SD-CZ 4.5Å; M1037-Y1054 CarbonylContact C-O 3.5Å; M1037-Y1054 VanDerWaalsContact CA-O 3.31Å; M1037-Y1054 WeakPolarHBondContact CA-O 3.3Å; M1037-I1055 HydrophobicContact CE-CG1 4.36Å; M1037-Y1066 HydrophobicContact CE-CE1 3.59Å
1038	L	84.6	Confident	72.3	Confident	25 Å²	25	74 Å²	74	13%	0.131	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	117.4	-177.7	179.7	66.1	0	0	0	111.6	Q1040 Y1054 Y1056	L1038-Q1040 HydrophobicContact CD2-CG 4.02Å; L1038-Q1040 HydrophobicContact CG-CG 4.12Å; L1038-Y1054 PolarHBondContact N-O 2.84Å; L1038-Y1054 PolarHBondContact O-N 3.23Å; L1038-Y1056 HydrophobicContact CB-CE2 4.27Å
1039	A	88.5	Confident	73.6	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	114	166.5	0	0	0	0	0	109.9	N1028 F1053	N1028-A1039 PolarHBondContact N-O 3.36Å; A1039-F1053 HydrophobicContact CB-CD2 4Å
1040	Q	88	Confident	75.4	Confident	56 Å²	56	69.3 Å²	69.3	26%	0.262	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	148.1	165.4	-64.2	-174.3	-21.8	0	0	109.2	L1038 F1042 S1051 T1052 Y1054	L1038-Q1040 HydrophobicContact CD2-CG 4.02Å; L1038-Q1040 HydrophobicContact CG-CG 4.12Å; Q1040-F1042 HydrophobicContact CB-CE2 3.81Å; Q1040-F1042 HydrophobicContact CB-CZ 3.63Å; Q1040-S1051 CarbonylContact O-C 3.53Å; Q1040-S1051 WeakPolarHBondContact O-CA 3.32Å; Q1040-S1051 WeakPolarHBondContact O-CB 3.47Å; Q1040-S1051 PolarHBondContact O-OG 3.16Å; Q1040-T1052 PolarHBondContact N-O 2.86Å; Q1040-T1052 PolarHBondContact O-N 3.39Å; Q1040-Y1054 HydrophobicContact CB-CE2 4.24Å; Q1040-Y1054 HydrophobicContact CG-CD2 4.2Å; Q1040-Y1054 HydrophobicContact CG-CE2 3.99Å
1041	C	90.1	Very high	77.6	Confident	12 Å²	12	65.8 Å²	65.8	8%	0.081	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	139.2	-177.2	-62.8	0	0	0	0	111.2	P995 C1027 S1050 S1051	P995-C1041 HydrophobicContact CB-CB 3.86Å; C1027-C1041 WeakPolarHBondContact CA-SG 3.35Å; C1027-C1041 HydrophobicContact CB-CB 3.6Å; C1027-C1041 WeakPolarHBondContact CB-SG 3.17Å; C1027-C1041 WeakPolarHBondContact SG-CB 3.3Å; C1027-C1041 CovalentContact SG-SG 2.02Å; C1027-C1041 PolarHBondContact SG-SG 2.8Å; C1041-S1050 CarbonylContact C-O 3.5Å; C1041-S1050 WeakPolarHBondContact CA-O 3.38Å; C1041-S1051 VanDerWaalsContact SG-CB 3.55Å; C1041-S1051 PolarHBondContact SG-OG 3.5Å
1042	F	86.9	Confident	79.8	Confident	93 Å²	93	60.7 Å²	60.7	41%	0.408	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	137.2	-170.7	-44.7	-83.8	0	0	0	110.8	Q1040 S1050	Q1040-F1042 HydrophobicContact CB-CE2 3.81Å; Q1040-F1042 HydrophobicContact CB-CZ 3.63Å; F1042-S1050 PolarHBondContact N-O 2.67Å; F1042-S1050 PolarHBondContact O-N 3.28Å; F1042-S1050 PolarHBondContact O-OG 2.87Å
1043	Q	85.5	Confident	82.2	Confident	108 Å²	108	57.5 Å²	57.5	51%	0.505	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	124.5	165.5	-174.9	164.2	8.7	0	0	108.6	P995 D1045 K1046 I1049	P995-Q1043 HydrophobicContact CG-CB 3.83Å; Q1043-D1045 WeakPolarHBondContact CG-O 3.45Å; Q1043-D1045 PolarHBondContact NE2-O 3.46Å; Q1043-K1046 PolarHBondContact NE2-O 3.45Å; Q1043-I1049 HydrophobicContact CG-CG2 4.41Å
1044	Q	78.8	Confident	84.4	Confident	100 Å²	100	54.6 Å²	54.6	47%	0.467	26%	0.255	S	S	.	.			trans	-94.6	-33.7	-178.7	-58.1	-164.8	-4.9	0	0	111.6	Q1048 S1050	Q1044-Q1048 HydrophobicContact CB-CB 4.34Å; Q1044-Q1048 PolarHBondContact N-O 3.19Å; Q1044-S1050 PolarHBondContact NE2-OG 3.47Å
1045	D	81	Confident	86.4	Confident	101 Å²	101	45.5 Å²	45.5	54%	0.54	22%	0.216	S	C	.	.	S	Bend	trans	-152.1	179.9	175.7	-170.7	15.3	0	0	0	109.6	Q1043 F1047 Q1048	Q1043-D1045 WeakPolarHBondContact CG-O 3.45Å; Q1043-D1045 PolarHBondContact NE2-O 3.46Å; D1045-F1047 PolarHBondContact O-N 3.28Å; D1045-Q1048 HydrophobicContact CB-CB 4.26Å; D1045-Q1048 PolarHBondContact N-O 2.79Å; D1045-Q1048 VanDerWaalsContact N-O 3.15Å; D1045-Q1048 PolarHBondContact O-N 2.9Å
1046	K	82.3	Confident	87.6	Confident	112 Å²	112	48.3 Å²	48.3	49%	0.487	22%	0.224	S	C	.	.	S	Bend	trans	-51.6	-28.1	178.7	-170.2	176.5	177.5	-178.2	0	114	A993 Q1043	A993-K1046 WeakPolarHBondContact CB-O 3.14Å; Q1043-K1046 PolarHBondContact NE2-O 3.45Å
1047	F	88.2	Confident	87.9	Confident	42 Å²	42	52 Å²	52	18%	0.184	24%	0.242	C	C	.	.	S	Bend	trans	-123.7	-20.9	179.1	-51.8	-58.7	0	0	0	114.8	M938 Y962 A990 N991 D1045	M938-F1047 HydrophobicContact CE-CE1 3.84Å; M938-F1047 HydrophobicContact CE-CE2 4.49Å; M938-F1047 HydrophobicContact CE-CZ 3.61Å; M938-F1047 HydrophobicContact SD-CE1 4.22Å; M938-F1047 HydrophobicContact SD-CE2 4.45Å; M938-F1047 HydrophobicContact SD-CZ 3.55Å; M938-F1047 VanDerWaalsContact SD-CZ 3.55Å; Y962-F1047 VanDerWaalsContact OH-CB 3.28Å; Y962-F1047 WeakPolarHBondContact OH-CB 3.44Å; Y962-F1047 VanDerWaalsContact OH-CG 3.23Å; Y962-F1047 WeakPolarHBondContact OH-CG 3.11Å; A990-F1047 PolarHBondContact N-O 3.17Å; A990-F1047 WeakPolarHBondContact O-CA 3.35Å; N991-F1047 HydrophobicContact CB-CD1 3.83Å; N991-F1047 HydrophobicContact CB-CE1 4.12Å; D1045-F1047 PolarHBondContact O-N 3.28Å
1048	Q	90.5	Very high	88.1	Confident	85 Å²	85	50 Å²	50	40%	0.397	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	129.1	-179	-66.3	-166.8	2.1	0	0	111.7	Q1044 D1045	Q1044-Q1048 HydrophobicContact CB-CB 4.34Å; Q1044-Q1048 PolarHBondContact N-O 3.19Å; D1045-Q1048 HydrophobicContact CB-CB 4.26Å; D1045-Q1048 PolarHBondContact N-O 2.79Å; D1045-Q1048 VanDerWaalsContact N-O 3.15Å; D1045-Q1048 PolarHBondContact O-N 2.9Å
1049	I	93.3	Very high	88.2	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	156.2	-176.9	58.9	170.3	0	0	0	110	A988 A990 A993 P995 T998 F999 Q1043	A988-I1049 HydrophobicContact CB-CD1 4.46Å; A988-I1049 HydrophobicContact CB-CG1 4.07Å; A988-I1049 PolarHBondContact N-O 2.74Å; A988-I1049 WeakPolarHBondContact O-CG1 3.24Å; A988-I1049 PolarHBondContact O-N 3.36Å; A988-I1049 VanDerWaalsContact O-O 3.12Å; A990-I1049 HydrophobicContact CB-CD1 4.29Å; A993-I1049 HydrophobicContact CB-CG2 3.6Å; P995-I1049 HydrophobicContact CG-CB 4.06Å; P995-I1049 HydrophobicContact CG-CG2 3.76Å; T998-I1049 HydrophobicContact CG2-CD1 3.33Å; F999-I1049 HydrophobicContact CD2-CD1 4.44Å; F999-I1049 HydrophobicContact CE2-CB 3.87Å; F999-I1049 HydrophobicContact CE2-CD1 3.72Å; F999-I1049 HydrophobicContact CE2-CG1 3.71Å; F999-I1049 HydrophobicContact CZ-CB 4.33Å; F999-I1049 HydrophobicContact CZ-CD1 4.02Å; F999-I1049 HydrophobicContact CZ-CG1 3.8Å; Q1043-I1049 HydrophobicContact CG-CG2 4.41Å
1050	S	93.5	Very high	88.1	Confident	5 Å²	5	53.4 Å²	53.4	4%	0.035	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	155.2	-178.7	57.3	0	0	0	0	112.4	C986 C1041 F1042 Q1044	C986-S1050 CarbonylContact O-C 3.55Å; C986-S1050 VanDerWaalsContact O-CA 3.29Å; C986-S1050 WeakPolarHBondContact O-CA 3.32Å; C1041-S1050 CarbonylContact C-O 3.5Å; C1041-S1050 WeakPolarHBondContact CA-O 3.38Å; F1042-S1050 PolarHBondContact N-O 2.67Å; F1042-S1050 PolarHBondContact O-N 3.28Å; F1042-S1050 PolarHBondContact O-OG 2.87Å; Q1044-S1050 PolarHBondContact NE2-OG 3.47Å
1051	S	93.6	Very high	87.9	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	137.2	167.4	-178.7	0	0	0	0	110.4	C986 W1001 Q1040 C1041	C986-S1051 PolarHBondContact N-O 3.39Å; C986-S1051 PolarHBondContact O-N 2.69Å; W1001-S1051 PolarHBondContact NE1-OG 3.37Å; Q1040-S1051 CarbonylContact O-C 3.53Å; Q1040-S1051 WeakPolarHBondContact O-CA 3.32Å; Q1040-S1051 WeakPolarHBondContact O-CB 3.47Å; Q1040-S1051 PolarHBondContact O-OG 3.16Å; C1041-S1051 VanDerWaalsContact SG-CB 3.55Å; C1041-S1051 PolarHBondContact SG-OG 3.5Å
1052	T	92.3	Very high	87.8	Confident	14 Å²	14	54 Å²	54	9%	0.086	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	121.4	173.5	-54.3	0	0	0	0	108.3	A983 L984 D985 Q1040 Y1054	A983-T1052 HydrophobicContact CB-CG2 3.95Å; L984-T1052 WeakPolarHBondContact O-CA 3.33Å; D985-T1052 WeakPolarHBondContact OD1-CB 3.3Å; D985-T1052 VanDerWaalsContact OD1-CG2 3.25Å; D985-T1052 WeakPolarHBondContact OD1-CG2 3.3Å; D985-T1052 PolarHBondContact OD1-OG1 2.73Å; Q1040-T1052 PolarHBondContact N-O 2.86Å; Q1040-T1052 PolarHBondContact O-N 3.39Å; T1052-Y1054 HydrophobicContact CG2-CD2 4.08Å; T1052-Y1054 HydrophobicContact CG2-CE1 4.19Å; T1052-Y1054 HydrophobicContact CG2-CE2 3.49Å; T1052-Y1054 VanDerWaalsContact CG2-CE2 3.49Å
1053	F	92.6	Very high	87.9	Confident	1 Å²	1	49.9 Å²	49.9	0%	0.004	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	109.7	178.6	-172.7	-101	0	0	0	110.6	A983 L984 W1001 I1025 M1037 A1039 I1055 Y1066	A983-F1053 CarbonylContact C-O 3.53Å; A983-F1053 WeakPolarHBondContact CA-O 2.98Å; L984-F1053 HydrophobicContact CB-CB 4.22Å; L984-F1053 HydrophobicContact CD1-CD1 3.91Å; L984-F1053 HydrophobicContact CG-CD1 4.42Å; L984-F1053 PolarHBondContact N-O 2.86Å; L984-F1053 PolarHBondContact O-N 3.42Å; W1001-F1053 HydrophobicContact CB-CD2 3.9Å; W1001-F1053 HydrophobicContact CB-CE2 4.01Å; W1001-F1053 HydrophobicContact CD2-CB 3.66Å; W1001-F1053 AromaticContact CD2-CD2 3.94Å; W1001-F1053 HydrophobicContact CD2-CD2 3.94Å; W1001-F1053 AromaticContact CD2-CG 3.92Å; W1001-F1053 HydrophobicContact CD2-CG 3.92Å; W1001-F1053 HydrophobicContact CE3-CB 3.78Å; W1001-F1053 HydrophobicContact CE3-CD1 4.44Å; W1001-F1053 HydrophobicContact CE3-CD2 4.35Å; W1001-F1053 AromaticContact CE3-CG 3.97Å; W1001-F1053 HydrophobicContact CE3-CG 3.97Å; W1001-F1053 HydrophobicContact CG-CB 4.3Å; W1001-F1053 AromaticContact CG-CD2 3.73Å; W1001-F1053 HydrophobicContact CG-CD2 3.73Å; W1001-F1053 HydrophobicContact CG-CE2 4.34Å; W1001-F1053 HydrophobicContact CG-CG 4.22Å; W1001-F1053 HydrophobicContact CH2-CB 3.76Å; W1001-F1053 HydrophobicContact CZ2-CB 3.66Å; W1001-F1053 HydrophobicContact CZ3-CB 3.82Å; W1001-F1053 HydrophobicContact CZ3-CG 4.39Å; I1025-F1053 HydrophobicContact CB-CE2 4.19Å; I1025-F1053 HydrophobicContact CD1-CE2 3.79Å; I1025-F1053 HydrophobicContact CD1-CZ 3.67Å; I1025-F1053 HydrophobicContact CG2-CE2 3.95Å; M1037-F1053 HydrophobicContact CB-CE2 4.42Å; M1037-F1053 HydrophobicContact CB-CZ 3.87Å; M1037-F1053 HydrophobicContact CE-CE1 4.04Å; M1037-F1053 HydrophobicContact CE-CZ 3.94Å; M1037-F1053 HydrophobicContact CG-CZ 4.46Å; M1037-F1053 HydrophobicContact SD-CZ 4.5Å; A1039-F1053 HydrophobicContact CB-CD2 4Å; F1053-I1055 HydrophobicContact CD1-CD1 4.03Å; F1053-I1055 HydrophobicContact CD1-CG1 3.81Å; F1053-I1055 HydrophobicContact CE1-CD1 3.79Å; F1053-I1055 HydrophobicContact CE1-CG1 3.5Å; F1053-Y1066 HydrophobicContact CD1-CD1 4.47Å; F1053-Y1066 AromaticContact CE1-CD1 3.9Å; F1053-Y1066 HydrophobicContact CE1-CD1 3.9Å; F1053-Y1066 AromaticContact CE1-CE1 3.75Å; F1053-Y1066 HydrophobicContact CE1-CE1 3.75Å; F1053-Y1066 HydrophobicContact CZ-CE1 4.44Å
1054	Y	89.9	Confident	88.1	Confident	51 Å²	51	44.7 Å²	44.7	20%	0.2	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	138.6	178	-63.2	-92.7	0	0	0	110.8	Y981 A982 A983 M1037 L1038 Q1040 T1052	Y981-Y1054 HydrophobicContact CD2-CD1 4.11Å; Y981-Y1054 HydrophobicContact CE2-CD1 4.45Å; Y981-Y1054 HydrophobicContact CE2-CE1 4.49Å; A982-Y1054 CarbonylContact O-C 3.36Å; A982-Y1054 WeakPolarHBondContact O-CA 3.41Å; A983-Y1054 HydrophobicContact CB-CD1 4.04Å; A983-Y1054 HydrophobicContact CB-CE1 4.04Å; M1037-Y1054 CarbonylContact C-O 3.5Å; M1037-Y1054 VanDerWaalsContact CA-O 3.31Å; M1037-Y1054 WeakPolarHBondContact CA-O 3.3Å; L1038-Y1054 PolarHBondContact N-O 2.84Å; L1038-Y1054 PolarHBondContact O-N 3.23Å; Q1040-Y1054 HydrophobicContact CB-CE2 4.24Å; Q1040-Y1054 HydrophobicContact CG-CD2 4.2Å; Q1040-Y1054 HydrophobicContact CG-CE2 3.99Å; T1052-Y1054 HydrophobicContact CG2-CD2 4.08Å; T1052-Y1054 HydrophobicContact CG2-CE1 4.19Å; T1052-Y1054 HydrophobicContact CG2-CE2 3.49Å; T1052-Y1054 VanDerWaalsContact CG2-CE2 3.49Å
1055	I	89.9	Confident	88.6	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	109.8	170.2	-57.1	158	0	0	0	107	Y981 A982 L984 K1036 M1037 F1053 L1058 D1062 Y1066 L1084	Y981-I1055 CarbonylContact C-O 3.58Å; Y981-I1055 WeakPolarHBondContact CA-O 3.46Å; Y981-I1055 WeakPolarHBondContact CB-O 3.36Å; A982-I1055 PolarHBondContact N-O 3.18Å; A982-I1055 PolarHBondContact O-N 3.1Å; L984-I1055 HydrophobicContact CD1-CD1 4.48Å; K1036-I1055 CarbonylContact O-C 3.21Å; K1036-I1055 VanDerWaalsContact O-CA 3.3Å; K1036-I1055 WeakPolarHBondContact O-CA 3.49Å; M1037-I1055 HydrophobicContact CE-CG1 4.36Å; F1053-I1055 HydrophobicContact CD1-CD1 4.03Å; F1053-I1055 HydrophobicContact CD1-CG1 3.81Å; F1053-I1055 HydrophobicContact CE1-CD1 3.79Å; F1053-I1055 HydrophobicContact CE1-CG1 3.5Å; I1055-L1058 HydrophobicContact CB-CD2 4.17Å; I1055-L1058 HydrophobicContact CG2-CD2 3.75Å; I1055-D1062 HydrophobicContact CG2-CB 4.23Å; I1055-Y1066 HydrophobicContact CD1-CE1 3.79Å; I1055-Y1066 HydrophobicContact CD1-CE2 4.12Å; I1055-L1084 HydrophobicContact CD1-CD2 3.56Å
1056	Y	86.8	Confident	89.2	Confident	84 Å²	84	36.8 Å²	36.8	33%	0.329	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	153.5	-177.7	-61	-79.9	0	0	0	111.7	D980 Y981 K1036 L1038	D980-Y1056 WeakPolarHBondContact O-CA 3.17Å; Y981-Y1056 HydrophobicContact CG-CD1 4.48Å; K1036-Y1056 WeakPolarHBondContact CE-O 3.47Å; K1036-Y1056 WeakPolarHBondContact CG-O 3.19Å; K1036-Y1056 PolarHBondContact O-N 2.91Å; L1038-Y1056 HydrophobicContact CB-CE2 4.27Å
1057	Q	86.1	Confident	89.7	Confident	153 Å²	153	31.7 Å²	31.7	72%	0.715	15%	0.151	S	C	*	.	S	Bend	trans	53	64.9	177.4	-61.3	-174.9	-20.6	0	0	112.7	K979 D980 K1036 T1059	K979-Q1057 CarbonylContact O-C 3.52Å; K979-Q1057 WeakPolarHBondContact O-CA 3.48Å; D980-Q1057 PolarHBondContact O-N 2.82Å; K1036-Q1057 WeakPolarHBondContact CE-O 3.26Å; Q1057-T1059 PolarHBondContact O-N 2.92Å
1058	L	86.6	Confident	90	Very high	7 Å²	7	29.7 Å²	29.7	4%	0.037	14%	0.142	C	C	.	.			trans	-62.1	128.4	-173.1	-70.7	167.5	0	0	0	112.6	Q976 N978 K979 A982 I1055 D1062 L1084 Y1086	Q976-L1058 HydrophobicContact CB-CD1 4.17Å; Q976-L1058 HydrophobicContact CG-CD1 3.6Å; N978-L1058 WeakPolarHBondContact O-CD1 3.46Å; K979-L1058 PolarHBondContact O-N 3.27Å; A982-L1058 HydrophobicContact CB-CD1 3.95Å; A982-L1058 HydrophobicContact CB-CD2 4.14Å; I1055-L1058 HydrophobicContact CB-CD2 4.17Å; I1055-L1058 HydrophobicContact CG2-CD2 3.75Å; L1058-D1062 WeakPolarHBondContact CA-OD2 3.42Å; L1058-D1062 HydrophobicContact CD2-CB 4.1Å; L1058-L1084 HydrophobicContact CD2-CD2 4.11Å; L1058-Y1086 HydrophobicContact CB-CD2 4.31Å; L1058-Y1086 HydrophobicContact CB-CE2 4.44Å; L1058-Y1086 HydrophobicContact CB-CG 4.37Å
1059	T	88	Confident	90.2	Very high	52 Å²	52	27.1 Å²	27.1	32%	0.319	13%	0.13	S	C	.	.			trans	-118.6	165.9	171.7	67.4	0	0	0	0	110.7	K1036 Q1057 D1061 D1062	K1036-T1059 PolarHBondContact NZ-OG1 2.81Å; K1036-T1059 VanDerWaalsContact NZ-OG1 3.1Å; Q1057-T1059 PolarHBondContact O-N 2.92Å; T1059-D1061 PolarHBondContact O-N 2.73Å; T1059-D1061 PolarHBondContact OG1-N 3.01Å; T1059-D1062 PolarHBondContact N-OD2 3.24Å; T1059-D1062 PolarHBondContact O-N 3.38Å; T1059-D1062 PolarHBondContact OG1-OD2 3.04Å
1060	E	85.9	Confident	90.3	Very high	43 Å²	43	27 Å²	27	20%	0.201	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-21.3	170.1	61	-171.2	-134.7	0	0	113.3	F1088 K1091 R1116	E1060-F1088 HydrophobicContact CB-CB 4.11Å; E1060-F1088 HydrophobicContact CB-CD1 3.78Å; E1060-F1088 HydrophobicContact CB-CD2 3.58Å; E1060-F1088 HydrophobicContact CB-CE1 4.02Å; E1060-F1088 HydrophobicContact CB-CE2 3.81Å; E1060-F1088 HydrophobicContact CB-CG 3.56Å; E1060-F1088 HydrophobicContact CB-CZ 4.03Å; E1060-F1088 HydrophobicContact CG-CD2 4.5Å; E1060-K1091 WeakPolarHBondContact OE1-CD 3.25Å; E1060-K1091 IonicContact OE1-NZ 2.77Å; E1060-K1091 PolarHBondContact OE1-NZ 2.78Å; E1060-K1091 IonicContact OE2-NZ 2.9Å; E1060-K1091 PolarHBondContact OE2-NZ 3.37Å; E1060-R1116 PolarHBondContact O-NH2 3.33Å
1061	D	83.4	Confident	90.2	Very high	73 Å²	73	28.1 Å²	28.1	39%	0.39	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-1.8	177.6	-49.9	-57	0	0	0	114	R1003 T1059 R1116	R1003-D1061 PolarHBondContact NH1-O 3.07Å; R1003-D1061 PolarHBondContact NH2-O 3.36Å; T1059-D1061 PolarHBondContact O-N 2.73Å; T1059-D1061 PolarHBondContact OG1-N 3.01Å; D1061-R1116 IonicContact OD1-CZ 2.69Å; D1061-R1116 VanDerWaalsContact OD1-CZ 3.28Å; D1061-R1116 IonicContact OD1-NH1 3.69Å; D1061-R1116 PolarHBondContact OD1-NH1 2.9Å; D1061-R1116 IonicContact OD1-NH2 2.79Å; D1061-R1116 PolarHBondContact OD1-NH2 2.84Å
1062	D	88.6	Confident	90	Very high	7 Å²	7	29 Å²	29	4%	0.037	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-23.9	169.8	-58.2	-48.6	0	0	0	112.4	R1003 K1036 I1055 L1058 T1059 G1064 Y1066 L1084	R1003-D1062 PolarHBondContact NH2-O 2.89Å; K1036-D1062 WeakPolarHBondContact CE-OD1 3.11Å; K1036-D1062 WeakPolarHBondContact CE-OD2 3.22Å; K1036-D1062 IonicContact NZ-OD1 3.36Å; K1036-D1062 PolarHBondContact NZ-OD1 3.09Å; K1036-D1062 IonicContact NZ-OD2 3.5Å; K1036-D1062 PolarHBondContact NZ-OD2 3.32Å; I1055-D1062 HydrophobicContact CG2-CB 4.23Å; L1058-D1062 WeakPolarHBondContact CA-OD2 3.42Å; L1058-D1062 HydrophobicContact CD2-CB 4.1Å; T1059-D1062 PolarHBondContact N-OD2 3.24Å; T1059-D1062 PolarHBondContact O-N 3.38Å; T1059-D1062 PolarHBondContact OG1-OD2 3.04Å; D1062-G1064 PolarHBondContact O-N 2.79Å; D1062-Y1066 WeakPolarHBondContact O-CE2 3.43Å; D1062-Y1066 PolarHBondContact O-OH 3.38Å; D1062-L1084 HydrophobicContact CB-CD2 4.27Å
1063	V	89.9	Confident	89.6	Confident	7 Å²	7	30.7 Å²	30.7	4%	0.042	16%	0.162	C	C	.	.			trans	-54.3	134.5	176.9	-176.5	0	0	0	0	110	R1003 L1084 Y1086 F1088 P1161	R1003-V1063 PolarHBondContact NH2-O 3.27Å; V1063-L1084 WeakPolarHBondContact CG1-O 3.2Å; V1063-Y1086 HydrophobicContact CG2-CD1 4.31Å; V1063-F1088 HydrophobicContact CB-CE1 4.41Å; V1063-F1088 HydrophobicContact CG2-CD1 4.35Å; V1063-F1088 HydrophobicContact CG2-CE1 4Å; V1063-P1161 HydrophobicContact CG1-CB 4.05Å
1064	G	88.3	Confident	89.1	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	152.3	-169.9	-173.9	0	0	0	0	0	114.8	D1062 L1084	D1062-G1064 PolarHBondContact O-N 2.79Å; G1064-L1084 PolarHBondContact N-O 2.81Å; G1064-L1084 PolarHBondContact O-N 3.27Å
1065	K	90.3	Very high	88.7	Confident	35 Å²	35	31.3 Å²	31.3	15%	0.152	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	129.1	-177.2	-171.3	176.8	-79.6	170.5	0	110.5	Y1004 E1016 T1081 F1082 N1083	Y1004-K1065 HydrophobicContact CD2-CB 3.9Å; Y1004-K1065 HydrophobicContact CD2-CD 3.87Å; Y1004-K1065 HydrophobicContact CD2-CG 3.72Å; Y1004-K1065 HydrophobicContact CE2-CD 3.92Å; Y1004-K1065 HydrophobicContact CE2-CG 4.09Å; Y1004-K1065 PolarHBondContact N-O 2.81Å; E1016-K1065 WeakPolarHBondContact OE1-CE 3.31Å; E1016-K1065 IonicContact OE1-NZ 2.67Å; E1016-K1065 PolarHBondContact OE1-NZ 3.42Å; E1016-K1065 IonicContact OE2-NZ 2.85Å; E1016-K1065 PolarHBondContact OE2-NZ 2.96Å; K1065-T1081 HydrophobicContact CD-CG2 3.72Å; K1065-T1081 HydrophobicContact CG-CG2 3.45Å; K1065-T1081 VanDerWaalsContact CG-CG2 3.45Å; K1065-F1082 CarbonylContact C-O 3.58Å; K1065-F1082 WeakPolarHBondContact CA-O 3.33Å; K1065-N1083 VanDerWaalsContact CE-OD1 3.24Å; K1065-N1083 WeakPolarHBondContact CE-OD1 3.49Å
1066	Y	93.1	Very high	88.5	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	154.4	-179.3	-70.5	-98.4	0	0	0	109.9	L984 Y1002 R1003 M1037 F1053 I1055 D1062 T1081 F1082 L1084	L984-Y1066 HydrophobicContact CD1-CD1 4.32Å; L984-Y1066 HydrophobicContact CD1-CD2 4.36Å; L984-Y1066 HydrophobicContact CD1-CG 3.95Å; Y1002-Y1066 CarbonylContact O-C 3.6Å; Y1002-Y1066 WeakPolarHBondContact O-CA 3.47Å; R1003-Y1066 HydrophobicContact CB-CD1 3.89Å; R1003-Y1066 HydrophobicContact CB-CE1 3.82Å; R1003-Y1066 WeakPolarHBondContact CD-OH 3.21Å; R1003-Y1066 HydrophobicContact CG-CD1 3.9Å; R1003-Y1066 HydrophobicContact CG-CE1 3.6Å; R1003-Y1066 HydrophobicContact CG-CE2 4.26Å; R1003-Y1066 HydrophobicContact CG-CG 4.37Å; R1003-Y1066 PolarHBondContact NE-OH 3.38Å; M1037-Y1066 HydrophobicContact CE-CE1 3.59Å; F1053-Y1066 HydrophobicContact CD1-CD1 4.47Å; F1053-Y1066 AromaticContact CE1-CD1 3.9Å; F1053-Y1066 HydrophobicContact CE1-CD1 3.9Å; F1053-Y1066 AromaticContact CE1-CE1 3.75Å; F1053-Y1066 HydrophobicContact CE1-CE1 3.75Å; F1053-Y1066 HydrophobicContact CZ-CE1 4.44Å; I1055-Y1066 HydrophobicContact CD1-CE1 3.79Å; I1055-Y1066 HydrophobicContact CD1-CE2 4.12Å; D1062-Y1066 WeakPolarHBondContact O-CE2 3.43Å; D1062-Y1066 PolarHBondContact O-OH 3.38Å; Y1066-T1081 CarbonylContact O-C 3.27Å; Y1066-T1081 WeakPolarHBondContact O-CA 3.28Å; Y1066-F1082 PolarHBondContact N-O 2.88Å; Y1066-F1082 PolarHBondContact O-N 2.92Å; Y1066-L1084 HydrophobicContact CD2-CB 4.07Å; Y1066-L1084 HydrophobicContact CE2-CB 3.88Å; Y1066-L1084 HydrophobicContact CE2-CD2 3.9Å
1067	V	93.6	Very high	88.7	Confident	4 Å²	4	37.8 Å²	37.8	2%	0.024	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	127.7	-179.9	-176.5	0	0	0	0	110.1	W1001 Y1002 Y1004 L1021 K1079 K1080	W1001-V1067 CarbonylContact C-O 3.46Å; W1001-V1067 WeakPolarHBondContact CA-O 3.25Å; Y1002-V1067 PolarHBondContact N-O 3.28Å; Y1002-V1067 PolarHBondContact O-N 3.38Å; Y1004-V1067 HydrophobicContact CD2-CG2 4.1Å; Y1004-V1067 HydrophobicContact CE2-CG2 3.47Å; Y1004-V1067 VanDerWaalsContact CE2-CG2 3.47Å; L1021-V1067 HydrophobicContact CD2-CG2 4.29Å; V1067-K1079 HydrophobicContact CG1-CB 3.93Å; V1067-K1079 HydrophobicContact CG1-CD 4.1Å; V1067-K1079 HydrophobicContact CG1-CG 4.41Å; V1067-K1080 CarbonylContact C-O 3.5Å; V1067-K1080 WeakPolarHBondContact CA-O 3Å
1068	C	94.6	Very high	89	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	116.8	161.9	171.4	0	0	0	0	108.3	C986 W1001 K1079 K1080 F1082	C986-C1068 HydrophobicContact CB-CB 3.68Å; C986-C1068 WeakPolarHBondContact CB-SG 3.48Å; C986-C1068 WeakPolarHBondContact SG-CB 3.44Å; C986-C1068 CovalentContact SG-SG 2.04Å; C986-C1068 PolarHBondContact SG-SG 3.29Å; W1001-C1068 HydrophobicContact CD2-CB 4.07Å; W1001-C1068 HydrophobicContact CE3-CB 3.93Å; W1001-C1068 HydrophobicContact CH2-CB 3.87Å; W1001-C1068 HydrophobicContact CZ2-CB 3.98Å; W1001-C1068 HydrophobicContact CZ3-CB 3.84Å; C1068-K1079 CarbonylContact O-C 3.57Å; C1068-K1079 VanDerWaalsContact O-CA 3.31Å; C1068-K1079 WeakPolarHBondContact O-CA 3.42Å; C1068-K1080 HydrophobicContact CB-CB 4.4Å; C1068-K1080 PolarHBondContact N-O 3.39Å; C1068-K1080 PolarHBondContact O-N 3.32Å; C1068-F1082 HydrophobicContact CB-CE2 3.97Å
1069	E	94.4	Very high	89.3	Confident	31 Å²	31	37 Å²	37	15%	0.145	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	139.6	167.2	-175.9	174.2	120.9	0	0	109.8	T1000 Y1002 P1077 V1078 K1079	T1000-E1069 PolarHBondContact N-O 3Å; T1000-E1069 PolarHBondContact O-N 2.88Å; Y1002-E1069 HydrophobicContact CD2-CB 4.37Å; Y1002-E1069 HydrophobicContact CE2-CB 3.86Å; E1069-P1077 HydrophobicContact CG-CB 3.74Å; E1069-V1078 CarbonylContact C-O 3.17Å; E1069-V1078 WeakPolarHBondContact CA-O 3.35Å; E1069-K1079 HydrophobicContact CB-CG 4.37Å; E1069-K1079 HydrophobicContact CG-CG 4.23Å; E1069-K1079 WeakPolarHBondContact OE2-CE 3.45Å; E1069-K1079 IonicContact OE2-NZ 2.62Å; E1069-K1079 PolarHBondContact OE2-NZ 3.42Å
1070	V	94.5	Very high	89.6	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	121.3	-178.4	-162.4	0	0	0	0	109.8	A964 I966 A988 T998 F999 P1077 V1078	A964-V1070 HydrophobicContact CB-CG1 3.9Å; I966-V1070 HydrophobicContact CD1-CG2 4.2Å; I966-V1070 HydrophobicContact CG1-CG2 3.84Å; A988-V1070 HydrophobicContact CB-CG1 3.69Å; A988-V1070 HydrophobicContact CB-CG2 4.5Å; T998-V1070 HydrophobicContact CG2-CG1 3.62Å; T998-V1070 CarbonylContact O-C 3.59Å; T998-V1070 VanDerWaalsContact O-CA 3.28Å; T998-V1070 WeakPolarHBondContact O-CA 3.47Å; F999-V1070 HydrophobicContact CD1-CG1 4.21Å; F999-V1070 HydrophobicContact CD1-CG2 3.85Å; F999-V1070 HydrophobicContact CE1-CG1 3.99Å; F999-V1070 HydrophobicContact CE1-CG2 3.76Å; V1070-P1077 WeakPolarHBondContact O-CA 3.26Å; V1070-V1078 HydrophobicContact CB-CG2 3.89Å; V1070-V1078 HydrophobicContact CG2-CG2 4.48Å; V1070-V1078 PolarHBondContact N-O 3.34Å; V1070-V1078 PolarHBondContact O-N 3.09Å
1071	S	92.5	Very high	90	Very high	29 Å²	29	34 Å²	34	20%	0.203	20%	0.197	C	C	.	.			trans	-152	121.9	176	-179.4	0	0	0	0	111.7	T998 G1073	T998-S1071 WeakPolarHBondContact CA-O 3.48Å; T998-S1071 PolarHBondContact O-N 2.85Å; S1071-G1073 VanDerWaalsContact C-N 3.32Å; S1071-G1073 PolarHBondContact OG-N 3.49Å
1072	N	89.3	Confident	90.5	Very high	19 Å²	19	30.6 Å²	30.6	10%	0.102	18%	0.179	C	C	.	.			trans	-95.4	19.3	174	69.4	-20.6	0	0	0	112.8	Y962 A964 A990 N991 P992 T998 I1074	Y962-N1072 PolarHBondContact O-ND2 3.41Å; A964-N1072 HydrophobicContact CB-CB 4.33Å; A964-N1072 PolarHBondContact N-OD1 3.46Å; A964-N1072 VanDerWaalsContact N-OD1 3.16Å; A990-N1072 HydrophobicContact CB-CB 4.37Å; N991-N1072 PolarHBondContact O-ND2 2.8Å; P992-N1072 WeakPolarHBondContact O-CB 3.27Å; P992-N1072 PolarHBondContact O-ND2 3.29Å; T998-N1072 HydrophobicContact CG2-CB 4.12Å; N1072-I1074 PolarHBondContact O-N 3.01Å; N1072-I1074 PolarHBondContact OD1-N 3.44Å; N1072-I1074 PolarHBondContact OD1-O 3.17Å
1073	G	84.1	Confident	90.6	Very high	49 Å²	49	31.3 Å²	31.3	51%	0.505	18%	0.183	S	C	.	.	S	Bend	trans	77.1	1.3	-176.2	0	0	0	0	0	114.9	S1071	S1071-G1073 VanDerWaalsContact C-N 3.32Å; S1071-G1073 PolarHBondContact OG-N 3.49Å
1074	I	81.7	Confident	90.7	Very high	26 Å²	26	31 Å²	31	13%	0.133	18%	0.181	C	C	.	.	S	Bend	trans	-114.7	120.8	176.2	-56	179.7	0	0	0	108.4	P963 N1072	P963-I1074 VanDerWaalsContact CA-O 3.23Å; P963-I1074 WeakPolarHBondContact CA-O 3.34Å; P963-I1074 HydrophobicContact CB-CG2 4.4Å; P963-I1074 WeakPolarHBondContact CB-O 3.38Å; N1072-I1074 PolarHBondContact O-N 3.01Å; N1072-I1074 PolarHBondContact OD1-N 3.44Å; N1072-I1074 PolarHBondContact OD1-O 3.17Å
1075	G	81.5	Confident	90.8	Very high	39 Å²	39	32.1 Å²	32.1	40%	0.402	19%	0.187	S	C	.	.	S	Bend	trans	79.3	-166.5	-178.2	0	0	0	0	0	113.8
1076	E	86.2	Confident	90.8	Very high	167 Å²	167	31.5 Å²	31.5	78%	0.78	18%	0.184	S	C	*	.	S	Bend	trans	-84.4	142.7	178.8	-62.4	-59.8	142.9	0	0	111.2	V1078	E1076-V1078 PolarHBondContact O-N 2.92Å
1077	P	89.5	Confident	90.6	Very high	52 Å²	52	34.5 Å²	34.5	34%	0.338	20%	0.197	S	C	.	.	P	Polyproline II helix	trans	-61.2	128.7	174.7	-22.4	33.3	0	0	0	112.8	E1069 V1070	E1069-P1077 HydrophobicContact CG-CB 3.74Å; V1070-P1077 WeakPolarHBondContact O-CA 3.26Å
1078	V	92.4	Very high	90.5	Very high	48 Å²	48	34.6 Å²	34.6	29%	0.291	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	147.7	178	-62.9	0	0	0	0	110.8	I966 E1069 V1070 E1076	I966-V1078 HydrophobicContact CD1-CB 3.91Å; I966-V1078 HydrophobicContact CD1-CG2 3.67Å; I966-V1078 HydrophobicContact CG1-CB 4.48Å; I966-V1078 HydrophobicContact CG1-CG2 3.76Å; E1069-V1078 CarbonylContact C-O 3.17Å; E1069-V1078 WeakPolarHBondContact CA-O 3.35Å; V1070-V1078 HydrophobicContact CB-CG2 3.89Å; V1070-V1078 HydrophobicContact CG2-CG2 4.48Å; V1070-V1078 PolarHBondContact N-O 3.34Å; V1070-V1078 PolarHBondContact O-N 3.09Å; E1076-V1078 PolarHBondContact O-N 2.92Å
1079	K	93.6	Very high	90.4	Very high	96 Å²	96	37.1 Å²	37.1	42%	0.417	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	137.2	-171.4	-51.3	-164.1	-167.4	-147.9	0	113.2	V1067 C1068 E1069	V1067-K1079 HydrophobicContact CG1-CB 3.93Å; V1067-K1079 HydrophobicContact CG1-CD 4.1Å; V1067-K1079 HydrophobicContact CG1-CG 4.41Å; C1068-K1079 CarbonylContact O-C 3.57Å; C1068-K1079 VanDerWaalsContact O-CA 3.31Å; C1068-K1079 WeakPolarHBondContact O-CA 3.42Å; E1069-K1079 HydrophobicContact CB-CG 4.37Å; E1069-K1079 HydrophobicContact CG-CG 4.23Å; E1069-K1079 WeakPolarHBondContact OE2-CE 3.45Å; E1069-K1079 IonicContact OE2-NZ 2.62Å; E1069-K1079 PolarHBondContact OE2-NZ 3.42Å
1080	K	94.4	Very high	90.4	Very high	11 Å²	11	35.9 Å²	35.9	5%	0.048	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	127.2	170	-178.7	177.2	174.7	-171.1	0	109.9	I966 K969 L970 E972 D985 V1067 C1068 F1082	I966-K1080 HydrophobicContact CD1-CB 4Å; I966-K1080 HydrophobicContact CG2-CB 4.34Å; I966-K1080 HydrophobicContact CG2-CD 4.36Å; K969-K1080 WeakPolarHBondContact O-CD 3.43Å; K969-K1080 VanDerWaalsContact O-CE 3.3Å; K969-K1080 WeakPolarHBondContact O-CE 3.4Å; L970-K1080 CarbonylContact O-C 3.44Å; L970-K1080 WeakPolarHBondContact O-CA 3.49Å; E972-K1080 VanDerWaalsContact OE2-CE 3.28Å; E972-K1080 WeakPolarHBondContact OE2-CE 3.37Å; E972-K1080 IonicContact OE2-NZ 2.68Å; E972-K1080 PolarHBondContact OE2-NZ 3.1Å; D985-K1080 PolarHBondContact O-NZ 2.9Å; V1067-K1080 CarbonylContact C-O 3.5Å; V1067-K1080 WeakPolarHBondContact CA-O 3Å; C1068-K1080 HydrophobicContact CB-CB 4.4Å; C1068-K1080 PolarHBondContact N-O 3.39Å; C1068-K1080 PolarHBondContact O-N 3.32Å; K1080-F1082 HydrophobicContact CB-CE2 4.29Å; K1080-F1082 HydrophobicContact CD-CE1 4.13Å; K1080-F1082 HydrophobicContact CD-CE2 3.9Å; K1080-F1082 HydrophobicContact CD-CZ 3.49Å; K1080-F1082 VanDerWaalsContact CD-CZ 3.49Å; K1080-F1082 VanDerWaalsContact CE-CE1 3.42Å; K1080-F1082 HydrophobicContact CG-CD2 4.44Å; K1080-F1082 HydrophobicContact CG-CE2 3.81Å; K1080-F1082 HydrophobicContact CG-CZ 3.93Å
1081	T	93.4	Very high	90.2	Very high	22 Å²	22	40.5 Å²	40.5	14%	0.135	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	138.9	-179.7	-53.1	0	0	0	0	111	L970 E971 E972 K1065 Y1066	L970-T1081 PolarHBondContact O-N 2.86Å; E971-T1081 WeakPolarHBondContact CA-O 3.25Å; E972-T1081 PolarHBondContact N-O 2.81Å; K1065-T1081 HydrophobicContact CD-CG2 3.72Å; K1065-T1081 HydrophobicContact CG-CG2 3.45Å; K1065-T1081 VanDerWaalsContact CG-CG2 3.45Å; Y1066-T1081 CarbonylContact O-C 3.27Å; Y1066-T1081 WeakPolarHBondContact O-CA 3.28Å
1082	F	93.8	Very high	90.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	129.8	173.7	-56.7	-102.4	0	0	0	110.3	E972 I974 L984 D985 C986 W1001 K1065 Y1066 C1068 K1080	E972-F1082 HydrophobicContact CB-CD1 4.17Å; E972-F1082 CarbonylContact O-C 3.52Å; E972-F1082 VanDerWaalsContact O-CA 3.27Å; E972-F1082 WeakPolarHBondContact O-CA 3.38Å; I974-F1082 HydrophobicContact CG1-CD1 4.22Å; L984-F1082 HydrophobicContact CB-CD1 3.93Å; L984-F1082 HydrophobicContact CB-CD2 4.45Å; L984-F1082 HydrophobicContact CB-CE1 3.98Å; L984-F1082 HydrophobicContact CB-CG 4.16Å; L984-F1082 HydrophobicContact CB-CZ 4.27Å; L984-F1082 HydrophobicContact CD1-CB 4.07Å; L984-F1082 HydrophobicContact CD1-CG 4.23Å; L984-F1082 HydrophobicContact CD2-CB 4.29Å; L984-F1082 HydrophobicContact CD2-CD1 4.32Å; L984-F1082 HydrophobicContact CD2-CG 4.48Å; D985-F1082 WeakPolarHBondContact O-CE1 3.3Å; D985-F1082 VanDerWaalsContact O-CZ 3.26Å; D985-F1082 WeakPolarHBondContact O-CZ 3.11Å; C986-F1082 HydrophobicContact CB-CZ 4.29Å; W1001-F1082 HydrophobicContact CH2-CD2 4.12Å; W1001-F1082 AromaticContact CH2-CE2 3.41Å; W1001-F1082 HydrophobicContact CH2-CE2 3.41Å; W1001-F1082 VanDerWaalsContact CH2-CE2 3.41Å; W1001-F1082 AromaticContact CH2-CZ 3.69Å; W1001-F1082 HydrophobicContact CH2-CZ 3.69Å; W1001-F1082 AromaticContact CZ3-CD2 3.67Å; W1001-F1082 HydrophobicContact CZ3-CD2 3.67Å; W1001-F1082 AromaticContact CZ3-CE2 3.39Å; W1001-F1082 HydrophobicContact CZ3-CE2 3.39Å; W1001-F1082 HydrophobicContact CZ3-CZ 4.11Å; K1065-F1082 CarbonylContact C-O 3.58Å; K1065-F1082 WeakPolarHBondContact CA-O 3.33Å; Y1066-F1082 PolarHBondContact N-O 2.88Å; Y1066-F1082 PolarHBondContact O-N 2.92Å; C1068-F1082 HydrophobicContact CB-CE2 3.97Å; K1080-F1082 HydrophobicContact CB-CE2 4.29Å; K1080-F1082 HydrophobicContact CD-CE1 4.13Å; K1080-F1082 HydrophobicContact CD-CE2 3.9Å; K1080-F1082 HydrophobicContact CD-CZ 3.49Å; K1080-F1082 VanDerWaalsContact CD-CZ 3.49Å; K1080-F1082 VanDerWaalsContact CE-CE1 3.42Å; K1080-F1082 HydrophobicContact CG-CD2 4.44Å; K1080-F1082 HydrophobicContact CG-CE2 3.81Å; K1080-F1082 HydrophobicContact CG-CZ 3.93Å
1083	N	91.4	Very high	89.9	Confident	22 Å²	22	41 Å²	41	12%	0.118	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	108.9	169.3	-61.5	-55.5	0	0	0	108.4	E972 N973 I974 K1065 P1161	E972-N1083 PolarHBondContact O-N 2.78Å; N973-N1083 WeakPolarHBondContact OD1-CB 3.29Å; N973-N1083 PolarHBondContact OD1-ND2 2.79Å; I974-N1083 PolarHBondContact N-O 2.86Å; K1065-N1083 VanDerWaalsContact CE-OD1 3.24Å; K1065-N1083 WeakPolarHBondContact CE-OD1 3.49Å; N1083-P1161 HydrophobicContact CB-CG 3.76Å
1084	L	92.3	Very high	89.8	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	123.5	175.8	178.8	63.2	0	0	0	109.6	I974 A982 I1055 L1058 D1062 V1063 G1064 Y1066	I974-L1084 HydrophobicContact CG2-CD1 4.25Å; A982-L1084 HydrophobicContact CB-CD1 3.72Å; I1055-L1084 HydrophobicContact CD1-CD2 3.56Å; L1058-L1084 HydrophobicContact CD2-CD2 4.11Å; D1062-L1084 HydrophobicContact CB-CD2 4.27Å; V1063-L1084 WeakPolarHBondContact CG1-O 3.2Å; G1064-L1084 PolarHBondContact N-O 2.81Å; G1064-L1084 PolarHBondContact O-N 3.27Å; Y1066-L1084 HydrophobicContact CD2-CB 4.07Å; Y1066-L1084 HydrophobicContact CE2-CB 3.88Å; Y1066-L1084 HydrophobicContact CE2-CD2 3.9Å
1085	L	90.3	Very high	89.5	Confident	25 Å²	25	45 Å²	45	13%	0.131	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	127	179.7	-56	166.9	0	0	0	108.7	N973 I974 T975 Q976 E1118 P1161	N973-L1085 HydrophobicContact CB-CD1 4.49Å; I974-L1085 PolarHBondContact O-N 2.82Å; T975-L1085 CarbonylContact C-O 3.54Å; T975-L1085 WeakPolarHBondContact CA-O 3.1Å; T975-L1085 HydrophobicContact CG2-CB 4.31Å; Q976-L1085 PolarHBondContact N-O 3.3Å; L1085-E1118 HydrophobicContact CB-CG 4.32Å; L1085-E1118 HydrophobicContact CD2-CG 4.28Å; L1085-P1161 HydrophobicContact CD2-CB 3.75Å; L1085-P1161 HydrophobicContact CD2-CG 4.35Å
1086	Y	89.3	Confident	89.5	Confident	22 Å²	22	45.6 Å²	45.6	9%	0.086	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	134.2	176.7	159.2	-102.4	0	0	0	107.6	K979 L1058 V1063 F1088 E1118	K979-Y1086 WeakPolarHBondContact CD-OH 3.24Å; K979-Y1086 VanDerWaalsContact CE-OH 3.27Å; K979-Y1086 WeakPolarHBondContact CE-OH 3.48Å; K979-Y1086 HydrophobicContact CG-CE2 4.03Å; L1058-Y1086 HydrophobicContact CB-CD2 4.31Å; L1058-Y1086 HydrophobicContact CB-CE2 4.44Å; L1058-Y1086 HydrophobicContact CB-CG 4.37Å; V1063-Y1086 HydrophobicContact CG2-CD1 4.31Å; Y1086-F1088 WeakPolarHBondContact O-CD1 3.32Å; Y1086-E1118 WeakPolarHBondContact O-CB 3.43Å
1087	H	90	Very high	89.3	Confident	62 Å²	62	38.7 Å²	38.7	29%	0.287	20%	0.197	S	C	.	.			trans	-80.5	135	-166.3	-61.1	168.3	0	0	0	113.6	E1118 Q1189	H1087-E1118 CarbonylContact C-O 3.45Å; H1087-E1118 VanDerWaalsContact CA-O 3.23Å; H1087-E1118 WeakPolarHBondContact CA-O 3.22Å; H1087-Q1189 HydrophobicContact CB-CG 4.29Å
1088	F	90.6	Very high	89.2	Confident	7 Å²	7	38 Å²	38	3%	0.031	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	153.4	176.9	68.1	-83.2	0	0	0	112.5	E1060 V1063 Y1086 R1116 T1117 E1118 N1187	E1060-F1088 HydrophobicContact CB-CB 4.11Å; E1060-F1088 HydrophobicContact CB-CD1 3.78Å; E1060-F1088 HydrophobicContact CB-CD2 3.58Å; E1060-F1088 HydrophobicContact CB-CE1 4.02Å; E1060-F1088 HydrophobicContact CB-CE2 3.81Å; E1060-F1088 HydrophobicContact CB-CG 3.56Å; E1060-F1088 HydrophobicContact CB-CZ 4.03Å; E1060-F1088 HydrophobicContact CG-CD2 4.5Å; V1063-F1088 HydrophobicContact CB-CE1 4.41Å; V1063-F1088 HydrophobicContact CG2-CD1 4.35Å; V1063-F1088 HydrophobicContact CG2-CE1 4Å; Y1086-F1088 WeakPolarHBondContact O-CD1 3.32Å; F1088-R1116 VanDerWaalsContact CE2-C 3.4Å; F1088-R1116 HydrophobicContact CE2-CB 3.93Å; F1088-R1116 WeakPolarHBondContact CE2-O 2.98Å; F1088-R1116 HydrophobicContact CZ-CB 4.16Å; F1088-T1117 VanDerWaalsContact CE2-CA 3.48Å; F1088-T1117 VanDerWaalsContact CZ-CA 3.47Å; F1088-T1117 VanDerWaalsContact CZ-N 3.26Å; F1088-E1118 HydrophobicContact CD1-CB 3.87Å; F1088-E1118 HydrophobicContact CE1-CB 3.68Å; F1088-E1118 PolarHBondContact N-O 3.35Å; F1088-E1118 PolarHBondContact O-N 2.64Å; F1088-E1118 VanDerWaalsContact O-O 3.05Å; F1088-N1187 PolarHBondContact O-ND2 3.15Å
1089	P	92.9	Very high	89	Confident	52 Å²	52	37.7 Å²	37.7	34%	0.338	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	159	-178	26.6	-35.6	0	0	0	113.2	Q1189	P1089-Q1189 HydrophobicContact CB-CB 4.08Å
1090	P	94	Very high	88.8	Confident	6 Å²	6	36.9 Å²	36.9	4%	0.039	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	136.7	-177.9	-17	32.4	0	0	0	113	I1115 A1185 N1187 G1190 A1192	P1090-I1115 HydrophobicContact CB-CG2 3.88Å; P1090-A1185 HydrophobicContact CB-CB 4.1Å; P1090-A1185 WeakPolarHBondContact CG-O 3.2Å; P1090-N1187 HydrophobicContact CG-CB 4.19Å; P1090-G1190 VanDerWaalsContact CD-C 3.45Å; P1090-G1190 WeakPolarHBondContact CD-O 3.42Å; P1090-G1190 WeakPolarHBondContact CG-O 3.03Å; P1090-A1192 HydrophobicContact CB-CB 4.48Å; P1090-A1192 VanDerWaalsContact O-CB 3.27Å; P1090-A1192 WeakPolarHBondContact O-CB 3.41Å
1091	K	91.7	Very high	88.7	Confident	97 Å²	97	36.7 Å²	36.7	42%	0.422	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	109.9	173.8	-75.8	171.4	168.7	169.8	0	108.7	E1060 I1115 R1116	E1060-K1091 WeakPolarHBondContact OE1-CD 3.25Å; E1060-K1091 IonicContact OE1-NZ 2.77Å; E1060-K1091 PolarHBondContact OE1-NZ 2.78Å; E1060-K1091 IonicContact OE2-NZ 2.9Å; E1060-K1091 PolarHBondContact OE2-NZ 3.37Å; K1091-I1115 WeakPolarHBondContact O-CA 3.5Å; K1091-R1116 HydrophobicContact CB-CB 4.46Å; K1091-R1116 PolarHBondContact N-O 3.14Å; K1091-R1116 PolarHBondContact O-N 3.47Å
1092	I	90.6	Very high	88.7	Confident	20 Å²	20	36 Å²	36	10%	0.103	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	125.2	178.8	-48.7	-176.5	0	0	0	108.9	C1113 Y1114 I1115 C1183 A1185 A1192 L1194	I1092-C1113 HydrophobicContact CG2-CB 3.88Å; I1092-Y1114 CarbonylContact C-O 3.55Å; I1092-Y1114 WeakPolarHBondContact CA-O 3.37Å; I1092-Y1114 WeakPolarHBondContact CG2-O 3.43Å; I1092-I1115 HydrophobicContact CG1-CG1 3.97Å; I1092-I1115 HydrophobicContact CG1-CG2 4.4Å; I1092-I1115 HydrophobicContact CG2-CG1 4.45Å; I1092-C1183 WeakPolarHBondContact CD1-O 3.38Å; I1092-A1185 HydrophobicContact CD1-CB 4.05Å; I1092-A1185 HydrophobicContact CG1-CB 4.31Å; I1092-A1192 HydrophobicContact CD1-CB 4.45Å; I1092-A1192 HydrophobicContact CG1-CB 4.09Å; I1092-L1194 HydrophobicContact CB-CB 4.14Å; I1092-L1194 HydrophobicContact CD1-CB 4.15Å; I1092-L1194 HydrophobicContact CG2-CB 3.69Å; I1092-L1194 HydrophobicContact CG2-CD2 3.65Å; I1092-L1194 HydrophobicContact CG2-CG 4.32Å
1093	I	84.7	Confident	88.4	Confident	38 Å²	38	36.2 Å²	36.2	20%	0.195	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	127.7	-176.3	-50.1	171.5	0	0	0	109.3	E1013 L1095 Y1114 R1116 L1163	E1013-I1093 HydrophobicContact CG-CB 4.46Å; E1013-I1093 HydrophobicContact CG-CD1 3.39Å; E1013-I1093 HydrophobicContact CG-CG2 4.41Å; E1013-I1093 WeakPolarHBondContact OE1-CB 3.21Å; E1013-I1093 VanDerWaalsContact OE1-CG2 3.24Å; E1013-I1093 WeakPolarHBondContact OE1-CG2 3.49Å; I1093-L1095 PolarHBondContact O-N 2.94Å; I1093-Y1114 PolarHBondContact N-O 2.59Å; I1093-R1116 HydrophobicContact CD1-CG 4.06Å; I1093-R1116 HydrophobicContact CG1-CG 4.49Å; I1093-L1163 HydrophobicContact CD1-CD1 4.2Å
1094	Q	81.7	Confident	88.2	Confident	140 Å²	140	39.6 Å²	39.6	65%	0.654	20%	0.198	S	C	*	.			trans	-97.3	85.3	-172.1	-59.1	-169.5	-10.9	0	0	111.6	L1194	Q1094-L1194 HydrophobicContact CG-CD1 3.88Å; Q1094-L1194 HydrophobicContact CG-CD2 4.48Å
1095	L	75.4	Confident	87.8	Confident	18 Å²	18	45.3 Å²	45.3	9%	0.094	23%	0.225	C	C	.	.			trans	-93.3	134.9	174.1	-66.2	-170.7	0	0	0	113.3	T1011 E1013 I1093 R1097 Y1098 T1099 N1261	T1011-L1095 HydrophobicContact CG2-CD2 4.08Å; E1013-L1095 WeakPolarHBondContact OE1-CD1 3.35Å; E1013-L1095 WeakPolarHBondContact OE1-CG 3.39Å; E1013-L1095 WeakPolarHBondContact OE2-CD1 3.47Å; I1093-L1095 PolarHBondContact O-N 2.94Å; L1095-R1097 PolarHBondContact O-N 3.44Å; L1095-R1097 VanDerWaalsContact O-N 3.12Å; L1095-Y1098 HydrophobicContact CB-CD2 3.98Å; L1095-Y1098 HydrophobicContact CD1-CD2 3.79Å; L1095-Y1098 HydrophobicContact CD1-CE2 3.8Å; L1095-Y1098 HydrophobicContact CG-CD2 4.38Å; L1095-Y1098 PolarHBondContact O-N 3.25Å; L1095-T1099 PolarHBondContact O-N 3.31Å; L1095-T1099 PolarHBondContact O-OG1 2.95Å; L1095-N1261 HydrophobicContact CD1-CB 4.47Å; L1095-N1261 VanDerWaalsContact CD1-ND2 3.29Å; L1095-N1261 WeakPolarHBondContact CD1-ND2 3.49Å
1096	P	80.9	Confident	87.5	Confident	52 Å²	52	47.5 Å²	47.5	34%	0.338	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-28.7	171.4	-29.9	38.1	0	0	0	115	Y1098 I1208	P1096-Y1098 VanDerWaalsContact C-N 3.29Å; P1096-Y1098 PolarHBondContact O-N 2.68Å; P1096-I1208 HydrophobicContact CB-CD1 4.48Å; P1096-I1208 HydrophobicContact CG-CD1 3.87Å
1097	R	82.4	Confident	87.4	Confident	22 Å²	22	48.2 Å²	48.2	8%	0.083	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-24.3	175.3	-171.1	171.3	-172.8	-161.7	1.6	113.5	L1095 G1227 D1229 D1258	L1095-R1097 PolarHBondContact O-N 3.44Å; L1095-R1097 VanDerWaalsContact O-N 3.12Å; R1097-G1227 WeakPolarHBondContact CG-O 3.43Å; R1097-D1229 IonicContact CZ-OD2 2.76Å; R1097-D1229 IonicContact NE-OD2 2.63Å; R1097-D1229 PolarHBondContact NE-OD2 3.38Å; R1097-D1229 IonicContact NH2-OD2 2.72Å; R1097-D1229 PolarHBondContact NH2-OD2 2.89Å; R1097-D1258 IonicContact CZ-OD1 2.94Å; R1097-D1258 IonicContact NH1-OD1 2.62Å; R1097-D1258 PolarHBondContact NH1-OD1 2.89Å; R1097-D1258 IonicContact NH2-OD1 3.44Å; R1097-D1258 PolarHBondContact NH2-OD1 3.11Å
1098	Y	87	Confident	87.3	Confident	37 Å²	37	49.1 Å²	49.1	15%	0.145	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	-11.6	-171.5	-57.5	-52	0	0	0	114.9	L1095 P1096 K1100 T1112 Y1114 I1196	L1095-Y1098 HydrophobicContact CB-CD2 3.98Å; L1095-Y1098 HydrophobicContact CD1-CD2 3.79Å; L1095-Y1098 HydrophobicContact CD1-CE2 3.8Å; L1095-Y1098 HydrophobicContact CG-CD2 4.38Å; L1095-Y1098 PolarHBondContact O-N 3.25Å; P1096-Y1098 VanDerWaalsContact C-N 3.29Å; P1096-Y1098 PolarHBondContact O-N 2.68Å; Y1098-K1100 PolarHBondContact O-N 2.85Å; Y1098-T1112 HydrophobicContact CD1-CG2 4.46Å; Y1098-Y1114 HydrophobicContact CD2-CD2 4.07Å; Y1098-Y1114 AromaticContact CD2-CE2 3.69Å; Y1098-Y1114 HydrophobicContact CD2-CE2 3.69Å; Y1098-Y1114 HydrophobicContact CE2-CD2 4.11Å; Y1098-Y1114 AromaticContact CE2-CE2 3.33Å; Y1098-Y1114 HydrophobicContact CE2-CE2 3.33Å; Y1098-Y1114 AromaticContact CZ-CE2 3.91Å; Y1098-I1196 WeakPolarHBondContact O-CD1 3.41Å; Y1098-I1196 WeakPolarHBondContact O-CG1 3.07Å; Y1098-I1196 WeakPolarHBondContact O-CG2 3.47Å
1099	T	87.8	Confident	87.3	Confident	42 Å²	42	49.5 Å²	49.5	26%	0.258	26%	0.256	S	S	.	.	S	Bend	trans	-72.3	-9.8	167.1	52.4	0	0	0	0	113.3	L1095 L1194 I1196 H1197	L1095-T1099 PolarHBondContact O-N 3.31Å; L1095-T1099 PolarHBondContact O-OG1 2.95Å; T1099-L1194 HydrophobicContact CG2-CD1 4.13Å; T1099-L1194 HydrophobicContact CG2-CD2 4.43Å; T1099-I1196 WeakPolarHBondContact O-CA 3.06Å; T1099-H1197 PolarHBondContact O-N 3.49Å
1100	K	91.2	Very high	87.2	Confident	79 Å²	79	52.4 Å²	52.4	34%	0.343	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	148	172.1	-64.4	172	-178.6	169.4	0	109.3	Y1098 D1205 F1228	Y1098-K1100 PolarHBondContact O-N 2.85Å; K1100-D1205 IonicContact NZ-OD1 3.18Å; K1100-D1205 PolarHBondContact NZ-OD1 2.87Å; K1100-D1205 IonicContact NZ-OD2 3.81Å; K1100-D1205 PolarHBondContact NZ-OD2 2.83Å; K1100-F1228 HydrophobicContact CB-CB 4.25Å; K1100-F1228 HydrophobicContact CB-CD1 3.81Å; K1100-F1228 HydrophobicContact CB-CD2 3.56Å; K1100-F1228 HydrophobicContact CB-CE1 3.93Å; K1100-F1228 HydrophobicContact CB-CE2 3.72Å; K1100-F1228 HydrophobicContact CB-CG 3.61Å; K1100-F1228 HydrophobicContact CB-CZ 3.88Å; K1100-F1228 HydrophobicContact CD-CB 3.82Å; K1100-F1228 HydrophobicContact CD-CD1 3.51Å; K1100-F1228 HydrophobicContact CD-CE1 4.15Å; K1100-F1228 HydrophobicContact CD-CG 3.71Å; K1100-F1228 HydrophobicContact CG-CD1 4.33Å; K1100-F1228 HydrophobicContact CG-CG 4.33Å; K1100-F1228 WeakPolarHBondContact O-CE2 3.48Å
1101	A	92	Very high	87.1	Confident	8 Å²	8	52.1 Å²	52.1	7%	0.066	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	144.5	169.9	0	0	0	0	0	109.4	V1109 L1111 I1196 H1197 L1198 S1199	A1101-V1109 HydrophobicContact CB-CG1 3.93Å; A1101-L1111 HydrophobicContact CB-CD2 3.47Å; A1101-L1111 VanDerWaalsContact CB-CD2 3.47Å; A1101-I1196 HydrophobicContact CB-CG2 4.06Å; A1101-H1197 PolarHBondContact N-O 3.46Å; A1101-L1198 HydrophobicContact CB-CD1 3.87Å; A1101-L1198 WeakPolarHBondContact O-CA 3.38Å; A1101-S1199 PolarHBondContact O-N 2.03Å
1102	A	92.1	Very high	87.1	Confident	7 Å²	7	48 Å²	48	6%	0.058	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	162	172.2	0	0	0	0	0	111.6	V1109 S1199 F1228 G1231	A1102-V1109 VanDerWaalsContact O-CG2 3.32Å; A1102-V1109 WeakPolarHBondContact O-CG2 2.8Å; A1102-S1199 VanDerWaalsContact CA-O 3.26Å; A1102-S1199 WeakPolarHBondContact CA-O 3.43Å; A1102-S1199 WeakPolarHBondContact CB-O 3.06Å; A1102-F1228 HydrophobicContact CB-CE1 4.46Å; A1102-F1228 HydrophobicContact CB-CZ 3.7Å; A1102-G1231 VanDerWaalsContact O-CA 3.29Å; A1102-G1231 WeakPolarHBondContact O-CA 3.31Å
1103	G	87.7	Confident	87	Confident	5 Å²	5	47.1 Å²	47.1	5%	0.052	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.5	-178	173.7	0	0	0	0	0	113	S1199 T1201	G1103-S1199 PolarHBondContact N-O 3.44Å; G1103-T1201 PolarHBondContact O-N 3.34Å
1104	E	87.2	Confident	87.2	Confident	92 Å²	92	45.7 Å²	45.7	43%	0.43	23%	0.229	S	C	.	.			trans	-89.7	159.2	177.1	-58.1	-159.6	114.9	0	0	111.6	S1106 S1107 T1201 K1286	E1104-S1106 PolarHBondContact O-N 3.43Å; E1104-S1107 PolarHBondContact N-OG 2.92Å; E1104-S1107 VanDerWaalsContact N-OG 3.1Å; E1104-S1107 VanDerWaalsContact O-CB 3.26Å; E1104-S1107 WeakPolarHBondContact O-CB 3.42Å; E1104-S1107 PolarHBondContact O-N 2.9Å; E1104-S1107 PolarHBondContact O-OG 2.71Å; E1104-T1201 HydrophobicContact CG-CG2 3.73Å; E1104-K1286 IonicContact OE1-NZ 2.7Å; E1104-K1286 PolarHBondContact OE1-NZ 2.89Å
1105	Q	83.8	Confident	87.7	Confident	121 Å²	121	39 Å²	39	57%	0.565	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	133.1	178.2	-72.4	-177.9	68.6	0	0	110.7	S1107 I1173	Q1105-S1107 PolarHBondContact O-N 2.86Å; Q1105-I1173 CarbonylContact C-O 3.56Å; Q1105-I1173 WeakPolarHBondContact CA-O 3.37Å
1106	S	84.2	Confident	88.4	Confident	70 Å²	70	39.5 Å²	39.5	49%	0.49	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.1	6.3	-171	-16.1	0	0	0	0	115.5	E1104 D1172 I1173 R1174	E1104-S1106 PolarHBondContact O-N 3.43Å; S1106-D1172 VanDerWaalsContact CA-OD1 3.3Å; S1106-D1172 WeakPolarHBondContact CA-OD1 3.23Å; S1106-D1172 VanDerWaalsContact CB-OD1 3.29Å; S1106-D1172 WeakPolarHBondContact CB-OD1 3.48Å; S1106-I1173 PolarHBondContact N-O 3.25Å; S1106-R1174 PolarHBondContact OG-NH1 2.71Å
1107	S	87.1	Confident	89	Confident	37 Å²	37	37 Å²	37	26%	0.259	18%	0.182	S	C	.	.			trans	-79.3	172.7	170.5	75.9	0	0	0	0	112.3	E1104 Q1105 D1172 I1173	E1104-S1107 PolarHBondContact N-OG 2.92Å; E1104-S1107 VanDerWaalsContact N-OG 3.1Å; E1104-S1107 VanDerWaalsContact O-CB 3.26Å; E1104-S1107 WeakPolarHBondContact O-CB 3.42Å; E1104-S1107 PolarHBondContact O-N 2.9Å; E1104-S1107 PolarHBondContact O-OG 2.71Å; Q1105-S1107 PolarHBondContact O-N 2.86Å; S1107-D1172 PolarHBondContact O-N 2.84Å; S1107-I1173 PolarHBondContact O-N 2.79Å; S1107-I1173 VanDerWaalsContact O-N 3.12Å
1108	K	89.1	Confident	89.3	Confident	82 Å²	82	36.6 Å²	36.6	36%	0.357	18%	0.181	S	C	.	.			trans	-103.9	128.6	168.2	178.9	173.7	-162.9	147.6	0	108.6	W1110 E1153 A1169 V1170 N1171	K1108-W1110 HydrophobicContact CD-CZ2 4.17Å; K1108-E1153 IonicContact NZ-OE2 3.88Å; K1108-E1153 PolarHBondContact NZ-OE2 3.01Å; K1108-A1169 HydrophobicContact CD-CB 4.48Å; K1108-A1169 HydrophobicContact CG-CB 4.49Å; K1108-V1170 WeakPolarHBondContact CA-O 3.45Å; K1108-N1171 WeakPolarHBondContact CD-OD1 3.12Å; K1108-N1171 WeakPolarHBondContact CE-OD1 3.14Å; K1108-N1171 VanDerWaalsContact CG-OD1 3.28Å; K1108-N1171 WeakPolarHBondContact CG-OD1 3.23Å; K1108-N1171 PolarHBondContact NZ-OD1 2.84Å; K1108-N1171 VanDerWaalsContact NZ-OD1 3.09Å
1109	V	90.1	Very high	89.4	Confident	14 Å²	14	36.4 Å²	36.4	9%	0.085	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	146	173.9	174	0	0	0	0	110.2	A1101 A1102 A1169 V1170 I1173 L1198	A1101-V1109 HydrophobicContact CB-CG1 3.93Å; A1102-V1109 VanDerWaalsContact O-CG2 3.32Å; A1102-V1109 WeakPolarHBondContact O-CG2 2.8Å; V1109-A1169 WeakPolarHBondContact O-CA 3.5Å; V1109-V1170 PolarHBondContact N-O 3.44Å; V1109-V1170 VanDerWaalsContact N-O 3.14Å; V1109-V1170 PolarHBondContact O-N 3.12Å; V1109-I1173 HydrophobicContact CB-CD1 3.4Å; V1109-I1173 VanDerWaalsContact CB-CD1 3.4Å; V1109-I1173 HydrophobicContact CG2-CD1 3.28Å; V1109-L1198 HydrophobicContact CB-CD1 4.38Å; V1109-L1198 HydrophobicContact CG1-CD1 3.93Å
1110	W	90.4	Very high	89.5	Confident	113 Å²	113	38.4 Å²	38.4	43%	0.428	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	107.8	178.8	-62.2	99.5	0	0	0	110.4	K1108 Y1155 Q1167 L1168 A1169	K1108-W1110 HydrophobicContact CD-CZ2 4.17Å; W1110-Y1155 HydrophobicContact CH2-CD2 4.32Å; W1110-Y1155 AromaticContact CH2-CE2 3.82Å; W1110-Y1155 HydrophobicContact CH2-CE2 3.82Å; W1110-Y1155 AromaticContact CZ3-CD2 3.68Å; W1110-Y1155 HydrophobicContact CZ3-CD2 3.68Å; W1110-Y1155 AromaticContact CZ3-CE2 3.54Å; W1110-Y1155 HydrophobicContact CZ3-CE2 3.54Å; W1110-Q1167 HydrophobicContact CE3-CB 4.17Å; W1110-L1168 WeakPolarHBondContact CA-O 3.41Å; W1110-A1169 HydrophobicContact CD2-CB 4.28Å; W1110-A1169 HydrophobicContact CE3-CB 3.68Å; W1110-A1169 HydrophobicContact CH2-CB 3.87Å; W1110-A1169 HydrophobicContact CZ2-CB 4.42Å; W1110-A1169 HydrophobicContact CZ3-CB 3.46Å; W1110-A1169 VanDerWaalsContact CZ3-CB 3.46Å
1111	L	93	Very high	89.6	Confident	1 Å²	1	35 Å²	35	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	136.5	161.2	-44.3	-176.4	0	0	0	107.3	A1101 W1125 Q1167 L1168 V1170 Y1181 I1196 L1198	A1101-L1111 HydrophobicContact CB-CD2 3.47Å; A1101-L1111 VanDerWaalsContact CB-CD2 3.47Å; L1111-W1125 HydrophobicContact CB-CH2 3.83Å; L1111-W1125 HydrophobicContact CB-CZ3 3.68Å; L1111-W1125 HydrophobicContact CD1-CE3 4.38Å; L1111-W1125 HydrophobicContact CD1-CZ3 4.06Å; L1111-Q1167 CarbonylContact O-C 3.49Å; L1111-Q1167 WeakPolarHBondContact O-CA 3.35Å; L1111-L1168 HydrophobicContact CB-CB 4.22Å; L1111-L1168 HydrophobicContact CD1-CB 4.41Å; L1111-L1168 HydrophobicContact CD1-CD2 4.02Å; L1111-L1168 HydrophobicContact CG-CB 4.46Å; L1111-L1168 PolarHBondContact N-O 3.14Å; L1111-L1168 PolarHBondContact O-N 2.84Å; L1111-V1170 HydrophobicContact CD1-CG2 4.46Å; L1111-V1170 HydrophobicContact CG-CG2 4.48Å; L1111-Y1181 HydrophobicContact CD1-CD1 3.47Å; L1111-Y1181 VanDerWaalsContact CD1-CD1 3.47Å; L1111-Y1181 HydrophobicContact CD1-CD2 4.03Å; L1111-Y1181 HydrophobicContact CD1-CE1 4.17Å; L1111-Y1181 HydrophobicContact CD1-CG 3.39Å; L1111-I1196 HydrophobicContact CB-CD1 4.11Å; L1111-I1196 HydrophobicContact CD2-CG2 4.07Å; L1111-L1198 HydrophobicContact CD2-CB 4.44Å; L1111-L1198 HydrophobicContact CD2-CD1 4.27Å
1112	T	89.8	Confident	89.6	Confident	9 Å²	9	42 Å²	42	6%	0.055	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	134.5	-172.9	-59.7	0	0	0	0	110.7	Y1098 Y1114 K1165 A1166 Q1167 I1196	Y1098-T1112 HydrophobicContact CD1-CG2 4.46Å; T1112-Y1114 HydrophobicContact CG2-CD2 4.15Å; T1112-Y1114 HydrophobicContact CG2-CE2 3.57Å; T1112-K1165 HydrophobicContact CG2-CG 4.24Å; T1112-A1166 WeakPolarHBondContact CA-O 3.42Å; T1112-Q1167 HydrophobicContact CG2-CG 4.08Å; T1112-Q1167 PolarHBondContact OG1-NE2 3.23Å; T1112-I1196 WeakPolarHBondContact O-CD1 3.23Å
1113	C	90.3	Very high	89.6	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.014	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	136.2	171.4	-74.8	0	0	0	0	110.1	I1092 I1115 K1165 A1166 C1183	I1092-C1113 HydrophobicContact CG2-CB 3.88Å; C1113-I1115 HydrophobicContact CB-CD1 4.23Å; C1113-I1115 WeakPolarHBondContact O-CD1 3.34Å; C1113-K1165 CarbonylContact O-C 3.58Å; C1113-K1165 WeakPolarHBondContact O-CA 3.24Å; C1113-A1166 PolarHBondContact N-O 3.1Å; C1113-A1166 PolarHBondContact O-N 2.94Å; C1113-C1183 HydrophobicContact CB-CB 4Å; C1113-C1183 WeakPolarHBondContact SG-CB 3.41Å
1114	Y	89.1	Confident	89.8	Confident	8 Å²	8	45.4 Å²	45.4	3%	0.031	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	129.6	170	-64.9	-101.1	0	0	0	108.2	E1013 I1092 I1093 Y1098 T1112 I1159 Y1164 K1165	E1013-Y1114 HydrophobicContact CB-CD1 3.84Å; E1013-Y1114 HydrophobicContact CB-CE1 4.08Å; E1013-Y1114 HydrophobicContact CB-CG 4.13Å; E1013-Y1114 HydrophobicContact CG-CD1 3.92Å; E1013-Y1114 HydrophobicContact CG-CD2 4.33Å; E1013-Y1114 HydrophobicContact CG-CG 3.76Å; I1092-Y1114 CarbonylContact C-O 3.55Å; I1092-Y1114 WeakPolarHBondContact CA-O 3.37Å; I1092-Y1114 WeakPolarHBondContact CG2-O 3.43Å; I1093-Y1114 PolarHBondContact N-O 2.59Å; Y1098-Y1114 HydrophobicContact CD2-CD2 4.07Å; Y1098-Y1114 AromaticContact CD2-CE2 3.69Å; Y1098-Y1114 HydrophobicContact CD2-CE2 3.69Å; Y1098-Y1114 HydrophobicContact CE2-CD2 4.11Å; Y1098-Y1114 AromaticContact CE2-CE2 3.33Å; Y1098-Y1114 HydrophobicContact CE2-CE2 3.33Å; Y1098-Y1114 AromaticContact CZ-CE2 3.91Å; T1112-Y1114 HydrophobicContact CG2-CD2 4.15Å; T1112-Y1114 HydrophobicContact CG2-CE2 3.57Å; Y1114-I1159 HydrophobicContact CD1-CD1 3.96Å; Y1114-I1159 HydrophobicContact CE1-CD1 3.81Å; Y1114-Y1164 CarbonylContact C-O 3.56Å; Y1114-Y1164 WeakPolarHBondContact CA-O 3.37Å; Y1114-K1165 HydrophobicContact CD1-CB 4.08Å; Y1114-K1165 HydrophobicContact CD1-CD 4.41Å; Y1114-K1165 HydrophobicContact CD1-CG 4.31Å; Y1114-K1165 HydrophobicContact CE1-CB 4.11Å; Y1114-K1165 HydrophobicContact CE1-CD 3.63Å; Y1114-K1165 HydrophobicContact CE1-CG 3.98Å; Y1114-K1165 WeakPolarHBondContact OH-CE 3.32Å; Y1114-K1165 PolarHBondContact OH-NZ 3.35Å
1115	I	91	Very high	90.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	116.3	-174.4	-51.5	95.7	0	0	0	108.2	P1090 K1091 I1092 C1113 T1117 I1123 Y1164 A1166 A1185	P1090-I1115 HydrophobicContact CB-CG2 3.88Å; K1091-I1115 WeakPolarHBondContact O-CA 3.5Å; I1092-I1115 HydrophobicContact CG1-CG1 3.97Å; I1092-I1115 HydrophobicContact CG1-CG2 4.4Å; I1092-I1115 HydrophobicContact CG2-CG1 4.45Å; C1113-I1115 HydrophobicContact CB-CD1 4.23Å; C1113-I1115 WeakPolarHBondContact O-CD1 3.34Å; I1115-T1117 HydrophobicContact CG2-CG2 3.83Å; I1115-I1123 HydrophobicContact CD1-CD1 3.97Å; I1115-I1123 HydrophobicContact CG1-CD1 4.41Å; I1115-Y1164 PolarHBondContact N-O 2.88Å; I1115-Y1164 PolarHBondContact O-N 2.66Å; I1115-A1166 HydrophobicContact CD1-CB 3.61Å; I1115-A1185 HydrophobicContact CG1-CB 4.03Å; I1115-A1185 HydrophobicContact CG2-CB 3.99Å
1116	R	91.2	Very high	90.6	Very high	28 Å²	28	36.3 Å²	36.3	11%	0.106	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	120.3	162.3	-73.3	-173.9	65.1	-162.7	-9.3	108.5	E1012 E1060 D1061 F1088 K1091 I1093 G1162 L1163	E1012-R1116 IonicContact OE1-CZ 3.5Å; E1012-R1116 IonicContact OE1-NH1 3.25Å; E1012-R1116 PolarHBondContact OE1-NH1 2.94Å; E1012-R1116 WeakPolarHBondContact OE2-CD 3.06Å; E1012-R1116 IonicContact OE2-CZ 3.53Å; E1012-R1116 IonicContact OE2-NE 2.67Å; E1012-R1116 IonicContact OE2-NH1 3.31Å; E1012-R1116 PolarHBondContact OE2-NH1 2.81Å; E1060-R1116 PolarHBondContact O-NH2 3.33Å; D1061-R1116 IonicContact OD1-CZ 2.69Å; D1061-R1116 VanDerWaalsContact OD1-CZ 3.28Å; D1061-R1116 IonicContact OD1-NH1 3.69Å; D1061-R1116 PolarHBondContact OD1-NH1 2.9Å; D1061-R1116 IonicContact OD1-NH2 2.79Å; D1061-R1116 PolarHBondContact OD1-NH2 2.84Å; F1088-R1116 VanDerWaalsContact CE2-C 3.4Å; F1088-R1116 HydrophobicContact CE2-CB 3.93Å; F1088-R1116 WeakPolarHBondContact CE2-O 2.98Å; F1088-R1116 HydrophobicContact CZ-CB 4.16Å; K1091-R1116 HydrophobicContact CB-CB 4.46Å; K1091-R1116 PolarHBondContact N-O 3.14Å; K1091-R1116 PolarHBondContact O-N 3.47Å; I1093-R1116 HydrophobicContact CD1-CG 4.06Å; I1093-R1116 HydrophobicContact CG1-CG 4.49Å; R1116-G1162 CarbonylContact C-O 3.48Å; R1116-G1162 WeakPolarHBondContact CA-O 3.48Å; R1116-L1163 HydrophobicContact CG-CD1 4.01Å
1117	T	91.9	Very high	91	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.9	151.8	-178.2	-167.1	0	0	0	0	110.7	F1088 I1115 P1121 G1162 Y1164 N1187	F1088-T1117 VanDerWaalsContact CE2-CA 3.48Å; F1088-T1117 VanDerWaalsContact CZ-CA 3.47Å; F1088-T1117 VanDerWaalsContact CZ-N 3.26Å; I1115-T1117 HydrophobicContact CG2-CG2 3.83Å; T1117-P1121 HydrophobicContact CG2-CB 3.86Å; T1117-P1121 HydrophobicContact CG2-CG 3.64Å; T1117-G1162 PolarHBondContact N-O 2.74Å; T1117-G1162 CarbonylContact O-C 3.53Å; T1117-G1162 WeakPolarHBondContact O-CA 3.37Å; T1117-Y1164 HydrophobicContact CG2-CD2 3.73Å; T1117-Y1164 HydrophobicContact CG2-CE2 4.13Å; T1117-Y1164 WeakPolarHBondContact O-CE2 3.31Å; T1117-N1187 PolarHBondContact OG1-ND2 2.87Å
1118	E	90.2	Very high	90.9	Very high	13 Å²	13	37 Å²	37	6%	0.061	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	131.5	170.4	-167.2	64.5	-124.9	0	0	108.4	L1085 Y1086 H1087 F1088 G1162 N1187	L1085-E1118 HydrophobicContact CB-CG 4.32Å; L1085-E1118 HydrophobicContact CD2-CG 4.28Å; Y1086-E1118 WeakPolarHBondContact O-CB 3.43Å; H1087-E1118 CarbonylContact C-O 3.45Å; H1087-E1118 VanDerWaalsContact CA-O 3.23Å; H1087-E1118 WeakPolarHBondContact CA-O 3.22Å; F1088-E1118 HydrophobicContact CD1-CB 3.87Å; F1088-E1118 HydrophobicContact CE1-CB 3.68Å; F1088-E1118 PolarHBondContact N-O 3.35Å; F1088-E1118 PolarHBondContact O-N 2.64Å; F1088-E1118 VanDerWaalsContact O-O 3.05Å; E1118-G1162 WeakPolarHBondContact OE2-CA 3.4Å; E1118-G1162 PolarHBondContact OE2-N 3.44Å; E1118-N1187 VanDerWaalsContact C-ND2 3.34Å; E1118-N1187 PolarHBondContact O-ND2 3.24Å; E1118-N1187 VanDerWaalsContact O-ND2 3.12Å
1119	P	89	Confident	90.7	Very high	34 Å²	34	39.2 Å²	39.2	22%	0.221	20%	0.199	C	C	.	.	S	Bend	cis	-71.2	176.2	-2.5	33.8	-37.9	0	0	0	113.5	N1187	P1119-N1187 PolarHBondContact O-ND2 2.88Å
1120	T	89.3	Confident	90.6	Very high	83 Å²	83	46 Å²	46	51%	0.509	23%	0.228	S	C	.	.			trans	-35.4	128.7	176	-49.1	0	0	0	0	113.6	L1156 Y1164	T1120-L1156 HydrophobicContact CG2-CD2 4.11Å; T1120-Y1164 HydrophobicContact CG2-CD1 4.34Å; T1120-Y1164 HydrophobicContact CG2-CE1 3.78Å; T1120-Y1164 PolarHBondContact OG1-OH 3.07Å
1121	P	92.4	Very high	90.6	Very high	7 Å²	7	46.9 Å²	46.9	5%	0.045	24%	0.24	C	C	.	.			trans	-82.1	149.5	-177.2	33.1	-33.2	0	0	0	112.6	T1117 I1123 L1156 Y1164 A1185 A1186	T1117-P1121 HydrophobicContact CG2-CB 3.86Å; T1117-P1121 HydrophobicContact CG2-CG 3.64Å; P1121-I1123 HydrophobicContact CB-CD1 3.99Å; P1121-I1123 HydrophobicContact CG-CD1 3.85Å; P1121-I1123 HydrophobicContact CG-CG1 4.33Å; P1121-L1156 HydrophobicContact CG-CD1 4.42Å; P1121-L1156 HydrophobicContact CG-CD2 4.33Å; P1121-L1156 WeakPolarHBondContact O-CD2 3.46Å; P1121-Y1164 HydrophobicContact CG-CG 4.33Å; P1121-A1185 HydrophobicContact CB-CB 4.45Å; P1121-A1186 CarbonylContact C-O 3.55Å; P1121-A1186 WeakPolarHBondContact CA-O 3.26Å
1122	Q	92.5	Very high	90.4	Very high	155 Å²	155	47.5 Å²	47.5	72%	0.724	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	133.2	154.7	-62.6	-176.4	-2.3	0	0	108.4	A1185 A1186	Q1122-A1185 WeakPolarHBondContact O-CA 3.32Å; Q1122-A1186 PolarHBondContact N-O 2.75Å; Q1122-A1186 PolarHBondContact O-N 3.09Å
1123	I	92.2	Very high	90.1	Very high	34 Å²	34	51 Å²	51	17%	0.174	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	128.5	-179.2	-58.8	-61.4	0	0	0	110	I1115 P1121 L1156 A1166 Q1184 A1185	I1115-I1123 HydrophobicContact CD1-CD1 3.97Å; I1115-I1123 HydrophobicContact CG1-CD1 4.41Å; P1121-I1123 HydrophobicContact CB-CD1 3.99Å; P1121-I1123 HydrophobicContact CG-CD1 3.85Å; P1121-I1123 HydrophobicContact CG-CG1 4.33Å; I1123-L1156 HydrophobicContact CG1-CD1 3.96Å; I1123-L1156 HydrophobicContact CG1-CD2 4.16Å; I1123-A1166 HydrophobicContact CD1-CB 4.16Å; I1123-A1166 HydrophobicContact CG1-CB 4.1Å; I1123-A1166 HydrophobicContact CG2-CB 3.94Å; I1123-Q1184 WeakPolarHBondContact CA-O 3.29Å; I1123-A1185 HydrophobicContact CD1-CB 3.55Å
1124	V	92.2	Very high	89.7	Confident	50 Å²	50	52.9 Å²	52.9	30%	0.303	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	134.3	175.3	171.6	0	0	0	0	108.7	L1126 L1131 Q1184	V1124-L1126 HydrophobicContact CG1-CD2 3.8Å; V1124-L1126 HydrophobicContact CG1-CG 4.34Å; V1124-L1131 HydrophobicContact CG1-CD2 3.43Å; V1124-L1131 VanDerWaalsContact CG1-CD2 3.43Å; V1124-Q1184 HydrophobicContact CB-CB 4.26Å; V1124-Q1184 PolarHBondContact N-O 3Å; V1124-Q1184 PolarHBondContact O-N 2.99Å
1125	W	94.1	Very high	89.2	Confident	5 Å²	5	58.5 Å²	58.5	2%	0.019	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	127.3	172.7	-70.6	92.1	0	0	0	110.4	L1111 I1132 M1134 A1166 L1168 S1182 C1183 I1196	L1111-W1125 HydrophobicContact CB-CH2 3.83Å; L1111-W1125 HydrophobicContact CB-CZ3 3.68Å; L1111-W1125 HydrophobicContact CD1-CE3 4.38Å; L1111-W1125 HydrophobicContact CD1-CZ3 4.06Å; W1125-I1132 HydrophobicContact CB-CD1 4.03Å; W1125-I1132 WeakPolarHBondContact O-CG1 3.49Å; W1125-I1132 PolarHBondContact O-N 3.11Å; W1125-I1132 VanDerWaalsContact O-N 3.08Å; W1125-M1134 HydrophobicContact CB-CE 3.98Å; W1125-M1134 HydrophobicContact CG-CE 4.5Å; W1125-A1166 HydrophobicContact CZ2-CB 4.15Å; W1125-L1168 HydrophobicContact CB-CD1 4.4Å; W1125-L1168 HydrophobicContact CB-CD2 4.22Å; W1125-L1168 HydrophobicContact CD2-CB 3.66Å; W1125-L1168 HydrophobicContact CD2-CD1 4.47Å; W1125-L1168 HydrophobicContact CD2-CD2 4.17Å; W1125-L1168 HydrophobicContact CD2-CG 4.32Å; W1125-L1168 HydrophobicContact CE3-CB 3.89Å; W1125-L1168 HydrophobicContact CE3-CD2 4.14Å; W1125-L1168 HydrophobicContact CG-CB 4.16Å; W1125-L1168 HydrophobicContact CG-CD1 4.09Å; W1125-L1168 HydrophobicContact CG-CD2 4.22Å; W1125-L1168 HydrophobicContact CG-CG 4.39Å; W1125-L1168 HydrophobicContact CH2-CB 4.11Å; W1125-L1168 HydrophobicContact CZ2-CB 3.9Å; W1125-L1168 HydrophobicContact CZ3-CB 4.1Å; W1125-S1182 WeakPolarHBondContact CA-O 3.37Å; W1125-C1183 HydrophobicContact CD2-CB 4.34Å; W1125-C1183 HydrophobicContact CE3-CB 4.01Å; W1125-C1183 HydrophobicContact CH2-CB 3.78Å; W1125-C1183 HydrophobicContact CZ2-CB 4.1Å; W1125-C1183 HydrophobicContact CZ3-CB 3.73Å; W1125-I1196 HydrophobicContact CH2-CD1 4.4Å; W1125-I1196 HydrophobicContact CZ3-CD1 4.28Å
1126	L	93.8	Very high	88.4	Confident	17 Å²	17	61 Å²	61	9%	0.089	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	149.2	176.9	-51.4	177	0	0	0	109.8	V1124 K1130 L1131 Y1181 S1182	V1124-L1126 HydrophobicContact CG1-CD2 3.8Å; V1124-L1126 HydrophobicContact CG1-CG 4.34Å; L1126-K1130 CarbonylContact C-O 3.51Å; L1126-K1130 VanDerWaalsContact CA-O 3.24Å; L1126-K1130 WeakPolarHBondContact CA-O 3.24Å; L1126-L1131 HydrophobicContact CD2-CD2 4.13Å; L1126-L1131 HydrophobicContact CD2-CG 4.09Å; L1126-Y1181 CarbonylContact O-C 3.54Å; L1126-Y1181 VanDerWaalsContact O-CA 3.31Å; L1126-Y1181 WeakPolarHBondContact O-CA 3.4Å; L1126-S1182 PolarHBondContact N-O 3.24Å; L1126-S1182 PolarHBondContact O-N 2.91Å
1127	K	92.1	Very high	87.5	Confident	31 Å²	31	64.3 Å²	64.3	14%	0.135	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	130.2	161.8	-168.8	-162.7	176.5	179	0	108.4	N1129 K1130 I1132 Y1176 D1177 S1180 Y1181	K1127-N1129 PolarHBondContact O-N 3.44Å; K1127-K1130 PolarHBondContact N-O 2.88Å; K1127-K1130 PolarHBondContact O-N 3.09Å; K1127-I1132 HydrophobicContact CB-CD1 3.99Å; K1127-I1132 HydrophobicContact CB-CG1 3.95Å; K1127-Y1176 PolarHBondContact NZ-O 2.98Å; K1127-D1177 WeakPolarHBondContact CE-O 3.34Å; K1127-D1177 PolarHBondContact NZ-O 3.25Å; K1127-D1177 VanDerWaalsContact NZ-O 3.09Å; K1127-S1180 WeakPolarHBondContact CA-O 3.43Å; K1127-Y1181 HydrophobicContact CB-CD1 4.03Å; K1127-Y1181 HydrophobicContact CB-CE1 3.93Å; K1127-Y1181 HydrophobicContact CD-CE1 4Å; K1127-Y1181 HydrophobicContact CD-CE2 4.2Å; K1127-Y1181 HydrophobicContact CG-CD1 4.06Å; K1127-Y1181 HydrophobicContact CG-CD2 4.33Å; K1127-Y1181 HydrophobicContact CG-CE1 3.78Å; K1127-Y1181 HydrophobicContact CG-CE2 4.04Å; K1127-Y1181 HydrophobicContact CG-CG 4.33Å
1128	D	85.4	Confident	86.1	Confident	92 Å²	92	66.3 Å²	66.3	49%	0.492	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	44.1	-179.2	-48.2	-50.8	0	0	0	112.1	K1130 S1180	D1128-K1130 VanDerWaalsContact C-N 3.27Å; D1128-K1130 PolarHBondContact O-N 3.44Å; D1128-S1180 PolarHBondContact N-O 3.47Å
1129	N	84	Confident	84.6	Confident	128 Å²	128	74.7 Å²	74.7	68%	0.684	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	23.3	-173.7	-64.4	-26.4	0	0	0	116.4	K1127	K1127-N1129 PolarHBondContact O-N 3.44Å
1130	K	89.4	Confident	82.8	Confident	157 Å²	157	77.2 Å²	77.2	68%	0.683	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.6	140.2	175.8	-65.1	170.6	-174.5	170.4	0	111.4	L1126 K1127 D1128 I1132	L1126-K1130 CarbonylContact C-O 3.51Å; L1126-K1130 VanDerWaalsContact CA-O 3.24Å; L1126-K1130 WeakPolarHBondContact CA-O 3.24Å; K1127-K1130 PolarHBondContact N-O 2.88Å; K1127-K1130 PolarHBondContact O-N 3.09Å; D1128-K1130 VanDerWaalsContact C-N 3.27Å; D1128-K1130 PolarHBondContact O-N 3.44Å; K1130-I1132 PolarHBondContact O-N 3.04Å
1131	L	89.7	Confident	81	Confident	131 Å²	131	83.1 Å²	83.1	69%	0.686	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53.6	130.6	174	-82.1	159.2	0	0	0	111.6	V1124 L1126 P1133	V1124-L1131 HydrophobicContact CG1-CD2 3.43Å; V1124-L1131 VanDerWaalsContact CG1-CD2 3.43Å; L1126-L1131 HydrophobicContact CD2-CD2 4.13Å; L1126-L1131 HydrophobicContact CD2-CG 4.09Å; L1131-P1133 WeakPolarHBondContact O-CD 3.48Å
1132	I	89.3	Confident	79.1	Confident	14 Å²	14	89 Å²	89	7%	0.072	46%	0.458	C	S	.	.			trans	-81.2	119.5	177.8	-63.9	179.6	0	0	0	110.3	W1125 K1127 K1130 M1134 Y1152 L1168 Y1181	W1125-I1132 HydrophobicContact CB-CD1 4.03Å; W1125-I1132 WeakPolarHBondContact O-CG1 3.49Å; W1125-I1132 PolarHBondContact O-N 3.11Å; W1125-I1132 VanDerWaalsContact O-N 3.08Å; K1127-I1132 HydrophobicContact CB-CD1 3.99Å; K1127-I1132 HydrophobicContact CB-CG1 3.95Å; K1130-I1132 PolarHBondContact O-N 3.04Å; I1132-M1134 HydrophobicContact CB-CE 4.04Å; I1132-M1134 HydrophobicContact CG2-CE 4.03Å; I1132-M1134 HydrophobicContact CG2-SD 4.35Å; I1132-M1134 PolarHBondContact O-N 1.94Å; I1132-M1134 VanDerWaalsContact O-N 3.13Å; I1132-Y1152 HydrophobicContact CG2-CD1 3.86Å; I1132-Y1152 HydrophobicContact CG2-CD2 3.33Å; I1132-Y1152 HydrophobicContact CG2-CE1 4.16Å; I1132-Y1152 HydrophobicContact CG2-CE2 3.68Å; I1132-Y1152 HydrophobicContact CG2-CG 3.42Å; I1132-Y1152 VanDerWaalsContact CG2-CG 3.42Å; I1132-L1168 HydrophobicContact CD1-CD2 3.68Å; I1132-Y1181 HydrophobicContact CD1-CD1 3.71Å; I1132-Y1181 HydrophobicContact CD1-CE1 3.76Å
1133	P	83.8	Confident	76.6	Confident	83 Å²	83	86.4 Å²	86.4	54%	0.539	46%	0.457	S	S	.	.			trans	-74.3	102.9	177.2	24.6	-28.1	0	0	0	111.8	L1131 D1135 T1136	L1131-P1133 WeakPolarHBondContact O-CD 3.48Å; P1133-D1135 PolarHBondContact O-N 2.84Å; P1133-D1135 VanDerWaalsContact O-N 3.13Å; P1133-T1136 WeakPolarHBondContact CG-OG1 3Å; P1133-T1136 WeakPolarHBondContact O-CB 3.3Å; P1133-T1136 PolarHBondContact O-N 2.6Å; P1133-T1136 VanDerWaalsContact O-N 3.12Å; P1133-T1136 PolarHBondContact O-OG1 3.16Å
1134	M	82.1	Confident	74.8	Confident	41 Å²	41	92.4 Å²	92.4	20%	0.202	49%	0.489	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-10.1	-175.4	-62.5	-60.9	165.3	0	0	115.2	W1125 I1132 K1150 N1154 L1168	W1125-M1134 HydrophobicContact CB-CE 3.98Å; W1125-M1134 HydrophobicContact CG-CE 4.5Å; I1132-M1134 HydrophobicContact CB-CE 4.04Å; I1132-M1134 HydrophobicContact CG2-CE 4.03Å; I1132-M1134 HydrophobicContact CG2-SD 4.35Å; I1132-M1134 PolarHBondContact O-N 1.94Å; I1132-M1134 VanDerWaalsContact O-N 3.13Å; M1134-K1150 WeakPolarHBondContact O-CD 3.28Å; M1134-K1150 PolarHBondContact O-NZ 2.71Å; M1134-N1154 HydrophobicContact CE-CB 4.23Å; M1134-N1154 HydrophobicContact SD-CB 4.21Å; M1134-L1168 HydrophobicContact CE-CD1 3.83Å; M1134-L1168 HydrophobicContact SD-CD1 4.1Å
1135	D	77.8	Confident	72.4	Confident	126 Å²	126	94.3 Å²	94.3	67%	0.674	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	10.1	175.9	-61.2	-52.2	0	0	0	113.3	P1133 L1137 K1150	P1133-D1135 PolarHBondContact O-N 2.84Å; P1133-D1135 VanDerWaalsContact O-N 3.13Å; D1135-L1137 PolarHBondContact O-N 2.83Å; D1135-L1137 VanDerWaalsContact O-N 3.12Å; D1135-K1150 IonicContact OD1-NZ 3.36Å; D1135-K1150 PolarHBondContact OD1-NZ 3.31Å
1136	T	74.7	Confident	70.4	Confident	52 Å²	52	104.4 Å²	104.4	32%	0.319	55%	0.549	S	S	.	.			trans	-62.8	112.3	170.5	-55.4	0	0	0	0	110	P1133 K1151	P1133-T1136 WeakPolarHBondContact CG-OG1 3Å; P1133-T1136 WeakPolarHBondContact O-CB 3.3Å; P1133-T1136 PolarHBondContact O-N 2.6Å; P1133-T1136 VanDerWaalsContact O-N 3.12Å; P1133-T1136 PolarHBondContact O-OG1 3.16Å; T1136-K1151 HydrophobicContact CG2-CB 3.8Å; T1136-K1151 HydrophobicContact CG2-CG 4.26Å; T1136-K1151 WeakPolarHBondContact O-CB 3.41Å; T1136-K1151 PolarHBondContact O-N 2.71Å
1137	L	71.2	Confident	68.6	Low	97 Å²	97	110 Å²	110	51%	0.508	58%	0.579	S	S	.	*	B	Isolated β-bridge	trans	-90.4	142.9	173.9	-60.2	-179	0	0	0	111.1	D1135 Q1139 K1150	D1135-L1137 PolarHBondContact O-N 2.83Å; D1135-L1137 VanDerWaalsContact O-N 3.12Å; L1137-Q1139 PolarHBondContact O-N 2.03Å; L1137-K1150 HydrophobicContact CD2-CG 4Å
1138	I	63	Low	67.2	Low	43 Å²	43	110.5 Å²	110.5	22%	0.221	59%	0.593	C	S	.	*			trans	-71.4	120.5	170.2	-63	166.2	0	0	0	108.1	S1140 I1149 K1151 N1171 D1172	I1138-S1140 PolarHBondContact O-N 3.29Å; I1138-I1149 HydrophobicContact CD1-CB 4.19Å; I1138-I1149 HydrophobicContact CD1-CG2 3.97Å; I1138-I1149 PolarHBondContact N-O 2.8Å; I1138-K1151 HydrophobicContact CG1-CB 4.11Å; I1138-K1151 HydrophobicContact CG1-CD 4.15Å; I1138-N1171 HydrophobicContact CD1-CB 3.87Å; I1138-D1172 HydrophobicContact CD1-CB 3.73Å
1139	Q	58.5	Low	66.4	Low	188 Å²	188	111.3 Å²	111.3	88%	0.879	60%	0.596	S	S	*	*			trans	-71.3	91.8	177.3	-67.9	-175.3	0.4	0	0	110.5	L1137 K1141	L1137-Q1139 PolarHBondContact O-N 2.03Å; Q1139-K1141 PolarHBondContact O-N 3.17Å
1140	S	50.7	Low	66.3	Low	87 Å²	87	108.7 Å²	108.7	61%	0.608	58%	0.578	S	S	*	*			trans	-59	127	169.4	-179.8	0	0	0	0	110.1	I1138 N1142	I1138-S1140 PolarHBondContact O-N 3.29Å; S1140-N1142 WeakPolarHBondContact CB-O 3.28Å; S1140-N1142 PolarHBondContact O-N 2.86Å; S1140-N1142 PolarHBondContact OG-N 2.63Å; S1140-N1142 VanDerWaalsContact OG-N 3.11Å; S1140-N1142 PolarHBondContact OG-O 2.66Å
1141	K	53.3	Low	66.4	Low	208 Å²	208	101.9 Å²	101.9	90%	0.904	55%	0.549	S	S	*	.	S	Bend	trans	-75.4	-8.4	169.2	-78.4	-168.9	172.3	-174.5	0	113.5	Q1139	Q1139-K1141 PolarHBondContact O-N 3.17Å
1142	N	51.8	Low	66.5	Low	130 Å²	130	96.9 Å²	96.9	70%	0.695	52%	0.521	S	S	*	.	S	Bend	trans	-106.4	131.8	174.7	-66.3	-4.5	0	0	0	109.9	S1140	S1140-N1142 WeakPolarHBondContact CB-O 3.28Å; S1140-N1142 PolarHBondContact O-N 2.86Å; S1140-N1142 PolarHBondContact OG-N 2.63Å; S1140-N1142 VanDerWaalsContact OG-N 3.11Å; S1140-N1142 PolarHBondContact OG-O 2.66Å
1143	S	40.2	Very low	66.5	Low	101 Å²	101	98.5 Å²	98.5	71%	0.706	53%	0.528	S	S	*	.			trans	-61.4	172.8	165.3	-174.4	0	0	0	0	111.2
1144	D	53.4	Low	66.7	Low	159 Å²	159	98.4 Å²	98.4	85%	0.85	52%	0.523	S	S	*	.			trans	94.9	-3.4	161.5	-50.7	-9.2	0	0	0	117.8
1145	S	42.9	Very low	67.1	Low	90 Å²	90	101.2 Å²	101.2	63%	0.629	53%	0.532	S	S	*	.			trans	-100	113.6	158.7	-174.6	0	0	0	0	111.4	N1147	S1145-N1147 PolarHBondContact O-N 2.61Å; S1145-N1147 PolarHBondContact OG-N 2.66Å; S1145-N1147 PolarHBondContact OG-O 2.95Å
1146	K	51.3	Low	67.7	Low	218 Å²	218	98.6 Å²	98.6	95%	0.948	52%	0.518	S	S	*	.	S	Bend	trans	-71.2	-7.4	168.6	-86.2	-173.1	173.8	-179.3	0	113.9
1147	N	57.2	Low	68.2	Low	134 Å²	134	99.6 Å²	99.6	72%	0.717	52%	0.521	S	S	*	.	S	Bend	trans	-105.5	103.3	171	-69.6	-8.9	0	0	0	109	S1145	S1145-N1147 PolarHBondContact O-N 2.61Å; S1145-N1147 PolarHBondContact OG-N 2.66Å; S1145-N1147 PolarHBondContact OG-O 2.95Å
1148	G	61.2	Low	69	Low	42 Å²	42	99.9 Å²	99.9	43%	0.433	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-73.3	134.4	169.3	0	0	0	0	0	110.6	K1150	G1148-K1150 PolarHBondContact O-N 3.17Å
1149	I	69.9	Low	69.8	Low	108 Å²	108	98.7 Å²	98.7	55%	0.554	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-72.5	127.4	176.9	-56.5	175.3	0	0	0	108.4	I1138 N1171	I1138-I1149 HydrophobicContact CD1-CB 4.19Å; I1138-I1149 HydrophobicContact CD1-CG2 3.97Å; I1138-I1149 PolarHBondContact N-O 2.8Å; I1149-N1171 HydrophobicContact CG2-CB 4.41Å
1150	K	82	Confident	71	Confident	74 Å²	74	90.8 Å²	90.8	32%	0.322	48%	0.475	S	S	.	.	B	Isolated β-bridge	trans	-65.1	135.1	173.3	-75.6	-171.3	163.9	-133.8	0	110.2	M1134 D1135 L1137 G1148 Y1152 E1153 N1171	M1134-K1150 WeakPolarHBondContact O-CD 3.28Å; M1134-K1150 PolarHBondContact O-NZ 2.71Å; D1135-K1150 IonicContact OD1-NZ 3.36Å; D1135-K1150 PolarHBondContact OD1-NZ 3.31Å; L1137-K1150 HydrophobicContact CD2-CG 4Å; G1148-K1150 PolarHBondContact O-N 3.17Å; K1150-Y1152 VanDerWaalsContact C-N 3.26Å; K1150-Y1152 PolarHBondContact O-N 2.79Å; K1150-E1153 HydrophobicContact CB-CG 3.97Å; K1150-N1171 PolarHBondContact O-ND2 3.47Å
1151	K	90	Very high	72.7	Confident	14 Å²	14	87 Å²	87	6%	0.061	45%	0.448	C	S	.	.	S	Bend	trans	-65.6	-33.8	174.8	179.1	60	-176.7	173.8	0	111.7	T1136 I1138 N1171 D1172 D1177	T1136-K1151 HydrophobicContact CG2-CB 3.8Å; T1136-K1151 HydrophobicContact CG2-CG 4.26Å; T1136-K1151 WeakPolarHBondContact O-CB 3.41Å; T1136-K1151 PolarHBondContact O-N 2.71Å; I1138-K1151 HydrophobicContact CG1-CB 4.11Å; I1138-K1151 HydrophobicContact CG1-CD 4.15Å; K1151-N1171 WeakPolarHBondContact CD-O 3.19Å; K1151-N1171 WeakPolarHBondContact CE-O 3.19Å; K1151-N1171 PolarHBondContact NZ-O 2.77Å; K1151-N1171 PolarHBondContact O-N 2.81Å; K1151-D1172 PolarHBondContact NZ-O 2.73Å; K1151-D1177 WeakPolarHBondContact CE-OD1 3.2Å; K1151-D1177 IonicContact NZ-OD1 2.71Å; K1151-D1177 PolarHBondContact NZ-OD1 3.15Å; K1151-D1177 IonicContact NZ-OD2 2.67Å; K1151-D1177 PolarHBondContact NZ-OD2 2.91Å
1152	Y	91.6	Very high	74.4	Confident	25 Å²	25	77.2 Å²	77.2	10%	0.098	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	133.6	-178	-58.1	-68.4	0	0	0	110.2	I1132 K1150 L1168 A1169 V1170 Y1181	I1132-Y1152 HydrophobicContact CG2-CD1 3.86Å; I1132-Y1152 HydrophobicContact CG2-CD2 3.33Å; I1132-Y1152 HydrophobicContact CG2-CE1 4.16Å; I1132-Y1152 HydrophobicContact CG2-CE2 3.68Å; I1132-Y1152 HydrophobicContact CG2-CG 3.42Å; I1132-Y1152 VanDerWaalsContact CG2-CG 3.42Å; K1150-Y1152 VanDerWaalsContact C-N 3.26Å; K1150-Y1152 PolarHBondContact O-N 2.79Å; Y1152-L1168 HydrophobicContact CD1-CD2 4.26Å; Y1152-A1169 WeakPolarHBondContact CA-O 3.36Å; Y1152-V1170 HydrophobicContact CD1-CG1 4.44Å; Y1152-V1170 HydrophobicContact CD1-CG2 4.18Å; Y1152-V1170 HydrophobicContact CE1-CG1 4.03Å; Y1152-V1170 HydrophobicContact CE1-CG2 4.16Å; Y1152-Y1181 HydrophobicContact CE1-CE1 4.39Å
1153	E	89.1	Confident	76.1	Confident	49 Å²	49	71.1 Å²	71.1	23%	0.229	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	118.4	176.3	-62.9	169.5	132.2	0	0	108.9	K1108 K1150 Y1155 A1169 N1171	K1108-E1153 IonicContact NZ-OE2 3.88Å; K1108-E1153 PolarHBondContact NZ-OE2 3.01Å; K1150-E1153 HydrophobicContact CB-CG 3.97Å; E1153-Y1155 HydrophobicContact CB-CE2 3.66Å; E1153-A1169 HydrophobicContact CB-CB 4.01Å; E1153-A1169 PolarHBondContact N-O 3.34Å; E1153-A1169 PolarHBondContact O-N 3.37Å; E1153-N1171 VanDerWaalsContact CD-ND2 3.31Å; E1153-N1171 PolarHBondContact OE2-ND2 3.5Å
1154	N	89.3	Confident	78.4	Confident	81 Å²	81	66.8 Å²	66.8	43%	0.433	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	141.2	-179.1	65.9	-48.6	0	0	0	111.8	M1134 Q1167 L1168	M1134-N1154 HydrophobicContact CE-CB 4.23Å; M1134-N1154 HydrophobicContact SD-CB 4.21Å; N1154-Q1167 WeakPolarHBondContact CA-O 3.26Å; N1154-L1168 HydrophobicContact CB-CD1 4.1Å
1155	Y	90.2	Very high	80.1	Confident	99 Å²	99	60.8 Å²	60.8	39%	0.388	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	144.3	179.9	-56.1	-93.7	0	0	0	110	W1110 E1153 A1166 Q1167 A1169	W1110-Y1155 HydrophobicContact CH2-CD2 4.32Å; W1110-Y1155 AromaticContact CH2-CE2 3.82Å; W1110-Y1155 HydrophobicContact CH2-CE2 3.82Å; W1110-Y1155 AromaticContact CZ3-CD2 3.68Å; W1110-Y1155 HydrophobicContact CZ3-CD2 3.68Å; W1110-Y1155 AromaticContact CZ3-CE2 3.54Å; W1110-Y1155 HydrophobicContact CZ3-CE2 3.54Å; E1153-Y1155 HydrophobicContact CB-CE2 3.66Å; Y1155-A1166 CarbonylContact O-C 3.59Å; Y1155-A1166 WeakPolarHBondContact O-CA 3.17Å; Y1155-Q1167 PolarHBondContact N-O 2.8Å; Y1155-Q1167 PolarHBondContact O-N 3.27Å; Y1155-A1169 HydrophobicContact CE2-CB 4.32Å
1156	L	91.1	Very high	82.4	Confident	71 Å²	71	56.5 Å²	56.5	37%	0.372	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	119.7	170.9	-179.9	58.9	0	0	0	108.5	T1120 P1121 I1123 Y1164 A1166	T1120-L1156 HydrophobicContact CG2-CD2 4.11Å; P1121-L1156 HydrophobicContact CG-CD1 4.42Å; P1121-L1156 HydrophobicContact CG-CD2 4.33Å; P1121-L1156 WeakPolarHBondContact O-CD2 3.46Å; I1123-L1156 HydrophobicContact CG1-CD1 3.96Å; I1123-L1156 HydrophobicContact CG1-CD2 4.16Å; L1156-Y1164 HydrophobicContact CD1-CD1 4.35Å; L1156-A1166 HydrophobicContact CD1-CB 4.39Å
1157	I	85.2	Confident	84.3	Confident	74 Å²	74	47.6 Å²	47.6	38%	0.379	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	118.1	-176.8	-56.9	169.9	0	0	0	107.6	I1159 Y1164 K1165	I1157-I1159 HydrophobicContact CG2-CG1 4.48Å; I1157-I1159 PolarHBondContact O-N 3.12Å; I1157-Y1164 CarbonylContact O-C 3.6Å; I1157-Y1164 WeakPolarHBondContact O-CA 3.27Å; I1157-K1165 HydrophobicContact CB-CB 4.27Å; I1157-K1165 HydrophobicContact CD1-CD 4.41Å; I1157-K1165 PolarHBondContact N-O 3.29Å; I1157-K1165 PolarHBondContact O-N 3.5Å
1158	H	86.2	Confident	86.1	Confident	103 Å²	103	41.2 Å²	41.2	48%	0.477	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	117.8	166.8	176	-132.1	0	0	0	108	R1160 Y1164	H1158-R1160 PolarHBondContact CD2-O 2.8Å; H1158-R1160 PolarHBondContact NE2-O 2.83Å; H1158-Y1164 HydrophobicContact CB-CD1 3.89Å; H1158-Y1164 HydrophobicContact CB-CE1 3.71Å; H1158-Y1164 AromaticContact CD2-CE1 3.47Å; H1158-Y1164 VanDerWaalsContact CD2-CE1 3.47Å; H1158-Y1164 WeakPolarHBondContact CD2-CE1 3.44Å; H1158-Y1164 AromaticContact CD2-CZ 3.5Å; H1158-Y1164 VanDerWaalsContact CD2-CZ 3.5Å; H1158-Y1164 AromaticContact CG-CE1 3.81Å
1159	I	80.8	Confident	87.5	Confident	17 Å²	17	39.2 Å²	39.2	9%	0.087	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	-51.8	-179.7	-64.3	177.9	0	0	0	109.5	E1016 Y1114 I1157 L1163 K1165	E1016-I1159 VanDerWaalsContact CG-O 3.24Å; E1016-I1159 WeakPolarHBondContact CG-O 3.25Å; Y1114-I1159 HydrophobicContact CD1-CD1 3.96Å; Y1114-I1159 HydrophobicContact CE1-CD1 3.81Å; I1157-I1159 HydrophobicContact CG2-CG1 4.48Å; I1157-I1159 PolarHBondContact O-N 3.12Å; I1159-L1163 HydrophobicContact CB-CD2 4.34Å; I1159-L1163 HydrophobicContact CB-CG 4.42Å; I1159-L1163 HydrophobicContact CD1-CD2 4.3Å; I1159-L1163 HydrophobicContact CD1-CG 4.43Å; I1159-L1163 HydrophobicContact CG2-CD2 4.3Å; I1159-L1163 PolarHBondContact N-O 2.86Å; I1159-K1165 HydrophobicContact CD1-CB 3.78Å; I1159-K1165 HydrophobicContact CD1-CD 4.16Å; I1159-K1165 HydrophobicContact CG1-CB 4.22Å
1160	R	83.3	Confident	88.6	Confident	22 Å²	22	34 Å²	34	8%	0.083	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	160.7	-176.7	60.3	-168.6	-176.6	91	-3.6	108.4	E1012 E1016 H1158 G1162 L1163	E1012-R1160 PolarHBondContact O-NH2 2.87Å; E1016-R1160 HydrophobicContact CG-CB 4.32Å; H1158-R1160 PolarHBondContact CD2-O 2.8Å; H1158-R1160 PolarHBondContact NE2-O 2.83Å; R1160-G1162 PolarHBondContact O-N 2.77Å; R1160-L1163 HydrophobicContact CG-CB 3.87Å; R1160-L1163 HydrophobicContact CG-CD2 4.11Å; R1160-L1163 PolarHBondContact N-O 3.19Å; R1160-L1163 PolarHBondContact O-N 2.94Å; R1160-L1163 VanDerWaalsContact O-O 3.09Å
1161	P	87	Confident	89	Confident	7 Å²	7	31.1 Å²	31.1	5%	0.045	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-43.2	130.3	176.2	-32.7	37.3	0	0	0	112.3	V1063 N1083 L1085 L1163	V1063-P1161 HydrophobicContact CG1-CB 4.05Å; N1083-P1161 HydrophobicContact CB-CG 3.76Å; L1085-P1161 HydrophobicContact CD2-CB 3.75Å; L1085-P1161 HydrophobicContact CD2-CG 4.35Å; P1161-L1163 VanDerWaalsContact C-N 3.31Å; P1161-L1163 PolarHBondContact O-N 2.89Å
1162	G	88	Confident	88.9	Confident	3 Å²	3	32.3 Å²	32.3	3%	0.031	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	1.5	-177.6	0	0	0	0	0	117.2	R1116 T1117 E1118 R1160	R1116-G1162 CarbonylContact C-O 3.48Å; R1116-G1162 WeakPolarHBondContact CA-O 3.48Å; T1117-G1162 PolarHBondContact N-O 2.74Å; T1117-G1162 CarbonylContact O-C 3.53Å; T1117-G1162 WeakPolarHBondContact O-CA 3.37Å; E1118-G1162 WeakPolarHBondContact OE2-CA 3.4Å; E1118-G1162 PolarHBondContact OE2-N 3.44Å; R1160-G1162 PolarHBondContact O-N 2.77Å
1163	L	88.1	Confident	88.8	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.01	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	122.6	-177.9	-179.8	68.2	0	0	0	113.3	I1093 R1116 I1159 R1160 P1161	I1093-L1163 HydrophobicContact CD1-CD1 4.2Å; R1116-L1163 HydrophobicContact CG-CD1 4.01Å; I1159-L1163 HydrophobicContact CB-CD2 4.34Å; I1159-L1163 HydrophobicContact CB-CG 4.42Å; I1159-L1163 HydrophobicContact CD1-CD2 4.3Å; I1159-L1163 HydrophobicContact CD1-CG 4.43Å; I1159-L1163 HydrophobicContact CG2-CD2 4.3Å; I1159-L1163 PolarHBondContact N-O 2.86Å; R1160-L1163 HydrophobicContact CG-CB 3.87Å; R1160-L1163 HydrophobicContact CG-CD2 4.11Å; R1160-L1163 PolarHBondContact N-O 3.19Å; R1160-L1163 PolarHBondContact O-N 2.94Å; R1160-L1163 VanDerWaalsContact O-O 3.09Å; P1161-L1163 VanDerWaalsContact C-N 3.31Å; P1161-L1163 PolarHBondContact O-N 2.89Å
1164	Y	89.6	Confident	88.8	Confident	10 Å²	10	32.5 Å²	32.5	4%	0.039	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	151.4	-178.5	-61.2	-100.2	0	0	0	111.2	Y1114 I1115 T1117 T1120 P1121 L1156 I1157 H1158	Y1114-Y1164 CarbonylContact C-O 3.56Å; Y1114-Y1164 WeakPolarHBondContact CA-O 3.37Å; I1115-Y1164 PolarHBondContact N-O 2.88Å; I1115-Y1164 PolarHBondContact O-N 2.66Å; T1117-Y1164 HydrophobicContact CG2-CD2 3.73Å; T1117-Y1164 HydrophobicContact CG2-CE2 4.13Å; T1117-Y1164 WeakPolarHBondContact O-CE2 3.31Å; T1120-Y1164 HydrophobicContact CG2-CD1 4.34Å; T1120-Y1164 HydrophobicContact CG2-CE1 3.78Å; T1120-Y1164 PolarHBondContact OG1-OH 3.07Å; P1121-Y1164 HydrophobicContact CG-CG 4.33Å; L1156-Y1164 HydrophobicContact CD1-CD1 4.35Å; I1157-Y1164 CarbonylContact O-C 3.6Å; I1157-Y1164 WeakPolarHBondContact O-CA 3.27Å; H1158-Y1164 HydrophobicContact CB-CD1 3.89Å; H1158-Y1164 HydrophobicContact CB-CE1 3.71Å; H1158-Y1164 AromaticContact CD2-CE1 3.47Å; H1158-Y1164 VanDerWaalsContact CD2-CE1 3.47Å; H1158-Y1164 WeakPolarHBondContact CD2-CE1 3.44Å; H1158-Y1164 AromaticContact CD2-CZ 3.5Å; H1158-Y1164 VanDerWaalsContact CD2-CZ 3.5Å; H1158-Y1164 AromaticContact CG-CE1 3.81Å
1165	K	87.8	Confident	88.7	Confident	33 Å²	33	36 Å²	36	14%	0.143	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	107.9	177.5	171	178	-175.7	160.3	0	109.1	T1112 C1113 Y1114 I1157 I1159 Q1167	T1112-K1165 HydrophobicContact CG2-CG 4.24Å; C1113-K1165 CarbonylContact O-C 3.58Å; C1113-K1165 WeakPolarHBondContact O-CA 3.24Å; Y1114-K1165 HydrophobicContact CD1-CB 4.08Å; Y1114-K1165 HydrophobicContact CD1-CD 4.41Å; Y1114-K1165 HydrophobicContact CD1-CG 4.31Å; Y1114-K1165 HydrophobicContact CE1-CB 4.11Å; Y1114-K1165 HydrophobicContact CE1-CD 3.63Å; Y1114-K1165 HydrophobicContact CE1-CG 3.98Å; Y1114-K1165 WeakPolarHBondContact OH-CE 3.32Å; Y1114-K1165 PolarHBondContact OH-NZ 3.35Å; I1157-K1165 HydrophobicContact CB-CB 4.27Å; I1157-K1165 HydrophobicContact CD1-CD 4.41Å; I1157-K1165 PolarHBondContact N-O 3.29Å; I1157-K1165 PolarHBondContact O-N 3.5Å; I1159-K1165 HydrophobicContact CD1-CB 3.78Å; I1159-K1165 HydrophobicContact CD1-CD 4.16Å; I1159-K1165 HydrophobicContact CG1-CB 4.22Å; K1165-Q1167 HydrophobicContact CG-CG 4.12Å
1166	A	91.7	Very high	88.6	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	137.5	172.1	0	0	0	0	0	109.7	T1112 C1113 I1115 I1123 W1125 Y1155 L1156	T1112-A1166 WeakPolarHBondContact CA-O 3.42Å; C1113-A1166 PolarHBondContact N-O 3.1Å; C1113-A1166 PolarHBondContact O-N 2.94Å; I1115-A1166 HydrophobicContact CD1-CB 3.61Å; I1123-A1166 HydrophobicContact CD1-CB 4.16Å; I1123-A1166 HydrophobicContact CG1-CB 4.1Å; I1123-A1166 HydrophobicContact CG2-CB 3.94Å; W1125-A1166 HydrophobicContact CZ2-CB 4.15Å; Y1155-A1166 CarbonylContact O-C 3.59Å; Y1155-A1166 WeakPolarHBondContact O-CA 3.17Å; L1156-A1166 HydrophobicContact CD1-CB 4.39Å
1167	Q	91.3	Very high	88.6	Confident	31 Å²	31	35.8 Å²	35.8	15%	0.145	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	143.2	173.9	-57.2	-167.9	-87.4	0	0	111.4	W1110 L1111 T1112 N1154 Y1155 K1165	W1110-Q1167 HydrophobicContact CE3-CB 4.17Å; L1111-Q1167 CarbonylContact O-C 3.49Å; L1111-Q1167 WeakPolarHBondContact O-CA 3.35Å; T1112-Q1167 HydrophobicContact CG2-CG 4.08Å; T1112-Q1167 PolarHBondContact OG1-NE2 3.23Å; N1154-Q1167 WeakPolarHBondContact CA-O 3.26Å; Y1155-Q1167 PolarHBondContact N-O 2.8Å; Y1155-Q1167 PolarHBondContact O-N 3.27Å; K1165-Q1167 HydrophobicContact CG-CG 4.12Å
1168	L	94	Very high	88.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	117.6	166.8	-171.5	73.8	0	0	0	109	W1110 L1111 W1125 I1132 M1134 Y1152 N1154 V1170 Y1181	W1110-L1168 WeakPolarHBondContact CA-O 3.41Å; L1111-L1168 HydrophobicContact CB-CB 4.22Å; L1111-L1168 HydrophobicContact CD1-CB 4.41Å; L1111-L1168 HydrophobicContact CD1-CD2 4.02Å; L1111-L1168 HydrophobicContact CG-CB 4.46Å; L1111-L1168 PolarHBondContact N-O 3.14Å; L1111-L1168 PolarHBondContact O-N 2.84Å; W1125-L1168 HydrophobicContact CB-CD1 4.4Å; W1125-L1168 HydrophobicContact CB-CD2 4.22Å; W1125-L1168 HydrophobicContact CD2-CB 3.66Å; W1125-L1168 HydrophobicContact CD2-CD1 4.47Å; W1125-L1168 HydrophobicContact CD2-CD2 4.17Å; W1125-L1168 HydrophobicContact CD2-CG 4.32Å; W1125-L1168 HydrophobicContact CE3-CB 3.89Å; W1125-L1168 HydrophobicContact CE3-CD2 4.14Å; W1125-L1168 HydrophobicContact CG-CB 4.16Å; W1125-L1168 HydrophobicContact CG-CD1 4.09Å; W1125-L1168 HydrophobicContact CG-CD2 4.22Å; W1125-L1168 HydrophobicContact CG-CG 4.39Å; W1125-L1168 HydrophobicContact CH2-CB 4.11Å; W1125-L1168 HydrophobicContact CZ2-CB 3.9Å; W1125-L1168 HydrophobicContact CZ3-CB 4.1Å; I1132-L1168 HydrophobicContact CD1-CD2 3.68Å; M1134-L1168 HydrophobicContact CE-CD1 3.83Å; M1134-L1168 HydrophobicContact SD-CD1 4.1Å; Y1152-L1168 HydrophobicContact CD1-CD2 4.26Å; N1154-L1168 HydrophobicContact CB-CD1 4.1Å; L1168-V1170 HydrophobicContact CD2-CG2 4.22Å; L1168-Y1181 HydrophobicContact CD2-CD1 4.24Å; L1168-Y1181 HydrophobicContact CD2-CE1 4.37Å
1169	A	91.7	Very high	89.1	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	120.6	165.8	0	0	0	0	0	109.5	K1108 V1109 W1110 Y1152 E1153 Y1155	K1108-A1169 HydrophobicContact CD-CB 4.48Å; K1108-A1169 HydrophobicContact CG-CB 4.49Å; V1109-A1169 WeakPolarHBondContact O-CA 3.5Å; W1110-A1169 HydrophobicContact CD2-CB 4.28Å; W1110-A1169 HydrophobicContact CE3-CB 3.68Å; W1110-A1169 HydrophobicContact CH2-CB 3.87Å; W1110-A1169 HydrophobicContact CZ2-CB 4.42Å; W1110-A1169 HydrophobicContact CZ3-CB 3.46Å; W1110-A1169 VanDerWaalsContact CZ3-CB 3.46Å; Y1152-A1169 WeakPolarHBondContact CA-O 3.36Å; E1153-A1169 HydrophobicContact CB-CB 4.01Å; E1153-A1169 PolarHBondContact N-O 3.34Å; E1153-A1169 PolarHBondContact O-N 3.37Å; Y1155-A1169 HydrophobicContact CE2-CB 4.32Å
1170	V	92.4	Very high	89.7	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	110.6	166.4	-174	0	0	0	0	107.4	K1108 V1109 L1111 Y1152 L1168 I1173 D1177 Y1181 L1198	K1108-V1170 WeakPolarHBondContact CA-O 3.45Å; V1109-V1170 PolarHBondContact N-O 3.44Å; V1109-V1170 VanDerWaalsContact N-O 3.14Å; V1109-V1170 PolarHBondContact O-N 3.12Å; L1111-V1170 HydrophobicContact CD1-CG2 4.46Å; L1111-V1170 HydrophobicContact CG-CG2 4.48Å; Y1152-V1170 HydrophobicContact CD1-CG1 4.44Å; Y1152-V1170 HydrophobicContact CD1-CG2 4.18Å; Y1152-V1170 HydrophobicContact CE1-CG1 4.03Å; Y1152-V1170 HydrophobicContact CE1-CG2 4.16Å; L1168-V1170 HydrophobicContact CD2-CG2 4.22Å; V1170-I1173 HydrophobicContact CB-CD1 4.32Å; V1170-I1173 HydrophobicContact CB-CG1 4.23Å; V1170-I1173 HydrophobicContact CG1-CD1 4.42Å; V1170-I1173 HydrophobicContact CG1-CG1 3.8Å; V1170-D1177 HydrophobicContact CG1-CB 4.47Å; V1170-Y1181 HydrophobicContact CG2-CE1 4.36Å; V1170-L1198 HydrophobicContact CG2-CD2 4.44Å
1171	N	90.2	Very high	90.3	Very high	12 Å²	12	30.7 Å²	30.7	6%	0.064	14%	0.141	C	C	.	.			trans	-88.5	151.4	-179.6	-68.4	-46.2	0	0	0	111	K1108 I1138 I1149 K1150 K1151 E1153	K1108-N1171 WeakPolarHBondContact CD-OD1 3.12Å; K1108-N1171 WeakPolarHBondContact CE-OD1 3.14Å; K1108-N1171 VanDerWaalsContact CG-OD1 3.28Å; K1108-N1171 WeakPolarHBondContact CG-OD1 3.23Å; K1108-N1171 PolarHBondContact NZ-OD1 2.84Å; K1108-N1171 VanDerWaalsContact NZ-OD1 3.09Å; I1138-N1171 HydrophobicContact CD1-CB 3.87Å; I1149-N1171 HydrophobicContact CG2-CB 4.41Å; K1150-N1171 PolarHBondContact O-ND2 3.47Å; K1151-N1171 WeakPolarHBondContact CD-O 3.19Å; K1151-N1171 WeakPolarHBondContact CE-O 3.19Å; K1151-N1171 PolarHBondContact NZ-O 2.77Å; K1151-N1171 PolarHBondContact O-N 2.81Å; E1153-N1171 VanDerWaalsContact CD-ND2 3.31Å; E1153-N1171 PolarHBondContact OE2-ND2 3.5Å
1172	D	88	Confident	90.6	Very high	39 Å²	39	30.6 Å²	30.6	21%	0.209	14%	0.14	C	C	.	.	S	Bend	trans	48.2	65.4	178.3	-171	47	0	0	0	114.8	S1106 S1107 I1138 K1151 R1174	S1106-D1172 VanDerWaalsContact CA-OD1 3.3Å; S1106-D1172 WeakPolarHBondContact CA-OD1 3.23Å; S1106-D1172 VanDerWaalsContact CB-OD1 3.29Å; S1106-D1172 WeakPolarHBondContact CB-OD1 3.48Å; S1107-D1172 PolarHBondContact O-N 2.84Å; I1138-D1172 HydrophobicContact CD1-CB 3.73Å; K1151-D1172 PolarHBondContact NZ-O 2.73Å; D1172-R1174 VanDerWaalsContact CG-CZ 3.5Å; D1172-R1174 PolarHBondContact O-N 2.86Å; D1172-R1174 IonicContact OD1-CZ 3.75Å; D1172-R1174 IonicContact OD1-NE 2.69Å; D1172-R1174 PolarHBondContact OD1-NE 2.79Å; D1172-R1174 IonicContact OD1-NH1 3.42Å; D1172-R1174 IonicContact OD1-NH2 3.61Å; D1172-R1174 PolarHBondContact OD1-NH2 2.84Å; D1172-R1174 IonicContact OD2-CZ 3.2Å; D1172-R1174 IonicContact OD2-NE 3.07Å; D1172-R1174 PolarHBondContact OD2-NE 2.75Å; D1172-R1174 IonicContact OD2-NH2 3.73Å; D1172-R1174 PolarHBondContact OD2-NH2 3.3Å
1173	I	89	Confident	90.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.139	C	C	.	.			trans	-71	130.7	-171	-71.9	160.4	0	0	0	113.3	Q1105 S1106 S1107 V1109 V1170 D1177 F1178	Q1105-I1173 CarbonylContact C-O 3.56Å; Q1105-I1173 WeakPolarHBondContact CA-O 3.37Å; S1106-I1173 PolarHBondContact N-O 3.25Å; S1107-I1173 PolarHBondContact O-N 2.79Å; S1107-I1173 VanDerWaalsContact O-N 3.12Å; V1109-I1173 HydrophobicContact CB-CD1 3.4Å; V1109-I1173 VanDerWaalsContact CB-CD1 3.4Å; V1109-I1173 HydrophobicContact CG2-CD1 3.28Å; V1170-I1173 HydrophobicContact CB-CD1 4.32Å; V1170-I1173 HydrophobicContact CB-CG1 4.23Å; V1170-I1173 HydrophobicContact CG1-CD1 4.42Å; V1170-I1173 HydrophobicContact CG1-CG1 3.8Å; I1173-D1177 WeakPolarHBondContact CA-OD2 2.92Å; I1173-D1177 HydrophobicContact CG2-CB 4.47Å; I1173-F1178 HydrophobicContact CG2-CD1 4.37Å; I1173-F1178 HydrophobicContact CG2-CE1 3.76Å
1174	R	89.4	Confident	91.1	Very high	79 Å²	79	32.6 Å²	32.6	30%	0.298	15%	0.149	S	C	.	.			trans	-122.3	165.7	177.8	-52.4	-55.6	179.9	-175.3	2.5	110.2	S1106 D1172 Y1176 D1177	S1106-R1174 PolarHBondContact OG-NH1 2.71Å; D1172-R1174 VanDerWaalsContact CG-CZ 3.5Å; D1172-R1174 PolarHBondContact O-N 2.86Å; D1172-R1174 IonicContact OD1-CZ 3.75Å; D1172-R1174 IonicContact OD1-NE 2.69Å; D1172-R1174 PolarHBondContact OD1-NE 2.79Å; D1172-R1174 IonicContact OD1-NH1 3.42Å; D1172-R1174 IonicContact OD1-NH2 3.61Å; D1172-R1174 PolarHBondContact OD1-NH2 2.84Å; D1172-R1174 IonicContact OD2-CZ 3.2Å; D1172-R1174 IonicContact OD2-NE 3.07Å; D1172-R1174 PolarHBondContact OD2-NE 2.75Å; D1172-R1174 IonicContact OD2-NH2 3.73Å; D1172-R1174 PolarHBondContact OD2-NH2 3.3Å; R1174-Y1176 HydrophobicContact CB-CD1 3.81Å; R1174-Y1176 HydrophobicContact CB-CD2 4.34Å; R1174-Y1176 HydrophobicContact CB-CE1 3.47Å; R1174-Y1176 VanDerWaalsContact CB-CE1 3.47Å; R1174-Y1176 HydrophobicContact CB-CE2 4.03Å; R1174-Y1176 HydrophobicContact CB-CG 4.24Å; R1174-Y1176 HydrophobicContact CG-CE1 3.77Å; R1174-Y1176 HydrophobicContact CG-CE2 4.32Å; R1174-Y1176 PolarHBondContact O-N 3.08Å; R1174-Y1176 VanDerWaalsContact O-N 3.07Å; R1174-D1177 PolarHBondContact N-OD2 2.88Å; R1174-D1177 WeakPolarHBondContact O-CB 3.01Å; R1174-D1177 PolarHBondContact O-N 3.37Å
1175	K	87	Confident	91.3	Very high	155 Å²	155	32.1 Å²	32.1	67%	0.674	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-24.3	179.7	-68.8	-171.9	176.4	-175.5	0	114.6	F1178	K1175-F1178 HydrophobicContact CB-CD2 4.46Å; K1175-F1178 HydrophobicContact CB-CE2 4.38Å; K1175-F1178 HydrophobicContact CG-CE2 4.17Å
1176	Y	89.3	Confident	91.6	Very high	163 Å²	163	32 Å²	32	64%	0.639	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-10.6	176.1	60.2	-111.1	0	0	0	113.5	K1127 R1174	K1127-Y1176 PolarHBondContact NZ-O 2.98Å; R1174-Y1176 HydrophobicContact CB-CD1 3.81Å; R1174-Y1176 HydrophobicContact CB-CD2 4.34Å; R1174-Y1176 HydrophobicContact CB-CE1 3.47Å; R1174-Y1176 VanDerWaalsContact CB-CE1 3.47Å; R1174-Y1176 HydrophobicContact CB-CE2 4.03Å; R1174-Y1176 HydrophobicContact CB-CG 4.24Å; R1174-Y1176 HydrophobicContact CG-CE1 3.77Å; R1174-Y1176 HydrophobicContact CG-CE2 4.32Å; R1174-Y1176 PolarHBondContact O-N 3.08Å; R1174-Y1176 VanDerWaalsContact O-N 3.07Å
1177	D	90.5	Very high	91.5	Very high	2 Å²	2	33 Å²	33	1%	0.011	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-28.1	173.5	-62.4	-54.8	0	0	0	111.1	K1127 K1151 V1170 I1173 R1174 Y1181	K1127-D1177 WeakPolarHBondContact CE-O 3.34Å; K1127-D1177 PolarHBondContact NZ-O 3.25Å; K1127-D1177 VanDerWaalsContact NZ-O 3.09Å; K1151-D1177 WeakPolarHBondContact CE-OD1 3.2Å; K1151-D1177 IonicContact NZ-OD1 2.71Å; K1151-D1177 PolarHBondContact NZ-OD1 3.15Å; K1151-D1177 IonicContact NZ-OD2 2.67Å; K1151-D1177 PolarHBondContact NZ-OD2 2.91Å; V1170-D1177 HydrophobicContact CG1-CB 4.47Å; I1173-D1177 WeakPolarHBondContact CA-OD2 2.92Å; I1173-D1177 HydrophobicContact CG2-CB 4.47Å; R1174-D1177 PolarHBondContact N-OD2 2.88Å; R1174-D1177 WeakPolarHBondContact O-CB 3.01Å; R1174-D1177 PolarHBondContact O-N 3.37Å; D1177-Y1181 VanDerWaalsContact O-CE2 3.22Å; D1177-Y1181 WeakPolarHBondContact O-CE2 2.89Å; D1177-Y1181 PolarHBondContact O-OH 3.15Å
1178	F	91.9	Very high	91.4	Very high	64 Å²	64	38.9 Å²	38.9	28%	0.281	19%	0.189	S	C	.	.			trans	-54.5	148.4	172.9	-55.1	-26.7	0	0	0	111.9	I1173 K1175 L1198 S1199	I1173-F1178 HydrophobicContact CG2-CD1 4.37Å; I1173-F1178 HydrophobicContact CG2-CE1 3.76Å; K1175-F1178 HydrophobicContact CB-CD2 4.46Å; K1175-F1178 HydrophobicContact CB-CE2 4.38Å; K1175-F1178 HydrophobicContact CG-CE2 4.17Å; F1178-L1198 VanDerWaalsContact CA-O 3.23Å; F1178-L1198 WeakPolarHBondContact CA-O 3.2Å; F1178-L1198 WeakPolarHBondContact CB-O 3.23Å; F1178-L1198 HydrophobicContact CD1-CG 4.39Å; F1178-S1199 VanDerWaalsContact CE1-C 3.43Å; F1178-S1199 VanDerWaalsContact CE1-O 3.28Å; F1178-S1199 WeakPolarHBondContact CE1-O 3.49Å
1179	G	91	Very high	91.2	Very high	19 Å²	19	44.1 Å²	44.1	20%	0.196	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	143.6	-161.7	-176.4	0	0	0	0	0	113.3	L1198	G1179-L1198 PolarHBondContact N-O 3.38Å; G1179-L1198 VanDerWaalsContact N-O 3.09Å; G1179-L1198 PolarHBondContact O-N 3.14Å
1180	S	92.7	Very high	91.1	Very high	26 Å²	26	45.6 Å²	45.6	18%	0.182	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	122.5	178.7	177.9	0	0	0	0	110.6	K1127 D1128 E1195	K1127-S1180 WeakPolarHBondContact CA-O 3.43Å; D1128-S1180 PolarHBondContact N-O 3.47Å; S1180-E1195 VanDerWaalsContact CB-OE1 3.31Å; S1180-E1195 WeakPolarHBondContact CB-OE1 3Å; S1180-E1195 VanDerWaalsContact OG-CD 3.24Å; S1180-E1195 WeakPolarHBondContact OG-CG 3.45Å; S1180-E1195 PolarHBondContact OG-OE1 2.62Å
1181	Y	94.8	Very high	91.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	154.8	168.4	-71.1	-101.8	0	0	0	109.1	L1111 L1126 K1127 I1132 Y1152 L1168 V1170 D1177 E1195 I1196 L1198	L1111-Y1181 HydrophobicContact CD1-CD1 3.47Å; L1111-Y1181 VanDerWaalsContact CD1-CD1 3.47Å; L1111-Y1181 HydrophobicContact CD1-CD2 4.03Å; L1111-Y1181 HydrophobicContact CD1-CE1 4.17Å; L1111-Y1181 HydrophobicContact CD1-CG 3.39Å; L1126-Y1181 CarbonylContact O-C 3.54Å; L1126-Y1181 VanDerWaalsContact O-CA 3.31Å; L1126-Y1181 WeakPolarHBondContact O-CA 3.4Å; K1127-Y1181 HydrophobicContact CB-CD1 4.03Å; K1127-Y1181 HydrophobicContact CB-CE1 3.93Å; K1127-Y1181 HydrophobicContact CD-CE1 4Å; K1127-Y1181 HydrophobicContact CD-CE2 4.2Å; K1127-Y1181 HydrophobicContact CG-CD1 4.06Å; K1127-Y1181 HydrophobicContact CG-CD2 4.33Å; K1127-Y1181 HydrophobicContact CG-CE1 3.78Å; K1127-Y1181 HydrophobicContact CG-CE2 4.04Å; K1127-Y1181 HydrophobicContact CG-CG 4.33Å; I1132-Y1181 HydrophobicContact CD1-CD1 3.71Å; I1132-Y1181 HydrophobicContact CD1-CE1 3.76Å; Y1152-Y1181 HydrophobicContact CE1-CE1 4.39Å; L1168-Y1181 HydrophobicContact CD2-CD1 4.24Å; L1168-Y1181 HydrophobicContact CD2-CE1 4.37Å; V1170-Y1181 HydrophobicContact CG2-CE1 4.36Å; D1177-Y1181 VanDerWaalsContact O-CE2 3.22Å; D1177-Y1181 WeakPolarHBondContact O-CE2 2.89Å; D1177-Y1181 PolarHBondContact O-OH 3.15Å; Y1181-E1195 CarbonylContact O-C 3.55Å; Y1181-E1195 WeakPolarHBondContact O-CA 3.23Å; Y1181-I1196 PolarHBondContact N-O 3.11Å; Y1181-I1196 PolarHBondContact O-N 2.84Å; Y1181-L1198 HydrophobicContact CD2-CB 3.83Å; Y1181-L1198 HydrophobicContact CD2-CD2 4.36Å; Y1181-L1198 HydrophobicContact CE2-CB 3.76Å; Y1181-L1198 HydrophobicContact CE2-CD2 3.61Å; Y1181-L1198 HydrophobicContact CE2-CG 4.31Å
1182	S	93.6	Very high	91.4	Very high	4 Å²	4	52.5 Å²	52.5	3%	0.028	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	137.3	170	-75.3	0	0	0	0	111.6	W1125 L1126 Q1193 L1194	W1125-S1182 WeakPolarHBondContact CA-O 3.37Å; L1126-S1182 PolarHBondContact N-O 3.24Å; L1126-S1182 PolarHBondContact O-N 2.91Å; S1182-Q1193 PolarHBondContact OG-NE2 2.84Å; S1182-L1194 VanDerWaalsContact CA-O 3.25Å; S1182-L1194 WeakPolarHBondContact CA-O 3.28Å
1183	C	93.5	Very high	91.6	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	118.6	164	-175.9	0	0	0	0	107.9	I1092 C1113 W1125 Q1193 L1194	I1092-C1183 WeakPolarHBondContact CD1-O 3.38Å; C1113-C1183 HydrophobicContact CB-CB 4Å; C1113-C1183 WeakPolarHBondContact SG-CB 3.41Å; W1125-C1183 HydrophobicContact CD2-CB 4.34Å; W1125-C1183 HydrophobicContact CE3-CB 4.01Å; W1125-C1183 HydrophobicContact CH2-CB 3.78Å; W1125-C1183 HydrophobicContact CZ2-CB 4.1Å; W1125-C1183 HydrophobicContact CZ3-CB 3.73Å; C1183-Q1193 CarbonylContact O-C 3.59Å; C1183-Q1193 VanDerWaalsContact O-CA 3.3Å; C1183-Q1193 WeakPolarHBondContact O-CA 3.27Å; C1183-L1194 PolarHBondContact N-O 2.82Å; C1183-L1194 PolarHBondContact O-N 2.72Å
1184	Q	94	Very high	91.7	Very high	47 Å²	47	55.6 Å²	55.6	22%	0.22	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	129.3	170.4	-177.6	-176	10.2	0	0	107.9	I1123 V1124 E1191 A1192 Q1193	I1123-Q1184 WeakPolarHBondContact CA-O 3.29Å; V1124-Q1184 HydrophobicContact CB-CB 4.26Å; V1124-Q1184 PolarHBondContact N-O 3Å; V1124-Q1184 PolarHBondContact O-N 2.99Å; Q1184-E1191 PolarHBondContact NE2-OE2 2.82Å; Q1184-A1192 CarbonylContact C-O 3.58Å; Q1184-A1192 WeakPolarHBondContact CA-O 3.46Å; Q1184-Q1193 HydrophobicContact CB-CG 4.43Å
1185	A	94	Very high	91.9	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	127	179.7	0	0	0	0	0	109.5	P1090 I1092 I1115 P1121 Q1122 I1123 E1191 A1192	P1090-A1185 HydrophobicContact CB-CB 4.1Å; P1090-A1185 WeakPolarHBondContact CG-O 3.2Å; I1092-A1185 HydrophobicContact CD1-CB 4.05Å; I1092-A1185 HydrophobicContact CG1-CB 4.31Å; I1115-A1185 HydrophobicContact CG1-CB 4.03Å; I1115-A1185 HydrophobicContact CG2-CB 3.99Å; P1121-A1185 HydrophobicContact CB-CB 4.45Å; Q1122-A1185 WeakPolarHBondContact O-CA 3.32Å; I1123-A1185 HydrophobicContact CD1-CB 3.55Å; A1185-E1191 CarbonylContact O-C 3.51Å; A1185-E1191 VanDerWaalsContact O-CA 3.26Å; A1185-E1191 WeakPolarHBondContact O-CA 2.99Å; A1185-A1192 PolarHBondContact N-O 2.85Å; A1185-A1192 PolarHBondContact O-N 3.32Å
1186	A	93	Very high	92.2	Very high	30 Å²	30	49.9 Å²	49.9	25%	0.248	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	142.5	-178.5	0	0	0	0	0	111.2	P1121 Q1122 G1190 E1191	P1121-A1186 CarbonylContact C-O 3.55Å; P1121-A1186 WeakPolarHBondContact CA-O 3.26Å; Q1122-A1186 PolarHBondContact N-O 2.75Å; Q1122-A1186 PolarHBondContact O-N 3.09Å; A1186-G1190 WeakPolarHBondContact CA-O 3.01Å; A1186-E1191 HydrophobicContact CB-CB 4.04Å
1187	N	90.8	Very high	92.3	Very high	23 Å²	23	46.9 Å²	46.9	12%	0.123	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	-176.3	167.6	85	-5.8	0	0	0	110.4	F1088 P1090 T1117 E1118 P1119 Q1189 G1190	F1088-N1187 PolarHBondContact O-ND2 3.15Å; P1090-N1187 HydrophobicContact CG-CB 4.19Å; T1117-N1187 PolarHBondContact OG1-ND2 2.87Å; E1118-N1187 VanDerWaalsContact C-ND2 3.34Å; E1118-N1187 PolarHBondContact O-ND2 3.24Å; E1118-N1187 VanDerWaalsContact O-ND2 3.12Å; P1119-N1187 PolarHBondContact O-ND2 2.88Å; N1187-Q1189 PolarHBondContact O-N 2.78Å; N1187-Q1189 WeakPolarHBondContact OD1-CA 3.32Å; N1187-Q1189 WeakPolarHBondContact OD1-CB 3.4Å; N1187-Q1189 PolarHBondContact OD1-N 2.72Å; N1187-G1190 PolarHBondContact N-O 2.99Å; N1187-G1190 PolarHBondContact O-N 2.94Å; N1187-G1190 PolarHBondContact OD1-N 3.43Å
1188	L	88.9	Confident	92.5	Very high	154 Å²	154	46.8 Å²	46.8	81%	0.806	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	0.7	-178.2	-63.1	177.6	0	0	0	115
1189	Q	88.4	Confident	92.5	Very high	110 Å²	110	45.3 Å²	45.3	51%	0.514	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.1	-13.2	180	-56.4	-65.7	-89.5	0	0	113.3	H1087 P1089 N1187	H1087-Q1189 HydrophobicContact CB-CG 4.29Å; P1089-Q1189 HydrophobicContact CB-CB 4.08Å; N1187-Q1189 PolarHBondContact O-N 2.78Å; N1187-Q1189 WeakPolarHBondContact OD1-CA 3.32Å; N1187-Q1189 WeakPolarHBondContact OD1-CB 3.4Å; N1187-Q1189 PolarHBondContact OD1-N 2.72Å
1190	G	91.3	Very high	92.4	Very high	31 Å²	31	45.9 Å²	45.9	32%	0.32	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	160	-168.4	179.1	0	0	0	0	0	114	P1090 A1186 N1187	P1090-G1190 VanDerWaalsContact CD-C 3.45Å; P1090-G1190 WeakPolarHBondContact CD-O 3.42Å; P1090-G1190 WeakPolarHBondContact CG-O 3.03Å; A1186-G1190 WeakPolarHBondContact CA-O 3.01Å; N1187-G1190 PolarHBondContact N-O 2.99Å; N1187-G1190 PolarHBondContact O-N 2.94Å; N1187-G1190 PolarHBondContact OD1-N 3.43Å
1191	E	94.4	Very high	92.3	Very high	130 Å²	130	45.8 Å²	45.8	61%	0.607	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.8	159.7	178.5	66.9	177.1	152.6	0	0	113	Q1184 A1185 A1186	Q1184-E1191 PolarHBondContact NE2-OE2 2.82Å; A1185-E1191 CarbonylContact O-C 3.51Å; A1185-E1191 VanDerWaalsContact O-CA 3.26Å; A1185-E1191 WeakPolarHBondContact O-CA 2.99Å; A1186-E1191 HydrophobicContact CB-CB 4.04Å
1192	A	93.2	Very high	92.1	Very high	26 Å²	26	47.6 Å²	47.6	22%	0.215	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	156.9	171.1	0	0	0	0	0	111.2	P1090 I1092 Q1184 A1185	P1090-A1192 HydrophobicContact CB-CB 4.48Å; P1090-A1192 VanDerWaalsContact O-CB 3.27Å; P1090-A1192 WeakPolarHBondContact O-CB 3.41Å; I1092-A1192 HydrophobicContact CD1-CB 4.45Å; I1092-A1192 HydrophobicContact CG1-CB 4.09Å; Q1184-A1192 CarbonylContact C-O 3.58Å; Q1184-A1192 WeakPolarHBondContact CA-O 3.46Å; A1185-A1192 PolarHBondContact N-O 2.85Å; A1185-A1192 PolarHBondContact O-N 3.32Å
1193	Q	93.2	Very high	92	Very high	92 Å²	92	50.6 Å²	50.6	43%	0.43	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	143.5	179	-175.7	176.8	-27.7	0	0	111	S1182 C1183 Q1184	S1182-Q1193 PolarHBondContact OG-NE2 2.84Å; C1183-Q1193 CarbonylContact O-C 3.59Å; C1183-Q1193 VanDerWaalsContact O-CA 3.3Å; C1183-Q1193 WeakPolarHBondContact O-CA 3.27Å; Q1184-Q1193 HydrophobicContact CB-CG 4.43Å
1194	L	91.8	Very high	92	Very high	13 Å²	13	50.8 Å²	50.8	7%	0.068	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	130.7	171.5	-179.5	57.1	0	0	0	110.5	I1092 Q1094 T1099 S1182 C1183	I1092-L1194 HydrophobicContact CB-CB 4.14Å; I1092-L1194 HydrophobicContact CD1-CB 4.15Å; I1092-L1194 HydrophobicContact CG2-CB 3.69Å; I1092-L1194 HydrophobicContact CG2-CD2 3.65Å; I1092-L1194 HydrophobicContact CG2-CG 4.32Å; Q1094-L1194 HydrophobicContact CG-CD1 3.88Å; Q1094-L1194 HydrophobicContact CG-CD2 4.48Å; T1099-L1194 HydrophobicContact CG2-CD1 4.13Å; T1099-L1194 HydrophobicContact CG2-CD2 4.43Å; S1182-L1194 VanDerWaalsContact CA-O 3.25Å; S1182-L1194 WeakPolarHBondContact CA-O 3.28Å; C1183-L1194 PolarHBondContact N-O 2.82Å; C1183-L1194 PolarHBondContact O-N 2.72Å
1195	E	92.5	Very high	91.9	Very high	113 Å²	113	50.8 Å²	50.8	53%	0.528	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	137.9	173.2	-170.3	174.7	-178.7	0	0	111.5	S1180 Y1181	S1180-E1195 VanDerWaalsContact CB-OE1 3.31Å; S1180-E1195 WeakPolarHBondContact CB-OE1 3Å; S1180-E1195 VanDerWaalsContact OG-CD 3.24Å; S1180-E1195 WeakPolarHBondContact OG-CG 3.45Å; S1180-E1195 PolarHBondContact OG-OE1 2.62Å; Y1181-E1195 CarbonylContact O-C 3.55Å; Y1181-E1195 WeakPolarHBondContact O-CA 3.23Å
1196	I	92.6	Very high	91.9	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	123.8	173.3	-57.6	-179.9	0	0	0	108.7	Y1098 T1099 A1101 L1111 T1112 W1125 Y1181	Y1098-I1196 WeakPolarHBondContact O-CD1 3.41Å; Y1098-I1196 WeakPolarHBondContact O-CG1 3.07Å; Y1098-I1196 WeakPolarHBondContact O-CG2 3.47Å; T1099-I1196 WeakPolarHBondContact O-CA 3.06Å; A1101-I1196 HydrophobicContact CB-CG2 4.06Å; L1111-I1196 HydrophobicContact CB-CD1 4.11Å; L1111-I1196 HydrophobicContact CD2-CG2 4.07Å; T1112-I1196 WeakPolarHBondContact O-CD1 3.23Å; W1125-I1196 HydrophobicContact CH2-CD1 4.4Å; W1125-I1196 HydrophobicContact CZ3-CD1 4.28Å; Y1181-I1196 PolarHBondContact N-O 3.11Å; Y1181-I1196 PolarHBondContact O-N 2.84Å
1197	H	92.6	Very high	91.8	Very high	101 Å²	101	52.4 Å²	52.4	47%	0.468	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	120.1	177.3	-170.6	78.3	0	0	0	111.3	T1099 A1101	T1099-H1197 PolarHBondContact O-N 3.49Å; A1101-H1197 PolarHBondContact N-O 3.46Å
1198	L	93.2	Very high	91.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	122.7	177.3	-179.7	61.6	0	0	0	111.3	A1101 V1109 L1111 V1170 F1178 G1179 Y1181	A1101-L1198 HydrophobicContact CB-CD1 3.87Å; A1101-L1198 WeakPolarHBondContact O-CA 3.38Å; V1109-L1198 HydrophobicContact CB-CD1 4.38Å; V1109-L1198 HydrophobicContact CG1-CD1 3.93Å; L1111-L1198 HydrophobicContact CD2-CB 4.44Å; L1111-L1198 HydrophobicContact CD2-CD1 4.27Å; V1170-L1198 HydrophobicContact CG2-CD2 4.44Å; F1178-L1198 VanDerWaalsContact CA-O 3.23Å; F1178-L1198 WeakPolarHBondContact CA-O 3.2Å; F1178-L1198 WeakPolarHBondContact CB-O 3.23Å; F1178-L1198 HydrophobicContact CD1-CG 4.39Å; G1179-L1198 PolarHBondContact N-O 3.38Å; G1179-L1198 VanDerWaalsContact N-O 3.09Å; G1179-L1198 PolarHBondContact O-N 3.14Å; Y1181-L1198 HydrophobicContact CD2-CB 3.83Å; Y1181-L1198 HydrophobicContact CD2-CD2 4.36Å; Y1181-L1198 HydrophobicContact CE2-CB 3.76Å; Y1181-L1198 HydrophobicContact CE2-CD2 3.61Å; Y1181-L1198 HydrophobicContact CE2-CG 4.31Å
1199	S	92.1	Very high	91.4	Very high	33 Å²	33	52 Å²	52	23%	0.231	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	-172.3	-177.4	69.8	0	0	0	0	113.3	A1101 A1102 G1103 F1178	A1101-S1199 PolarHBondContact O-N 2.03Å; A1102-S1199 VanDerWaalsContact CA-O 3.26Å; A1102-S1199 WeakPolarHBondContact CA-O 3.43Å; A1102-S1199 WeakPolarHBondContact CB-O 3.06Å; G1103-S1199 PolarHBondContact N-O 3.44Å; F1178-S1199 VanDerWaalsContact CE1-C 3.43Å; F1178-S1199 VanDerWaalsContact CE1-O 3.28Å; F1178-S1199 WeakPolarHBondContact CE1-O 3.49Å
1200	G	89.2	Confident	91.4	Very high	30 Å²	30	48 Å²	48	31%	0.309	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	156.8	169.8	0	0	0	0	0	111.9
1201	T	90.6	Very high	91.2	Very high	24 Å²	24	49.6 Å²	49.6	15%	0.147	27%	0.267	C	S	.	.			trans	-49	140.4	-175.5	60.1	0	0	0	0	114.3	G1103 E1104 G1230 L1232 H1287	G1103-T1201 PolarHBondContact O-N 3.34Å; E1104-T1201 HydrophobicContact CG-CG2 3.73Å; T1201-G1230 CarbonylContact C-O 3.59Å; T1201-G1230 WeakPolarHBondContact CA-O 2.94Å; T1201-L1232 HydrophobicContact CG2-CD1 4.14Å; T1201-L1232 HydrophobicContact CG2-CD2 4.14Å; T1201-L1232 HydrophobicContact CG2-CG 3.84Å; T1201-H1287 VanDerWaalsContact C-NE2 3.33Å; T1201-H1287 WeakPolarHBondContact CB-NE2 3.1Å; T1201-H1287 PolarHBondContact O-CE1 2.8Å; T1201-H1287 PolarHBondContact O-NE2 3.03Å; T1201-H1287 VanDerWaalsContact O-NE2 3.1Å; T1201-H1287 PolarHBondContact OG1-NE2 2.82Å
1202	S	91.2	Very high	90.9	Very high	38 Å²	38	46.7 Å²	46.7	27%	0.266	26%	0.255	S	S	.	.			trans	-135.4	-177.2	-179	66.9	0	0	0	0	112.9	G1230 N1284 H1287	S1202-G1230 PolarHBondContact N-O 2.82Å; S1202-G1230 WeakPolarHBondContact OG-CA 3.32Å; S1202-N1284 PolarHBondContact O-ND2 2.95Å; S1202-H1287 PolarHBondContact O-CD2 2.89Å
1203	T	91.5	Very high	90.3	Very high	67 Å²	67	48.6 Å²	48.6	41%	0.411	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-58.9	152.6	157.8	48	0	0	0	0	110.9	H1287	T1203-H1287 HydrophobicContact CG2-CB 3.76Å; T1203-H1287 WeakPolarHBondContact CG2-O 3.39Å
1204	P	92.6	Very high	89.8	Confident	5 Å²	5	49.2 Å²	49.2	3%	0.032	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-68.8	159.4	168.9	-16.6	31.8	0	0	0	112.9	F1228 Q1234 N1284	P1204-F1228 CarbonylContact C-O 3.57Å; P1204-F1228 WeakPolarHBondContact CA-O 3.38Å; P1204-Q1234 HydrophobicContact CG-CB 4.32Å; P1204-N1284 HydrophobicContact CG-CB 3.94Å
1205	D	93.1	Very high	89.2	Confident	46 Å²	46	49.3 Å²	49.3	25%	0.246	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-74	149.3	168.2	-75.4	-13.7	0	0	0	111.1	K1100 F1228 S1282	K1100-D1205 IonicContact NZ-OD1 3.18Å; K1100-D1205 PolarHBondContact NZ-OD1 2.87Å; K1100-D1205 IonicContact NZ-OD2 3.81Å; K1100-D1205 PolarHBondContact NZ-OD2 2.83Å; D1205-F1228 HydrophobicContact CB-CB 4.39Å; D1205-F1228 PolarHBondContact N-O 2.71Å; D1205-F1228 WeakPolarHBondContact OD2-CB 3.32Å; D1205-S1282 PolarHBondContact O-OG 3.18Å
1206	V	92.7	Very high	88.9	Confident	58 Å²	58	46.2 Å²	46.2	35%	0.352	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-59.1	138.7	174.4	-176.2	0	0	0	0	110.5	A1291 T1293	V1206-A1291 HydrophobicContact CG2-CB 4.08Å; V1206-T1293 HydrophobicContact CG1-CG2 4.19Å
1207	P	91.1	Very high	88.5	Confident	7 Å²	7	48.1 Å²	48.1	5%	0.045	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-56.9	145.8	175.5	-24.8	34.7	0	0	0	113.1	W1224 F1236 V1280 T1293	P1207-W1224 HydrophobicContact CB-CB 4.35Å; P1207-W1224 HydrophobicContact CB-CG 4.2Å; P1207-F1236 HydrophobicContact CB-CE1 4.5Å; P1207-F1236 HydrophobicContact CG-CD1 3.78Å; P1207-F1236 HydrophobicContact CG-CE1 3.9Å; P1207-V1280 HydrophobicContact CB-CG1 4.04Å; P1207-V1280 HydrophobicContact CG-CG1 4.14Å; P1207-V1280 HydrophobicContact CG-CG2 4.41Å; P1207-T1293 HydrophobicContact CB-CG2 4.03Å; P1207-T1293 HydrophobicContact CG-CG2 4.49Å; P1207-T1293 WeakPolarHBondContact O-CG2 3.43Å
1208	I	87.3	Confident	88.1	Confident	61 Å²	61	45.2 Å²	45.2	31%	0.313	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	163.2	-178.2	70.3	-172.8	0	0	0	111.2	P1096 F1210 T1225	P1096-I1208 HydrophobicContact CB-CD1 4.48Å; P1096-I1208 HydrophobicContact CG-CD1 3.87Å; I1208-F1210 PolarHBondContact O-N 2.79Å; I1208-T1225 HydrophobicContact CD1-CG2 4.26Å; I1208-T1225 HydrophobicContact CG1-CG2 4.05Å; I1208-T1225 PolarHBondContact N-O 3.09Å; I1208-T1225 VanDerWaalsContact N-O 3.09Å; I1208-T1225 PolarHBondContact O-N 2.77Å
1209	N	83.9	Confident	87.9	Confident	108 Å²	108	46.7 Å²	46.7	58%	0.578	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	54	33.4	178.7	-59.1	-31.8	0	0	0	115.1	R1211	N1209-R1211 PolarHBondContact O-N 2.04Å
1210	F	89.4	Confident	87.9	Confident	24 Å²	24	45.1 Å²	45.1	11%	0.105	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	130.4	175.2	-177.7	-124	0	0	0	110.8	I1208 V1222 A1223 W1224 V1278 V1280 T1293 I1296	I1208-F1210 PolarHBondContact O-N 2.79Å; F1210-V1222 HydrophobicContact CE2-CB 3.83Å; F1210-V1222 HydrophobicContact CE2-CG1 4.39Å; F1210-V1222 HydrophobicContact CE2-CG2 4.03Å; F1210-V1222 HydrophobicContact CZ-CB 4.23Å; F1210-V1222 HydrophobicContact CZ-CG1 4.32Å; F1210-V1222 HydrophobicContact CZ-CG2 4.44Å; F1210-A1223 CarbonylContact C-O 3.53Å; F1210-A1223 VanDerWaalsContact CA-O 3.31Å; F1210-A1223 WeakPolarHBondContact CA-O 3.39Å; F1210-A1223 WeakPolarHBondContact CD2-O 3.06Å; F1210-W1224 HydrophobicContact CB-CB 4.28Å; F1210-W1224 HydrophobicContact CD2-CB 4.15Å; F1210-W1224 AromaticContact CD2-CE3 3.98Å; F1210-W1224 HydrophobicContact CD2-CE3 3.98Å; F1210-W1224 HydrophobicContact CE2-CE3 4.06Å; F1210-V1278 HydrophobicContact CE1-CB 4.47Å; F1210-V1278 HydrophobicContact CE1-CG1 4.4Å; F1210-V1278 HydrophobicContact CZ-CB 4.25Å; F1210-V1278 HydrophobicContact CZ-CG1 3.77Å; F1210-V1280 HydrophobicContact CB-CG1 4.48Å; F1210-V1280 HydrophobicContact CD2-CG1 3.75Å; F1210-V1280 HydrophobicContact CE2-CG1 4.09Å; F1210-V1280 HydrophobicContact CG-CG1 4.02Å; F1210-T1293 HydrophobicContact CB-CG2 4.19Å; F1210-I1296 HydrophobicContact CB-CD1 4.42Å; F1210-I1296 HydrophobicContact CD1-CD1 3.36Å; F1210-I1296 HydrophobicContact CD1-CG1 3.75Å; F1210-I1296 HydrophobicContact CE1-CB 4.25Å; F1210-I1296 HydrophobicContact CE1-CD1 3.81Å; F1210-I1296 HydrophobicContact CE1-CG1 3.93Å; F1210-I1296 HydrophobicContact CG-CD1 4.09Å; F1210-I1296 VanDerWaalsContact O-CD1 3.25Å; F1210-I1296 WeakPolarHBondContact O-CD1 3.32Å
1211	R	87.8	Confident	87.9	Confident	66 Å²	66	46 Å²	46	25%	0.249	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	162	-169.4	64.9	-173.8	-175.5	-129.5	-1.1	113.1	G1009 N1209 V1222 A1223	G1009-R1211 VanDerWaalsContact C-NH2 3.35Å; G1009-R1211 VanDerWaalsContact O-CZ 3.31Å; G1009-R1211 PolarHBondContact O-NH1 3.38Å; G1009-R1211 PolarHBondContact O-NH2 2.9Å; N1209-R1211 PolarHBondContact O-N 2.04Å; R1211-V1222 CarbonylContact O-C 3.57Å; R1211-V1222 VanDerWaalsContact O-CA 3.29Å; R1211-V1222 WeakPolarHBondContact O-CA 3.42Å; R1211-A1223 HydrophobicContact CG-CB 4.33Å; R1211-A1223 PolarHBondContact N-O 2.89Å; R1211-A1223 PolarHBondContact O-N 3.39Å
1212	L	87.5	Confident	87.9	Confident	69 Å²	69	44.9 Å²	44.9	36%	0.361	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	140.7	165.8	-171.9	76.8	0	0	0	110.3	N1214 A1215 L1220 H1221 V1222 L1298	L1212-N1214 WeakPolarHBondContact CD1-O 3.48Å; L1212-A1215 HydrophobicContact CD2-CB 4.29Å; L1212-L1220 HydrophobicContact CD1-CB 4.24Å; L1212-L1220 HydrophobicContact CD1-CD2 3.93Å; L1212-H1221 WeakPolarHBondContact CD1-O 3.19Å; L1212-V1222 HydrophobicContact CD1-CG1 4.19Å; L1212-L1298 HydrophobicContact CB-CD2 3.87Å; L1212-L1298 HydrophobicContact CD1-CD1 4.07Å; L1212-L1298 HydrophobicContact CD1-CD2 4.13Å; L1212-L1298 HydrophobicContact CD2-CD2 4.28Å; L1212-L1298 HydrophobicContact CG-CD2 4.32Å
1213	L	80	Confident	87.7	Confident	66 Å²	66	43.1 Å²	43.1	35%	0.346	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	-43.3	167.9	-63.4	-175.4	0	0	0	112.2	H1221 A1223 E1264	L1213-H1221 HydrophobicContact CB-CB 4.4Å; L1213-H1221 PolarHBondContact N-O 3.07Å; L1213-A1223 HydrophobicContact CD1-CB 3.79Å; L1213-A1223 HydrophobicContact CD2-CB 4.07Å; L1213-A1223 HydrophobicContact CG-CB 3.81Å; L1213-E1264 HydrophobicContact CD1-CG 4.1Å
1214	N	82.3	Confident	87.6	Confident	104 Å²	104	40 Å²	40	56%	0.556	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-158.6	156.7	178.1	-163.9	9.7	0	0	0	111.9	L1212 H1221	L1212-N1214 WeakPolarHBondContact CD1-O 3.48Å; N1214-H1221 HydrophobicContact CB-CB 4.37Å; N1214-H1221 PolarHBondContact N-O 3.28Å; N1214-H1221 PolarHBondContact O-N 3.38Å
1215	A	80.1	Confident	87.2	Confident	15 Å²	15	40.4 Å²	40.4	12%	0.124	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	141.3	174.2	0	0	0	0	0	110.9	L1212 L1220	L1212-A1215 HydrophobicContact CD2-CB 4.29Å; A1215-L1220 HydrophobicContact CB-CD2 3.64Å
1216	T	86	Confident	86.9	Confident	49 Å²	49	38.4 Å²	38.4	30%	0.301	21%	0.211	S	C	.	.			trans	-117.2	-172.5	169.5	73	0	0	0	0	109.7	S1218 T1219 T1300 L1301	T1216-S1218 PolarHBondContact O-N 2.73Å; T1216-S1218 PolarHBondContact OG1-N 2.85Å; T1216-S1218 VanDerWaalsContact OG1-N 3.16Å; T1216-T1219 WeakPolarHBondContact CG2-OG1 3.36Å; T1216-T1219 PolarHBondContact N-O 2.81Å; T1216-T1219 WeakPolarHBondContact OG1-CB 3.41Å; T1216-T1219 PolarHBondContact OG1-N 2.89Å; T1216-T1219 PolarHBondContact OG1-OG1 2.79Å; T1216-T1300 WeakPolarHBondContact O-CA 3.4Å; T1216-T1300 WeakPolarHBondContact O-CB 3.37Å; T1216-L1301 PolarHBondContact O-N 2.95Å
1217	S	83.5	Confident	86.6	Confident	40 Å²	40	35.7 Å²	35.7	28%	0.28	19%	0.194	S	C	.	.	S	Bend	trans	-71.3	-9.1	171.5	54.9	0	0	0	0	114.3	P1272 L1301	S1217-P1272 WeakPolarHBondContact O-CA 3.46Å; S1217-P1272 WeakPolarHBondContact O-CG 3.24Å; S1217-L1301 WeakPolarHBondContact CA-O 3.41Å
1218	S	85.6	Confident	86.6	Confident	40 Å²	40	35.9 Å²	35.9	28%	0.28	19%	0.194	S	C	.	.	S	Bend	trans	-142.1	2.9	179.6	64.9	0	0	0	0	115.5	T1216 G1269 L1270	T1216-S1218 PolarHBondContact O-N 2.73Å; T1216-S1218 PolarHBondContact OG1-N 2.85Å; T1216-S1218 VanDerWaalsContact OG1-N 3.16Å; S1218-G1269 PolarHBondContact O-N 3.46Å; S1218-G1269 VanDerWaalsContact O-N 3.14Å; S1218-L1270 WeakPolarHBondContact CA-O 3.41Å; S1218-L1270 WeakPolarHBondContact O-CB 3.48Å; S1218-L1270 PolarHBondContact O-N 2.94Å
1219	T	89	Confident	86.7	Confident	31 Å²	31	34.1 Å²	34.1	19%	0.19	19%	0.186	C	C	.	.			trans	-139.8	151.6	-177.8	73.5	0	0	0	0	113.1	T1216 I1267 T1268	T1216-T1219 WeakPolarHBondContact CG2-OG1 3.36Å; T1216-T1219 PolarHBondContact N-O 2.81Å; T1216-T1219 WeakPolarHBondContact OG1-CB 3.41Å; T1216-T1219 PolarHBondContact OG1-N 2.89Å; T1216-T1219 PolarHBondContact OG1-OG1 2.79Å; T1219-I1267 CarbonylContact C-O 3.58Å; T1219-I1267 WeakPolarHBondContact CA-O 3.42Å; T1219-I1267 WeakPolarHBondContact CB-O 3.37Å; T1219-T1268 HydrophobicContact CG2-CG2 3.96Å
1220	L	90.6	Very high	86.9	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	121.2	169.1	-67.2	172	0	0	0	109	L1212 A1215 I1267 L1270 Y1276 L1298 T1300	L1212-L1220 HydrophobicContact CD1-CB 4.24Å; L1212-L1220 HydrophobicContact CD1-CD2 3.93Å; A1215-L1220 HydrophobicContact CB-CD2 3.64Å; L1220-I1267 HydrophobicContact CB-CB 4.44Å; L1220-I1267 PolarHBondContact N-O 3.03Å; L1220-I1267 PolarHBondContact O-N 3.42Å; L1220-L1270 HydrophobicContact CB-CD1 4.01Å; L1220-L1270 HydrophobicContact CD1-CD1 3.64Å; L1220-L1270 HydrophobicContact CG-CD1 3.54Å; L1220-Y1276 HydrophobicContact CD1-CD2 4.4Å; L1220-L1298 HydrophobicContact CD1-CB 3.65Å; L1220-L1298 HydrophobicContact CD1-CD1 4.33Å; L1220-L1298 HydrophobicContact CD2-CB 4.22Å; L1220-T1300 HydrophobicContact CD2-CG2 4.39Å; L1220-T1300 HydrophobicContact CG-CG2 4.29Å
1221	H	90.5	Very high	86.7	Confident	48 Å²	48	28.8 Å²	28.8	22%	0.222	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	117.1	175.6	-172.6	-171.2	0	0	0	108.9	L1212 L1213 N1214 Y1265 I1266	L1212-H1221 WeakPolarHBondContact CD1-O 3.19Å; L1213-H1221 HydrophobicContact CB-CB 4.4Å; L1213-H1221 PolarHBondContact N-O 3.07Å; N1214-H1221 HydrophobicContact CB-CB 4.37Å; N1214-H1221 PolarHBondContact N-O 3.28Å; N1214-H1221 PolarHBondContact O-N 3.38Å; H1221-Y1265 PolarHBondContact CD2-O 3.05Å; H1221-I1266 HydrophobicContact CB-CG1 4.27Å
1222	V	90.3	Very high	86.6	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	156.9	-176	-66.4	0	0	0	0	111.8	F1210 R1211 L1212 W1224 E1264 Y1265 I1267 L1298	F1210-V1222 HydrophobicContact CE2-CB 3.83Å; F1210-V1222 HydrophobicContact CE2-CG1 4.39Å; F1210-V1222 HydrophobicContact CE2-CG2 4.03Å; F1210-V1222 HydrophobicContact CZ-CB 4.23Å; F1210-V1222 HydrophobicContact CZ-CG1 4.32Å; F1210-V1222 HydrophobicContact CZ-CG2 4.44Å; R1211-V1222 CarbonylContact O-C 3.57Å; R1211-V1222 VanDerWaalsContact O-CA 3.29Å; R1211-V1222 WeakPolarHBondContact O-CA 3.42Å; L1212-V1222 HydrophobicContact CD1-CG1 4.19Å; V1222-W1224 HydrophobicContact CG2-CZ3 4.36Å; V1222-E1264 CarbonylContact O-C 3.4Å; V1222-E1264 WeakPolarHBondContact O-CA 3.37Å; V1222-Y1265 WeakPolarHBondContact CG2-O 3.37Å; V1222-Y1265 PolarHBondContact N-O 3.34Å; V1222-Y1265 PolarHBondContact O-N 2.86Å; V1222-I1267 HydrophobicContact CG2-CD1 4.42Å; V1222-L1298 HydrophobicContact CG1-CD1 3.68Å
1223	A	87.6	Confident	86.6	Confident	1 Å²	1	28 Å²	28	1%	0.008	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	156.3	-179.8	0	0	0	0	0	112.3	F1210 R1211 L1213 V1263 E1264	F1210-A1223 CarbonylContact C-O 3.53Å; F1210-A1223 VanDerWaalsContact CA-O 3.31Å; F1210-A1223 WeakPolarHBondContact CA-O 3.39Å; F1210-A1223 WeakPolarHBondContact CD2-O 3.06Å; R1211-A1223 HydrophobicContact CG-CB 4.33Å; R1211-A1223 PolarHBondContact N-O 2.89Å; R1211-A1223 PolarHBondContact O-N 3.39Å; L1213-A1223 HydrophobicContact CD1-CB 3.79Å; L1213-A1223 HydrophobicContact CD2-CB 4.07Å; L1213-A1223 HydrophobicContact CG-CB 3.81Å; A1223-V1263 CarbonylContact C-O 3.47Å; A1223-V1263 WeakPolarHBondContact CA-O 3.1Å; A1223-E1264 HydrophobicContact CB-CG 3.9Å
1224	W	89.2	Confident	86.9	Confident	1 Å²	1	25 Å²	25	0%	0.004	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	170.2	173.5	56.1	98.3	0	0	0	111.3	P1207 F1210 V1222 F1236 V1238 V1254 G1262 V1263 V1280	P1207-W1224 HydrophobicContact CB-CB 4.35Å; P1207-W1224 HydrophobicContact CB-CG 4.2Å; F1210-W1224 HydrophobicContact CB-CB 4.28Å; F1210-W1224 HydrophobicContact CD2-CB 4.15Å; F1210-W1224 AromaticContact CD2-CE3 3.98Å; F1210-W1224 HydrophobicContact CD2-CE3 3.98Å; F1210-W1224 HydrophobicContact CE2-CE3 4.06Å; V1222-W1224 HydrophobicContact CG2-CZ3 4.36Å; W1224-F1236 AromaticContact CE2-CG 3.96Å; W1224-F1236 HydrophobicContact CZ2-CB 3.75Å; W1224-F1236 HydrophobicContact CZ2-CD2 4.23Å; W1224-F1236 AromaticContact CZ2-CG 3.92Å; W1224-F1236 HydrophobicContact CZ2-CG 3.92Å; W1224-F1236 AromaticContact NE1-CD1 3.32Å; W1224-F1236 VanDerWaalsContact NE1-CD1 3.32Å; W1224-F1236 AromaticContact NE1-CD2 3.74Å; W1224-F1236 AromaticContact NE1-CE1 3.57Å; W1224-F1236 AromaticContact NE1-CE2 3.97Å; W1224-F1236 AromaticContact NE1-CG 3.43Å; W1224-F1236 AromaticContact NE1-CZ 3.9Å; W1224-V1238 HydrophobicContact CH2-CG2 3.42Å; W1224-V1238 VanDerWaalsContact CH2-CG2 3.42Å; W1224-V1238 HydrophobicContact CZ2-CG2 4.25Å; W1224-V1238 HydrophobicContact CZ3-CG2 3.76Å; W1224-V1254 HydrophobicContact CH2-CB 4.27Å; W1224-V1254 HydrophobicContact CH2-CG1 4.13Å; W1224-V1254 HydrophobicContact CH2-CG2 4.21Å; W1224-V1254 HydrophobicContact CZ2-CB 4.25Å; W1224-V1254 HydrophobicContact CZ2-CG1 4.15Å; W1224-G1262 CarbonylContact O-C 3.55Å; W1224-G1262 VanDerWaalsContact O-CA 3.25Å; W1224-G1262 WeakPolarHBondContact O-CA 3.41Å; W1224-V1263 HydrophobicContact CD2-CB 4.3Å; W1224-V1263 HydrophobicContact CH2-CG1 3.94Å; W1224-V1263 HydrophobicContact CZ2-CB 3.87Å; W1224-V1263 HydrophobicContact CZ2-CG1 3.4Å; W1224-V1263 VanDerWaalsContact CZ2-CG1 3.4Å; W1224-V1263 PolarHBondContact N-O 2.71Å; W1224-V1263 PolarHBondContact O-N 3.33Å; W1224-V1280 HydrophobicContact CD2-CG1 4.16Å; W1224-V1280 HydrophobicContact CD2-CG2 4.21Å; W1224-V1280 HydrophobicContact CE3-CG1 4.34Å; W1224-V1280 HydrophobicContact CE3-CG2 4.47Å; W1224-V1280 HydrophobicContact CG-CG1 4.27Å; W1224-V1280 HydrophobicContact CH2-CG2 4.25Å; W1224-V1280 HydrophobicContact CZ2-CG2 3.94Å
1225	T	82.9	Confident	87.4	Confident	15 Å²	15	22.9 Å²	22.9	9%	0.092	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	138.6	170.5	-54.8	0	0	0	0	109.6	I1208 N1261	I1208-T1225 HydrophobicContact CD1-CG2 4.26Å; I1208-T1225 HydrophobicContact CG1-CG2 4.05Å; I1208-T1225 PolarHBondContact N-O 3.09Å; I1208-T1225 VanDerWaalsContact N-O 3.09Å; I1208-T1225 PolarHBondContact O-N 2.77Å; T1225-N1261 CarbonylContact C-O 3.38Å; T1225-N1261 WeakPolarHBondContact CA-O 3.19Å; T1225-N1261 WeakPolarHBondContact CG2-O 3.19Å
1226	Q	86.8	Confident	88	Confident	4 Å²	4	22.1 Å²	22.1	2%	0.019	14%	0.144	C	C	.	.			trans	-72.6	134.8	-179.9	-58	-165.4	65.3	0	0	111.5	F1236 N1257 R1260 N1261 V1263	Q1226-F1236 HydrophobicContact CB-CZ 4.04Å; Q1226-F1236 HydrophobicContact CG-CE2 3.94Å; Q1226-F1236 HydrophobicContact CG-CZ 3.59Å; Q1226-N1257 PolarHBondContact NE2-O 2.9Å; Q1226-R1260 PolarHBondContact NE2-O 2.73Å; Q1226-N1261 PolarHBondContact N-O 2.76Å; Q1226-V1263 HydrophobicContact CG-CG2 3.68Å
1227	G	87.9	Confident	88.4	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.01	14%	0.14	C	C	.	.			trans	-81.6	-169.4	168.7	0	0	0	0	0	112.6	R1097	R1097-G1227 WeakPolarHBondContact CG-O 3.43Å
1228	F	90.8	Very high	88.9	Confident	10 Å²	10	20 Å²	20	4%	0.044	13%	0.127	C	C	.	.			trans	-66.3	133.4	166.6	176.5	-121.7	0	0	0	111	K1100 A1102 P1204 D1205 G1230	K1100-F1228 HydrophobicContact CB-CB 4.25Å; K1100-F1228 HydrophobicContact CB-CD1 3.81Å; K1100-F1228 HydrophobicContact CB-CD2 3.56Å; K1100-F1228 HydrophobicContact CB-CE1 3.93Å; K1100-F1228 HydrophobicContact CB-CE2 3.72Å; K1100-F1228 HydrophobicContact CB-CG 3.61Å; K1100-F1228 HydrophobicContact CB-CZ 3.88Å; K1100-F1228 HydrophobicContact CD-CB 3.82Å; K1100-F1228 HydrophobicContact CD-CD1 3.51Å; K1100-F1228 HydrophobicContact CD-CE1 4.15Å; K1100-F1228 HydrophobicContact CD-CG 3.71Å; K1100-F1228 HydrophobicContact CG-CD1 4.33Å; K1100-F1228 HydrophobicContact CG-CG 4.33Å; K1100-F1228 WeakPolarHBondContact O-CE2 3.48Å; A1102-F1228 HydrophobicContact CB-CE1 4.46Å; A1102-F1228 HydrophobicContact CB-CZ 3.7Å; P1204-F1228 CarbonylContact C-O 3.57Å; P1204-F1228 WeakPolarHBondContact CA-O 3.38Å; D1205-F1228 HydrophobicContact CB-CB 4.39Å; D1205-F1228 PolarHBondContact N-O 2.71Å; D1205-F1228 WeakPolarHBondContact OD2-CB 3.32Å; F1228-G1230 VanDerWaalsContact C-N 3.32Å; F1228-G1230 VanDerWaalsContact CE1-CA 3.5Å; F1228-G1230 PolarHBondContact O-N 2.91Å
1229	D	88.6	Confident	89.3	Confident	25 Å²	25	20.8 Å²	20.8	13%	0.134	12%	0.123	C	C	.	.			trans	-83.9	-2.7	-172.8	51.3	39.6	0	0	0	114.5	R1097 G1231 L1232 Q1234 N1284	R1097-D1229 IonicContact CZ-OD2 2.76Å; R1097-D1229 IonicContact NE-OD2 2.63Å; R1097-D1229 PolarHBondContact NE-OD2 3.38Å; R1097-D1229 IonicContact NH2-OD2 2.72Å; R1097-D1229 PolarHBondContact NH2-OD2 2.89Å; D1229-G1231 VanDerWaalsContact C-N 3.32Å; D1229-G1231 PolarHBondContact OD1-N 2.82Å; D1229-L1232 WeakPolarHBondContact CB-O 3.4Å; D1229-Q1234 HydrophobicContact CB-CB 3.97Å; D1229-Q1234 HydrophobicContact CB-CG 3.91Å; D1229-N1284 PolarHBondContact O-ND2 2.81Å
1230	G	88.6	Confident	89.5	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.119	C	C	.	.			trans	79	12.7	-176.8	0	0	0	0	0	113.7	T1201 S1202 F1228	T1201-G1230 CarbonylContact C-O 3.59Å; T1201-G1230 WeakPolarHBondContact CA-O 2.94Å; S1202-G1230 PolarHBondContact N-O 2.82Å; S1202-G1230 WeakPolarHBondContact OG-CA 3.32Å; F1228-G1230 VanDerWaalsContact C-N 3.32Å; F1228-G1230 VanDerWaalsContact CE1-CA 3.5Å; F1228-G1230 PolarHBondContact O-N 2.91Å
1231	G	85.6	Confident	89.7	Confident	20 Å²	20	23.8 Å²	23.8	21%	0.206	13%	0.131	C	C	.	.	S	Bend	trans	79.4	18.6	-179.1	0	0	0	0	0	114.4	A1102 D1229	A1102-G1231 VanDerWaalsContact O-CA 3.29Å; A1102-G1231 WeakPolarHBondContact O-CA 3.31Å; D1229-G1231 VanDerWaalsContact C-N 3.32Å; D1229-G1231 PolarHBondContact OD1-N 2.82Å
1232	L	86.1	Confident	89.7	Confident	36 Å²	36	23.9 Å²	23.9	19%	0.188	13%	0.132	C	C	.	.	S	Bend	trans	-143.8	154.4	176.3	-67.8	173.8	0	0	0	108.9	T1201 D1229 Q1234 N1284 K1286	T1201-L1232 HydrophobicContact CG2-CD1 4.14Å; T1201-L1232 HydrophobicContact CG2-CD2 4.14Å; T1201-L1232 HydrophobicContact CG2-CG 3.84Å; D1229-L1232 WeakPolarHBondContact CB-O 3.4Å; L1232-Q1234 PolarHBondContact O-N 3.18Å; L1232-N1284 HydrophobicContact CB-CB 4.16Å; L1232-K1286 HydrophobicContact CD1-CB 3.42Å; L1232-K1286 VanDerWaalsContact CD1-CB 3.42Å; L1232-K1286 HydrophobicContact CD1-CD 3.71Å; L1232-K1286 HydrophobicContact CD1-CG 4.22Å
1233	A	85.7	Confident	89.6	Confident	83 Å²	83	26.6 Å²	26.6	69%	0.686	15%	0.148	S	C	*	.			trans	-57.4	124.6	179.7	0	0	0	0	0	111.6	N1284	A1233-N1284 WeakPolarHBondContact O-CB 3.2Å
1234	Q	87.8	Confident	89.2	Confident	3 Å²	3	30.1 Å²	30.1	1%	0.014	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	152.3	179.4	72.9	-174.4	-14.3	0	0	112.5	P1204 D1229 L1232 F1236 S1256 M1283	P1204-Q1234 HydrophobicContact CG-CB 4.32Å; D1229-Q1234 HydrophobicContact CB-CB 3.97Å; D1229-Q1234 HydrophobicContact CB-CG 3.91Å; L1232-Q1234 PolarHBondContact O-N 3.18Å; Q1234-F1236 HydrophobicContact CG-CE2 4.35Å; Q1234-F1236 HydrophobicContact CG-CZ 4.16Å; Q1234-S1256 WeakPolarHBondContact O-CB 3.49Å; Q1234-S1256 PolarHBondContact O-OG 2.82Å; Q1234-M1283 CarbonylContact C-O 3.54Å; Q1234-M1283 WeakPolarHBondContact CA-O 3.44Å
1235	T	91.2	Very high	88.6	Confident	58 Å²	58	31.8 Å²	31.8	36%	0.356	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	170	160.9	55.2	0	0	0	0	109.4	S1282 M1283	T1235-S1282 CarbonylContact O-C 3.47Å; T1235-S1282 VanDerWaalsContact O-CA 3.32Å; T1235-S1282 WeakPolarHBondContact O-CA 3.35Å; T1235-M1283 PolarHBondContact N-O 3.18Å; T1235-M1283 PolarHBondContact O-N 2.82Å; T1235-M1283 WeakPolarHBondContact OG1-CG 2.98Å
1236	F	93.8	Very high	88.4	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	150.8	175.1	-58.2	-83.1	0	0	0	110.1	P1207 W1224 Q1226 Q1234 D1253 V1254 V1263 V1280 N1281	P1207-F1236 HydrophobicContact CB-CE1 4.5Å; P1207-F1236 HydrophobicContact CG-CD1 3.78Å; P1207-F1236 HydrophobicContact CG-CE1 3.9Å; W1224-F1236 AromaticContact CE2-CG 3.96Å; W1224-F1236 HydrophobicContact CZ2-CB 3.75Å; W1224-F1236 HydrophobicContact CZ2-CD2 4.23Å; W1224-F1236 AromaticContact CZ2-CG 3.92Å; W1224-F1236 HydrophobicContact CZ2-CG 3.92Å; W1224-F1236 AromaticContact NE1-CD1 3.32Å; W1224-F1236 VanDerWaalsContact NE1-CD1 3.32Å; W1224-F1236 AromaticContact NE1-CD2 3.74Å; W1224-F1236 AromaticContact NE1-CE1 3.57Å; W1224-F1236 AromaticContact NE1-CE2 3.97Å; W1224-F1236 AromaticContact NE1-CG 3.43Å; W1224-F1236 AromaticContact NE1-CZ 3.9Å; Q1226-F1236 HydrophobicContact CB-CZ 4.04Å; Q1226-F1236 HydrophobicContact CG-CE2 3.94Å; Q1226-F1236 HydrophobicContact CG-CZ 3.59Å; Q1234-F1236 HydrophobicContact CG-CE2 4.35Å; Q1234-F1236 HydrophobicContact CG-CZ 4.16Å; F1236-D1253 CarbonylContact O-C 3.57Å; F1236-D1253 WeakPolarHBondContact O-CA 3.33Å; F1236-V1254 HydrophobicContact CB-CB 4.39Å; F1236-V1254 PolarHBondContact N-O 2.8Å; F1236-V1254 PolarHBondContact O-N 2.96Å; F1236-V1263 HydrophobicContact CD2-CG2 4.33Å; F1236-V1263 HydrophobicContact CE2-CG2 3.92Å; F1236-V1280 HydrophobicContact CB-CG2 4.02Å; F1236-N1281 WeakPolarHBondContact CA-O 3.4Å; F1236-N1281 WeakPolarHBondContact CB-O 3.2Å; F1236-N1281 WeakPolarHBondContact CD1-O 3.32Å
1237	Q	93.3	Very high	87.6	Confident	44 Å²	44	42 Å²	42	21%	0.206	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	116.4	170.6	177.5	175	96.7	0	0	109.9	Y1251 A1252 D1253 V1280 N1281 Y1292	Q1237-Y1251 HydrophobicContact CG-CD1 3.98Å; Q1237-A1252 WeakPolarHBondContact CA-O 3.45Å; Q1237-D1253 WeakPolarHBondContact CB-OD1 3.13Å; Q1237-D1253 VanDerWaalsContact CG-OD1 3.3Å; Q1237-D1253 WeakPolarHBondContact CG-OD1 3.48Å; Q1237-D1253 PolarHBondContact NE2-OD1 2.84Å; Q1237-V1280 WeakPolarHBondContact O-CA 3.03Å; Q1237-N1281 WeakPolarHBondContact CB-OD1 3.39Å; Q1237-N1281 PolarHBondContact N-O 3.49Å; Q1237-N1281 VanDerWaalsContact N-O 3.1Å; Q1237-N1281 PolarHBondContact N-OD1 2.91Å; Q1237-N1281 PolarHBondContact O-N 3.27Å; Q1237-N1281 VanDerWaalsContact O-N 3.13Å; Q1237-N1281 PolarHBondContact O-OD1 3.26Å; Q1237-Y1292 PolarHBondContact OE1-OH 3.33Å
1238	V	94.1	Very high	87.3	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	129.3	176.7	-177.7	0	0	0	0	108.3	W1224 W1240 Y1251 A1252 V1254 Y1265 I1267 V1278 V1280	W1224-V1238 HydrophobicContact CH2-CG2 3.42Å; W1224-V1238 VanDerWaalsContact CH2-CG2 3.42Å; W1224-V1238 HydrophobicContact CZ2-CG2 4.25Å; W1224-V1238 HydrophobicContact CZ3-CG2 3.76Å; V1238-W1240 HydrophobicContact CG1-CE3 4.45Å; V1238-Y1251 CarbonylContact O-C 2.84Å; V1238-Y1251 WeakPolarHBondContact O-CA 3.39Å; V1238-A1252 PolarHBondContact N-O 3.13Å; V1238-A1252 PolarHBondContact O-N 3.1Å; V1238-V1254 HydrophobicContact CG2-CG2 3.95Å; V1238-Y1265 HydrophobicContact CB-CD1 4.42Å; V1238-Y1265 HydrophobicContact CG1-CD1 4.37Å; V1238-Y1265 HydrophobicContact CG2-CD1 4.3Å; V1238-I1267 HydrophobicContact CG1-CD1 4.28Å; V1238-V1278 HydrophobicContact CG1-CG1 3.97Å; V1238-V1280 HydrophobicContact CG2-CB 4.26Å; V1238-V1280 HydrophobicContact CG2-CG2 3.88Å
1239	R	94.1	Very high	87.4	Confident	56 Å²	56	52.1 Å²	52.1	21%	0.211	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	142	175.4	71.8	176.9	176.6	-175.1	-1.1	112.2	Y1249 K1250 Y1251 V1278 S1279 Y1292	R1239-Y1249 HydrophobicContact CB-CD1 4.14Å; R1239-Y1249 HydrophobicContact CB-CG 4.44Å; R1239-Y1249 HydrophobicContact CG-CD1 3.99Å; R1239-Y1249 HydrophobicContact CG-CE1 4.36Å; R1239-Y1249 HydrophobicContact CG-CG 4.49Å; R1239-K1250 CarbonylContact C-O 3.5Å; R1239-K1250 WeakPolarHBondContact CA-O 3.32Å; R1239-Y1251 HydrophobicContact CB-CD1 3.55Å; R1239-Y1251 HydrophobicContact CB-CE1 3.61Å; R1239-Y1251 HydrophobicContact CB-CG 4.4Å; R1239-Y1251 HydrophobicContact CG-CE1 4.45Å; R1239-V1278 WeakPolarHBondContact O-CA 2.99Å; R1239-S1279 WeakPolarHBondContact CG-OG 3.31Å; R1239-S1279 PolarHBondContact N-O 3.36Å; R1239-S1279 PolarHBondContact NE-OG 3.43Å; R1239-S1279 PolarHBondContact O-N 2.94Å; R1239-Y1292 HydrophobicContact CB-CE1 4.18Å; R1239-Y1292 HydrophobicContact CG-CD1 3.98Å; R1239-Y1292 HydrophobicContact CG-CE1 3.58Å; R1239-Y1292 VanDerWaalsContact CZ-CG 3.42Å
1240	W	94.9	Very high	87.4	Confident	24 Å²	24	56.9 Å²	56.9	9%	0.091	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	150.5	176.9	67.9	108.3	0	0	0	114.1	V1238 K1250 A1252 I1267 I1277 V1278	V1238-W1240 HydrophobicContact CG1-CE3 4.45Å; W1240-K1250 HydrophobicContact CD2-CB 3.87Å; W1240-K1250 HydrophobicContact CE3-CB 4.26Å; W1240-K1250 HydrophobicContact CG-CB 4.43Å; W1240-K1250 HydrophobicContact CH2-CB 4.02Å; W1240-K1250 HydrophobicContact CZ2-CB 3.63Å; W1240-K1250 HydrophobicContact CZ2-CD 4.03Å; W1240-K1250 HydrophobicContact CZ2-CG 4.49Å; W1240-K1250 HydrophobicContact CZ3-CB 4.32Å; W1240-K1250 PolarHBondContact N-O 2.79Å; W1240-K1250 PolarHBondContact O-N 2.86Å; W1240-A1252 HydrophobicContact CH2-CB 4Å; W1240-A1252 HydrophobicContact CZ3-CB 3.78Å; W1240-I1267 HydrophobicContact CB-CD1 4.32Å; W1240-I1267 HydrophobicContact CD2-CD1 4.33Å; W1240-I1267 HydrophobicContact CD2-CG2 3.82Å; W1240-I1267 VanDerWaalsContact CE2-CG2 3.49Å; W1240-I1267 HydrophobicContact CE3-CD1 4.43Å; W1240-I1267 HydrophobicContact CE3-CG2 4.49Å; W1240-I1267 HydrophobicContact CG-CD1 4.29Å; W1240-I1267 HydrophobicContact CG-CG2 4.02Å; W1240-I1267 HydrophobicContact CZ2-CG2 3.97Å; W1240-I1277 WeakPolarHBondContact CA-O 3.46Å; W1240-V1278 HydrophobicContact CB-CB 4.46Å; W1240-V1278 HydrophobicContact CB-CG1 4.29Å; W1240-V1278 HydrophobicContact CB-CG2 3.92Å
1241	R	93.2	Very high	87.5	Confident	70 Å²	70	62.5 Å²	62.5	26%	0.264	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	157	169.7	71.9	-176.9	179.9	100	5.5	111.4	S1245 Y1249 Y1276 I1277	R1241-S1245 PolarHBondContact NH1-O 2.85Å; R1241-S1245 VanDerWaalsContact NH1-O 3.15Å; R1241-Y1249 HydrophobicContact CB-CD1 3.94Å; R1241-Y1249 HydrophobicContact CB-CE1 4.18Å; R1241-Y1249 HydrophobicContact CB-CG 4.46Å; R1241-Y1249 HydrophobicContact CG-CD1 3.87Å; R1241-Y1249 HydrophobicContact CG-CE1 3.58Å; R1241-Y1249 VanDerWaalsContact NE-CZ 3.33Å; R1241-Y1249 PolarHBondContact NE-OH 2.8Å; R1241-Y1249 VanDerWaalsContact NE-OH 3.14Å; R1241-Y1276 CarbonylContact O-C 3.54Å; R1241-Y1276 VanDerWaalsContact O-CA 3.29Å; R1241-Y1276 WeakPolarHBondContact O-CA 3.03Å; R1241-I1277 HydrophobicContact CG-CB 4.47Å; R1241-I1277 PolarHBondContact N-O 3.11Å; R1241-I1277 PolarHBondContact O-N 2.83Å
1242	E	91.5	Very high	87.7	Confident	51 Å²	51	62.2 Å²	62.2	24%	0.238	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	136.9	176.3	-169.5	174.6	160.3	0	0	110.9	S1245 K1271 Y1276	E1242-S1245 WeakPolarHBondContact O-CB 3.25Å; E1242-S1245 PolarHBondContact O-N 2.81Å; E1242-S1245 VanDerWaalsContact O-N 3.14Å; E1242-K1271 WeakPolarHBondContact OE1-CD 3.48Å; E1242-K1271 IonicContact OE1-NZ 3.82Å; E1242-K1271 PolarHBondContact OE1-NZ 3.3Å; E1242-K1271 WeakPolarHBondContact OE2-CE 3.25Å; E1242-K1271 IonicContact OE2-NZ 2.8Å; E1242-K1271 PolarHBondContact OE2-NZ 3.07Å; E1242-Y1276 HydrophobicContact CB-CD1 4.08Å; E1242-Y1276 HydrophobicContact CB-CE1 3.71Å; E1242-Y1276 HydrophobicContact CG-CE1 4.14Å
1243	V	87.4	Confident	87.9	Confident	57 Å²	57	65.8 Å²	65.8	35%	0.345	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	134.4	178.5	174.1	0	0	0	0	109.8	S1245 E1275 I1277	V1243-S1245 PolarHBondContact O-N 2.88Å; V1243-E1275 HydrophobicContact CB-CB 4.22Å; V1243-E1275 HydrophobicContact CG2-CB 4.02Å; V1243-E1275 HydrophobicContact CG2-CG 3.84Å; V1243-E1275 PolarHBondContact N-O 2.92Å; V1243-I1277 HydrophobicContact CG2-CD1 4.06Å; V1243-I1277 HydrophobicContact CG2-CG1 3.9Å
1244	G	79.9	Confident	88.1	Confident	74 Å²	74	62.7 Å²	62.7	76%	0.763	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	-10.2	-174.7	0	0	0	0	0	115.2
1245	S	77	Confident	87.9	Confident	37 Å²	37	66 Å²	66	26%	0.259	36%	0.36	S	S	.	.			trans	-78.4	138.7	177.2	-173.9	0	0	0	0	112.6	R1241 E1242 V1243 S1247	R1241-S1245 PolarHBondContact NH1-O 2.85Å; R1241-S1245 VanDerWaalsContact NH1-O 3.15Å; E1242-S1245 WeakPolarHBondContact O-CB 3.25Å; E1242-S1245 PolarHBondContact O-N 2.81Å; E1242-S1245 VanDerWaalsContact O-N 3.14Å; V1243-S1245 PolarHBondContact O-N 2.88Å; S1245-S1247 WeakPolarHBondContact CB-OG 3.06Å; S1245-S1247 VanDerWaalsContact OG-CB 3.27Å; S1245-S1247 WeakPolarHBondContact OG-CB 3.44Å; S1245-S1247 PolarHBondContact OG-N 2.88Å; S1245-S1247 VanDerWaalsContact OG-N 3.08Å; S1245-S1247 PolarHBondContact OG-OG 2.83Å
1246	I	78.4	Confident	87.6	Confident	175 Å²	175	64.7 Å²	64.7	90%	0.897	35%	0.353	S	S	*	.			trans	-80.4	-4.8	171.1	-41	175.9	0	0	0	110.8
1247	S	68.6	Low	86.6	Confident	58 Å²	58	67.9 Å²	67.9	41%	0.406	37%	0.37	S	S	.	.	S	Bend	trans	-58.8	140.6	176.7	60.9	0	0	0	0	112.1	S1245	S1245-S1247 WeakPolarHBondContact CB-OG 3.06Å; S1245-S1247 VanDerWaalsContact OG-CB 3.27Å; S1245-S1247 WeakPolarHBondContact OG-CB 3.44Å; S1245-S1247 PolarHBondContact OG-N 2.88Å; S1245-S1247 VanDerWaalsContact OG-N 3.08Å; S1245-S1247 PolarHBondContact OG-OG 2.83Å
1248	L	83.1	Confident	85.4	Confident	160 Å²	160	70.6 Å²	70.6	84%	0.838	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-52	150.6	166.5	-62.5	173.4	0	0	0	110.8	K1250	L1248-K1250 PolarHBondContact O-N 3.09Å
1249	Y	91.3	Very high	83.6	Confident	63 Å²	63	76.2 Å²	76.2	25%	0.247	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-57.2	137.2	168.6	-75.3	-84	0	0	0	110.1	R1239 R1241 Y1251 I1277	R1239-Y1249 HydrophobicContact CB-CD1 4.14Å; R1239-Y1249 HydrophobicContact CB-CG 4.44Å; R1239-Y1249 HydrophobicContact CG-CD1 3.99Å; R1239-Y1249 HydrophobicContact CG-CE1 4.36Å; R1239-Y1249 HydrophobicContact CG-CG 4.49Å; R1241-Y1249 HydrophobicContact CB-CD1 3.94Å; R1241-Y1249 HydrophobicContact CB-CE1 4.18Å; R1241-Y1249 HydrophobicContact CB-CG 4.46Å; R1241-Y1249 HydrophobicContact CG-CD1 3.87Å; R1241-Y1249 HydrophobicContact CG-CE1 3.58Å; R1241-Y1249 VanDerWaalsContact NE-CZ 3.33Å; R1241-Y1249 PolarHBondContact NE-OH 2.8Å; R1241-Y1249 VanDerWaalsContact NE-OH 3.14Å; Y1249-Y1251 VanDerWaalsContact O-CD2 3.31Å; Y1249-Y1251 WeakPolarHBondContact O-CD2 3.23Å; Y1249-Y1251 WeakPolarHBondContact O-CE2 3.4Å; Y1249-I1277 HydrophobicContact CE1-CG2 4.29Å
1250	K	89	Confident	82.2	Confident	125 Å²	125	77.4 Å²	77.4	54%	0.543	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	148.5	158.9	-65.4	-176.6	177.8	-174.3	0	108.2	R1239 W1240 L1248	R1239-K1250 CarbonylContact C-O 3.5Å; R1239-K1250 WeakPolarHBondContact CA-O 3.32Å; W1240-K1250 HydrophobicContact CD2-CB 3.87Å; W1240-K1250 HydrophobicContact CE3-CB 4.26Å; W1240-K1250 HydrophobicContact CG-CB 4.43Å; W1240-K1250 HydrophobicContact CH2-CB 4.02Å; W1240-K1250 HydrophobicContact CZ2-CB 3.63Å; W1240-K1250 HydrophobicContact CZ2-CD 4.03Å; W1240-K1250 HydrophobicContact CZ2-CG 4.49Å; W1240-K1250 HydrophobicContact CZ3-CB 4.32Å; W1240-K1250 PolarHBondContact N-O 2.79Å; W1240-K1250 PolarHBondContact O-N 2.86Å; L1248-K1250 PolarHBondContact O-N 3.09Å
1251	Y	92.4	Very high	81	Confident	118 Å²	118	76.9 Å²	76.9	46%	0.463	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	153.9	-178.3	-60.7	-91.4	0	0	0	110	Q1237 V1238 R1239 Y1249	Q1237-Y1251 HydrophobicContact CG-CD1 3.98Å; V1238-Y1251 CarbonylContact O-C 2.84Å; V1238-Y1251 WeakPolarHBondContact O-CA 3.39Å; R1239-Y1251 HydrophobicContact CB-CD1 3.55Å; R1239-Y1251 HydrophobicContact CB-CE1 3.61Å; R1239-Y1251 HydrophobicContact CB-CG 4.4Å; R1239-Y1251 HydrophobicContact CG-CE1 4.45Å; Y1249-Y1251 VanDerWaalsContact O-CD2 3.31Å; Y1249-Y1251 WeakPolarHBondContact O-CD2 3.23Å; Y1249-Y1251 WeakPolarHBondContact O-CE2 3.4Å
1252	A	89.7	Confident	80	Confident	15 Å²	15	74 Å²	74	12%	0.124	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	131	167.1	0	0	0	0	0	109.3	Q1237 V1238 W1240 Y1265	Q1237-A1252 WeakPolarHBondContact CA-O 3.45Å; V1238-A1252 PolarHBondContact N-O 3.13Å; V1238-A1252 PolarHBondContact O-N 3.1Å; W1240-A1252 HydrophobicContact CH2-CB 4Å; W1240-A1252 HydrophobicContact CZ3-CB 3.78Å; A1252-Y1265 HydrophobicContact CB-CE1 3.94Å; A1252-Y1265 HydrophobicContact CB-CE2 4.3Å; A1252-Y1265 WeakPolarHBondContact CB-OH 3.38Å
1253	D	89.7	Confident	79.6	Confident	111 Å²	111	72 Å²	72	59%	0.594	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.2	137	175.2	-64.8	-18.6	0	0	0	109.6	F1236 Q1237	F1236-D1253 CarbonylContact O-C 3.57Å; F1236-D1253 WeakPolarHBondContact O-CA 3.33Å; Q1237-D1253 WeakPolarHBondContact CB-OD1 3.13Å; Q1237-D1253 VanDerWaalsContact CG-OD1 3.3Å; Q1237-D1253 WeakPolarHBondContact CG-OD1 3.48Å; Q1237-D1253 PolarHBondContact NE2-OD1 2.84Å
1254	V	89.8	Confident	79.5	Confident	17 Å²	17	72.9 Å²	72.9	10%	0.103	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	122.8	-174.3	-174.4	0	0	0	0	108.3	W1224 F1236 V1238 V1263 Y1265	W1224-V1254 HydrophobicContact CH2-CB 4.27Å; W1224-V1254 HydrophobicContact CH2-CG1 4.13Å; W1224-V1254 HydrophobicContact CH2-CG2 4.21Å; W1224-V1254 HydrophobicContact CZ2-CB 4.25Å; W1224-V1254 HydrophobicContact CZ2-CG1 4.15Å; F1236-V1254 HydrophobicContact CB-CB 4.39Å; F1236-V1254 PolarHBondContact N-O 2.8Å; F1236-V1254 PolarHBondContact O-N 2.96Å; V1238-V1254 HydrophobicContact CG2-CG2 3.95Å; V1254-V1263 HydrophobicContact CG1-CG1 3.64Å; V1254-Y1265 HydrophobicContact CG2-CD2 3.55Å; V1254-Y1265 HydrophobicContact CG2-CE2 4.02Å; V1254-Y1265 HydrophobicContact CG2-CG 3.89Å
1255	A	84.6	Confident	80	Confident	73 Å²	73	72.5 Å²	72.5	60%	0.603	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63	148.5	178	0	0	0	0	0	111.4
1256	S	83.3	Confident	80.7	Confident	30 Å²	30	74.8 Å²	74.8	21%	0.21	39%	0.387	C	S	.	.			trans	-65.8	162.4	164	59.4	0	0	0	0	111.1	Q1234	Q1234-S1256 WeakPolarHBondContact O-CB 3.49Å; Q1234-S1256 PolarHBondContact O-OG 2.82Å
1257	N	73.8	Confident	81.2	Confident	67 Å²	67	66.5 Å²	66.5	36%	0.358	34%	0.344	S	S	.	.			trans	-125.3	107.4	173	-163.7	-37.1	0	0	0	109.3	Q1226 N1259 R1260	Q1226-N1257 PolarHBondContact NE2-O 2.9Å; N1257-N1259 PolarHBondContact O-N 2.75Å; N1257-N1259 PolarHBondContact OD1-N 2.78Å; N1257-R1260 HydrophobicContact CB-CB 3.93Å; N1257-R1260 PolarHBondContact O-N 2.72Å
1258	D	67.5	Low	82.2	Confident	102 Å²	102	68 Å²	68	55%	0.545	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-19.5	-173.7	-74.8	-45.4	0	0	0	114	R1097 R1260	R1097-D1258 IonicContact CZ-OD1 2.94Å; R1097-D1258 IonicContact NH1-OD1 2.62Å; R1097-D1258 PolarHBondContact NH1-OD1 2.89Å; R1097-D1258 IonicContact NH2-OD1 3.44Å; R1097-D1258 PolarHBondContact NH2-OD1 3.11Å; D1258-R1260 VanDerWaalsContact C-N 3.33Å
1259	N	57.2	Low	82.2	Confident	118 Å²	118	63.4 Å²	63.4	63%	0.631	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	5.5	178.5	-56.8	-13.3	0	0	0	112.7	N1257	N1257-N1259 PolarHBondContact O-N 2.75Å; N1257-N1259 PolarHBondContact OD1-N 2.78Å
1260	R	62.9	Low	82.2	Confident	81 Å²	81	61 Å²	61	31%	0.306	33%	0.334	S	S	.	.			trans	-153.9	115.2	-162.6	-94.7	-175.1	-179.1	-144.3	8.5	112.5	W1010 Q1226 N1257 D1258 G1262	W1010-R1260 HydrophobicContact CE3-CG 4.42Å; W1010-R1260 HydrophobicContact CH2-CB 3.89Å; W1010-R1260 HydrophobicContact CH2-CG 3.87Å; W1010-R1260 HydrophobicContact CZ3-CB 3.48Å; W1010-R1260 VanDerWaalsContact CZ3-CB 3.48Å; W1010-R1260 HydrophobicContact CZ3-CG 3.48Å; W1010-R1260 VanDerWaalsContact CZ3-CG 3.48Å; Q1226-R1260 PolarHBondContact NE2-O 2.73Å; N1257-R1260 HydrophobicContact CB-CB 3.93Å; N1257-R1260 PolarHBondContact O-N 2.72Å; D1258-R1260 VanDerWaalsContact C-N 3.33Å; R1260-G1262 VanDerWaalsContact C-N 3.26Å; R1260-G1262 PolarHBondContact O-N 2.82Å
1261	N	69.9	Low	82	Confident	13 Å²	13	60 Å²	60	7%	0.07	33%	0.33	C	S	.	.	S	Bend	trans	-67.2	-22.8	-179.8	-62.5	-41.7	0	0	0	114.3	T1011 E1013 L1095 T1225 Q1226	T1011-N1261 PolarHBondContact OG1-ND2 3.44Å; E1013-N1261 PolarHBondContact OE2-ND2 3Å; L1095-N1261 HydrophobicContact CD1-CB 4.47Å; L1095-N1261 VanDerWaalsContact CD1-ND2 3.29Å; L1095-N1261 WeakPolarHBondContact CD1-ND2 3.49Å; T1225-N1261 CarbonylContact C-O 3.38Å; T1225-N1261 WeakPolarHBondContact CA-O 3.19Å; T1225-N1261 WeakPolarHBondContact CG2-O 3.19Å; Q1226-N1261 PolarHBondContact N-O 2.76Å
1262	G	73.3	Confident	81.8	Confident	8 Å²	8	57.1 Å²	57.1	8%	0.082	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	158.1	171.4	0	0	0	0	0	113.3	W1010 W1224 R1260	W1010-G1262 WeakPolarHBondContact CH2-O 3.34Å; W1010-G1262 VanDerWaalsContact CZ3-CA 3.44Å; W1010-G1262 WeakPolarHBondContact CZ3-O 3.31Å; W1224-G1262 CarbonylContact O-C 3.55Å; W1224-G1262 VanDerWaalsContact O-CA 3.25Å; W1224-G1262 WeakPolarHBondContact O-CA 3.41Å; R1260-G1262 VanDerWaalsContact C-N 3.26Å; R1260-G1262 PolarHBondContact O-N 2.82Å
1263	V	81.7	Confident	81.6	Confident	10 Å²	10	57.8 Å²	57.8	6%	0.061	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	143.7	167.7	-179.7	0	0	0	0	108.2	A1223 W1224 Q1226 F1236 V1254	A1223-V1263 CarbonylContact C-O 3.47Å; A1223-V1263 WeakPolarHBondContact CA-O 3.1Å; W1224-V1263 HydrophobicContact CD2-CB 4.3Å; W1224-V1263 HydrophobicContact CH2-CG1 3.94Å; W1224-V1263 HydrophobicContact CZ2-CB 3.87Å; W1224-V1263 HydrophobicContact CZ2-CG1 3.4Å; W1224-V1263 VanDerWaalsContact CZ2-CG1 3.4Å; W1224-V1263 PolarHBondContact N-O 2.71Å; W1224-V1263 PolarHBondContact O-N 3.33Å; Q1226-V1263 HydrophobicContact CG-CG2 3.68Å; F1236-V1263 HydrophobicContact CD2-CG2 4.33Å; F1236-V1263 HydrophobicContact CE2-CG2 3.92Å; V1254-V1263 HydrophobicContact CG1-CG1 3.64Å
1264	E	85.7	Confident	81.6	Confident	76 Å²	76	53.7 Å²	53.7	36%	0.355	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	142.5	-172.9	-60.7	178.8	162.7	0	0	109.3	W1010 L1213 V1222 A1223	W1010-E1264 HydrophobicContact CZ2-CG 4.03Å; W1010-E1264 WeakPolarHBondContact CZ2-OE1 3.1Å; W1010-E1264 PolarHBondContact NE1-OE1 2.95Å; L1213-E1264 HydrophobicContact CD1-CG 4.1Å; V1222-E1264 CarbonylContact O-C 3.4Å; V1222-E1264 WeakPolarHBondContact O-CA 3.37Å; A1223-E1264 HydrophobicContact CB-CG 3.9Å
1265	Y	90.5	Very high	81.8	Confident	65 Å²	65	55.4 Å²	55.4	26%	0.255	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	137.7	-179	-174.1	-105.5	0	0	0	112.5	H1221 V1222 V1238 A1252 V1254 I1267	H1221-Y1265 PolarHBondContact CD2-O 3.05Å; V1222-Y1265 WeakPolarHBondContact CG2-O 3.37Å; V1222-Y1265 PolarHBondContact N-O 3.34Å; V1222-Y1265 PolarHBondContact O-N 2.86Å; V1238-Y1265 HydrophobicContact CB-CD1 4.42Å; V1238-Y1265 HydrophobicContact CG1-CD1 4.37Å; V1238-Y1265 HydrophobicContact CG2-CD1 4.3Å; A1252-Y1265 HydrophobicContact CB-CE1 3.94Å; A1252-Y1265 HydrophobicContact CB-CE2 4.3Å; A1252-Y1265 WeakPolarHBondContact CB-OH 3.38Å; V1254-Y1265 HydrophobicContact CG2-CD2 3.55Å; V1254-Y1265 HydrophobicContact CG2-CE2 4.02Å; V1254-Y1265 HydrophobicContact CG2-CG 3.89Å; Y1265-I1267 HydrophobicContact CD1-CG1 3.88Å; Y1265-I1267 HydrophobicContact CE1-CG1 3.9Å
1266	I	91.3	Very high	82.2	Confident	85 Å²	85	52.5 Å²	52.5	44%	0.436	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	110.3	179.8	-54.7	174.2	0	0	0	109.6	H1221 T1268	H1221-I1266 HydrophobicContact CB-CG1 4.27Å; I1266-T1268 HydrophobicContact CG2-CG2 3.87Å
1267	I	90.5	Very high	82.6	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	123.9	170.9	-52.9	174.3	0	0	0	108	T1219 L1220 V1222 V1238 W1240 Y1265 L1270 V1278	T1219-I1267 CarbonylContact C-O 3.58Å; T1219-I1267 WeakPolarHBondContact CA-O 3.42Å; T1219-I1267 WeakPolarHBondContact CB-O 3.37Å; L1220-I1267 HydrophobicContact CB-CB 4.44Å; L1220-I1267 PolarHBondContact N-O 3.03Å; L1220-I1267 PolarHBondContact O-N 3.42Å; V1222-I1267 HydrophobicContact CG2-CD1 4.42Å; V1238-I1267 HydrophobicContact CG1-CD1 4.28Å; W1240-I1267 HydrophobicContact CB-CD1 4.32Å; W1240-I1267 HydrophobicContact CD2-CD1 4.33Å; W1240-I1267 HydrophobicContact CD2-CG2 3.82Å; W1240-I1267 VanDerWaalsContact CE2-CG2 3.49Å; W1240-I1267 HydrophobicContact CE3-CD1 4.43Å; W1240-I1267 HydrophobicContact CE3-CG2 4.49Å; W1240-I1267 HydrophobicContact CG-CD1 4.29Å; W1240-I1267 HydrophobicContact CG-CG2 4.02Å; W1240-I1267 HydrophobicContact CZ2-CG2 3.97Å; Y1265-I1267 HydrophobicContact CD1-CG1 3.88Å; Y1265-I1267 HydrophobicContact CE1-CG1 3.9Å; I1267-L1270 HydrophobicContact CB-CD1 4.41Å; I1267-L1270 HydrophobicContact CG2-CD1 3.98Å; I1267-L1270 HydrophobicContact CG2-CD2 3.89Å; I1267-L1270 HydrophobicContact CG2-CG 4.16Å; I1267-V1278 HydrophobicContact CD1-CG1 3.62Å; I1267-V1278 HydrophobicContact CD1-CG2 4.06Å
1268	T	88.3	Confident	83.6	Confident	90 Å²	90	48.6 Å²	48.6	55%	0.552	27%	0.271	S	S	*	.			trans	-118.7	168.9	-177	61.2	0	0	0	0	112.3	T1219 I1266	T1219-T1268 HydrophobicContact CG2-CG2 3.96Å; I1266-T1268 HydrophobicContact CG2-CG2 3.87Å
1269	G	84	Confident	84.9	Confident	64 Å²	64	43.8 Å²	43.8	66%	0.66	25%	0.245	S	C	*	.	S	Bend	trans	70.9	34.4	176	0	0	0	0	0	113.8	S1218	S1218-G1269 PolarHBondContact O-N 3.46Å; S1218-G1269 VanDerWaalsContact O-N 3.14Å
1270	L	90.6	Very high	86.7	Confident	11 Å²	11	38.1 Å²	38.1	6%	0.058	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-92.4	156.7	177.3	-55.7	177	0	0	0	110.9	S1218 L1220 I1267 Y1276 T1300	S1218-L1270 WeakPolarHBondContact CA-O 3.41Å; S1218-L1270 WeakPolarHBondContact O-CB 3.48Å; S1218-L1270 PolarHBondContact O-N 2.94Å; L1220-L1270 HydrophobicContact CB-CD1 4.01Å; L1220-L1270 HydrophobicContact CD1-CD1 3.64Å; L1220-L1270 HydrophobicContact CG-CD1 3.54Å; I1267-L1270 HydrophobicContact CB-CD1 4.41Å; I1267-L1270 HydrophobicContact CG2-CD1 3.98Å; I1267-L1270 HydrophobicContact CG2-CD2 3.89Å; I1267-L1270 HydrophobicContact CG2-CG 4.16Å; L1270-Y1276 HydrophobicContact CB-CE2 3.83Å; L1270-Y1276 HydrophobicContact CD1-CD2 4.32Å; L1270-Y1276 HydrophobicContact CD1-CE2 4.37Å; L1270-Y1276 HydrophobicContact CD2-CD1 4.1Å; L1270-Y1276 HydrophobicContact CD2-CD2 4.38Å; L1270-Y1276 HydrophobicContact CD2-CE1 3.79Å; L1270-Y1276 HydrophobicContact CD2-CE2 4.07Å; L1270-Y1276 HydrophobicContact CD2-CG 4.4Å; L1270-Y1276 HydrophobicContact CG-CE2 4.31Å; L1270-T1300 HydrophobicContact CB-CG2 3.77Å; L1270-T1300 HydrophobicContact CD1-CG2 3.96Å
1271	K	86.1	Confident	88.3	Confident	106 Å²	106	34.6 Å²	34.6	46%	0.461	20%	0.202	S	C	.	.	P	Polyproline II helix	trans	-76.2	142.9	174.9	-69.7	166.5	171.3	164.9	0	110.5	E1242 S1274 Y1276 T1300	E1242-K1271 WeakPolarHBondContact OE1-CD 3.48Å; E1242-K1271 IonicContact OE1-NZ 3.82Å; E1242-K1271 PolarHBondContact OE1-NZ 3.3Å; E1242-K1271 WeakPolarHBondContact OE2-CE 3.25Å; E1242-K1271 IonicContact OE2-NZ 2.8Å; E1242-K1271 PolarHBondContact OE2-NZ 3.07Å; K1271-S1274 VanDerWaalsContact CB-OG 3.23Å; K1271-S1274 WeakPolarHBondContact CB-OG 3.41Å; K1271-S1274 WeakPolarHBondContact O-CB 3.43Å; K1271-Y1276 PolarHBondContact N-OH 2.95Å; K1271-T1300 WeakPolarHBondContact O-CB 3.49Å; K1271-T1300 PolarHBondContact O-OG1 2.68Å
1272	P	87.8	Confident	89.4	Confident	57 Å²	57	34 Å²	34	37%	0.37	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	150.4	169.9	-23.1	32.5	0	0	0	113.5	S1217 S1274 L1301 L1303	S1217-P1272 WeakPolarHBondContact O-CA 3.46Å; S1217-P1272 WeakPolarHBondContact O-CG 3.24Å; P1272-S1274 PolarHBondContact O-N 3.31Å; P1272-S1274 PolarHBondContact O-OG 3.41Å; P1272-L1301 WeakPolarHBondContact CA-O 3.25Å; P1272-L1303 HydrophobicContact CB-CB 4.18Å; P1272-L1303 HydrophobicContact CB-CD1 4.26Å; P1272-L1303 HydrophobicContact CG-CD1 3.99Å
1273	G	85.5	Confident	90.3	Very high	28 Å²	28	36.4 Å²	36.4	29%	0.289	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	4	177.5	0	0	0	0	0	116.2	T1300 L1301	G1273-T1300 WeakPolarHBondContact CA-O 3.49Å; G1273-T1300 PolarHBondContact N-OG1 2.97Å; G1273-T1300 VanDerWaalsContact N-OG1 3.16Å; G1273-L1301 PolarHBondContact N-O 2.79Å
1274	S	89.9	Confident	90.7	Very high	26 Å²	26	36.2 Å²	36.2	18%	0.182	21%	0.207	C	C	.	.			trans	-99.3	147	-164.4	-60.6	0	0	0	0	111.7	K1271 P1272 Y1276 R1299 T1300	K1271-S1274 VanDerWaalsContact CB-OG 3.23Å; K1271-S1274 WeakPolarHBondContact CB-OG 3.41Å; K1271-S1274 WeakPolarHBondContact O-CB 3.43Å; P1272-S1274 PolarHBondContact O-N 3.31Å; P1272-S1274 PolarHBondContact O-OG 3.41Å; S1274-Y1276 WeakPolarHBondContact O-CD2 3.4Å; S1274-R1299 WeakPolarHBondContact O-CA 3.39Å; S1274-R1299 WeakPolarHBondContact O-CG 3.4Å; S1274-T1300 PolarHBondContact N-OG1 2.9Å; S1274-T1300 PolarHBondContact O-N 2.66Å; S1274-T1300 PolarHBondContact O-OG1 3.29Å
1275	E	92.7	Very high	90.8	Very high	52 Å²	52	38.1 Å²	38.1	24%	0.243	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	137.4	-175.4	-162.5	177.9	122.6	0	0	111.8	V1243 H1297 L1298 R1299	V1243-E1275 HydrophobicContact CB-CB 4.22Å; V1243-E1275 HydrophobicContact CG2-CB 4.02Å; V1243-E1275 HydrophobicContact CG2-CG 3.84Å; V1243-E1275 PolarHBondContact N-O 2.92Å; E1275-H1297 IonicContact OE1-CE1 2.94Å; E1275-H1297 IonicContact OE1-CG 3.69Å; E1275-H1297 IonicContact OE1-ND1 2.7Å; E1275-H1297 PolarHBondContact OE1-ND1 3.01Å; E1275-L1298 WeakPolarHBondContact CA-O 3.05Å; E1275-R1299 HydrophobicContact CB-CG 4.4Å; E1275-R1299 HydrophobicContact CG-CB 4.49Å; E1275-R1299 IonicContact OE2-CZ 2.74Å; E1275-R1299 IonicContact OE2-NE 2.85Å; E1275-R1299 PolarHBondContact OE2-NE 2.83Å; E1275-R1299 IonicContact OE2-NH2 3.54Å; E1275-R1299 PolarHBondContact OE2-NH2 2.87Å
1276	Y	93	Very high	90.6	Very high	13 Å²	13	40.3 Å²	40.3	5%	0.051	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	137.1	-174.9	-68.3	-85.9	0	0	0	110.8	L1220 R1241 E1242 L1270 K1271 S1274 H1297 L1298 T1300	L1220-Y1276 HydrophobicContact CD1-CD2 4.4Å; R1241-Y1276 CarbonylContact O-C 3.54Å; R1241-Y1276 VanDerWaalsContact O-CA 3.29Å; R1241-Y1276 WeakPolarHBondContact O-CA 3.03Å; E1242-Y1276 HydrophobicContact CB-CD1 4.08Å; E1242-Y1276 HydrophobicContact CB-CE1 3.71Å; E1242-Y1276 HydrophobicContact CG-CE1 4.14Å; L1270-Y1276 HydrophobicContact CB-CE2 3.83Å; L1270-Y1276 HydrophobicContact CD1-CD2 4.32Å; L1270-Y1276 HydrophobicContact CD1-CE2 4.37Å; L1270-Y1276 HydrophobicContact CD2-CD1 4.1Å; L1270-Y1276 HydrophobicContact CD2-CD2 4.38Å; L1270-Y1276 HydrophobicContact CD2-CE1 3.79Å; L1270-Y1276 HydrophobicContact CD2-CE2 4.07Å; L1270-Y1276 HydrophobicContact CD2-CG 4.4Å; L1270-Y1276 HydrophobicContact CG-CE2 4.31Å; K1271-Y1276 PolarHBondContact N-OH 2.95Å; S1274-Y1276 WeakPolarHBondContact O-CD2 3.4Å; Y1276-H1297 WeakPolarHBondContact O-CA 3.38Å; Y1276-L1298 PolarHBondContact N-O 2.81Å; Y1276-L1298 PolarHBondContact O-N 2.89Å; Y1276-T1300 HydrophobicContact CE2-CG2 4.28Å
1277	I	93.1	Very high	90.5	Very high	15 Å²	15	39.8 Å²	39.8	8%	0.077	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	125.1	166.5	-74.1	157	0	0	0	107.7	W1240 R1241 V1243 Y1249 P1295	W1240-I1277 WeakPolarHBondContact CA-O 3.46Å; R1241-I1277 HydrophobicContact CG-CB 4.47Å; R1241-I1277 PolarHBondContact N-O 3.11Å; R1241-I1277 PolarHBondContact O-N 2.83Å; V1243-I1277 HydrophobicContact CG2-CD1 4.06Å; V1243-I1277 HydrophobicContact CG2-CG1 3.9Å; Y1249-I1277 HydrophobicContact CE1-CG2 4.29Å; I1277-P1295 HydrophobicContact CG2-CB 3.71Å
1278	V	94.5	Very high	90.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	141	178.7	-166.1	0	0	0	0	110.4	F1210 V1238 R1239 W1240 I1267 P1295 I1296 L1298	F1210-V1278 HydrophobicContact CE1-CB 4.47Å; F1210-V1278 HydrophobicContact CE1-CG1 4.4Å; F1210-V1278 HydrophobicContact CZ-CB 4.25Å; F1210-V1278 HydrophobicContact CZ-CG1 3.77Å; V1238-V1278 HydrophobicContact CG1-CG1 3.97Å; R1239-V1278 WeakPolarHBondContact O-CA 2.99Å; W1240-V1278 HydrophobicContact CB-CB 4.46Å; W1240-V1278 HydrophobicContact CB-CG1 4.29Å; W1240-V1278 HydrophobicContact CB-CG2 3.92Å; I1267-V1278 HydrophobicContact CD1-CG1 3.62Å; I1267-V1278 HydrophobicContact CD1-CG2 4.06Å; V1278-P1295 WeakPolarHBondContact O-CA 3.33Å; V1278-I1296 PolarHBondContact N-O 2.95Å; V1278-I1296 PolarHBondContact O-N 3.15Å; V1278-L1298 HydrophobicContact CB-CD1 4.14Å; V1278-L1298 HydrophobicContact CG2-CD1 3.86Å
1279	S	94.8	Very high	90.4	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	161.5	173.1	44.1	0	0	0	0	110.7	R1239 T1293	R1239-S1279 WeakPolarHBondContact CG-OG 3.31Å; R1239-S1279 PolarHBondContact N-O 3.36Å; R1239-S1279 PolarHBondContact NE-OG 3.43Å; R1239-S1279 PolarHBondContact O-N 2.94Å; S1279-T1293 WeakPolarHBondContact CB-O 3.31Å
1280	V	95.3	Very high	90.9	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	148.2	-178.8	61	0	0	0	0	110.9	P1207 F1210 W1224 F1236 Q1237 V1238 Y1292 T1293	P1207-V1280 HydrophobicContact CB-CG1 4.04Å; P1207-V1280 HydrophobicContact CG-CG1 4.14Å; P1207-V1280 HydrophobicContact CG-CG2 4.41Å; F1210-V1280 HydrophobicContact CB-CG1 4.48Å; F1210-V1280 HydrophobicContact CD2-CG1 3.75Å; F1210-V1280 HydrophobicContact CE2-CG1 4.09Å; F1210-V1280 HydrophobicContact CG-CG1 4.02Å; W1224-V1280 HydrophobicContact CD2-CG1 4.16Å; W1224-V1280 HydrophobicContact CD2-CG2 4.21Å; W1224-V1280 HydrophobicContact CE3-CG1 4.34Å; W1224-V1280 HydrophobicContact CE3-CG2 4.47Å; W1224-V1280 HydrophobicContact CG-CG1 4.27Å; W1224-V1280 HydrophobicContact CH2-CG2 4.25Å; W1224-V1280 HydrophobicContact CZ2-CG2 3.94Å; F1236-V1280 HydrophobicContact CB-CG2 4.02Å; Q1237-V1280 WeakPolarHBondContact O-CA 3.03Å; V1238-V1280 HydrophobicContact CG2-CB 4.26Å; V1238-V1280 HydrophobicContact CG2-CG2 3.88Å; V1280-Y1292 CarbonylContact O-C 3.58Å; V1280-Y1292 WeakPolarHBondContact O-CA 3.07Å; V1280-T1293 HydrophobicContact CG1-CG2 3.72Å; V1280-T1293 PolarHBondContact N-OG1 3.4Å; V1280-T1293 VanDerWaalsContact N-OG1 3.12Å; V1280-T1293 WeakPolarHBondContact O-CG2 3.39Å; V1280-T1293 PolarHBondContact O-N 3.43Å; V1280-T1293 PolarHBondContact O-OG1 3.27Å
1281	N	95.4	Very high	91	Very high	6 Å²	6	39.8 Å²	39.8	3%	0.032	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	173.4	166.7	71.6	-12.9	0	0	0	110.5	F1236 Q1237 S1290 A1291 Y1292	F1236-N1281 WeakPolarHBondContact CA-O 3.4Å; F1236-N1281 WeakPolarHBondContact CB-O 3.2Å; F1236-N1281 WeakPolarHBondContact CD1-O 3.32Å; Q1237-N1281 WeakPolarHBondContact CB-OD1 3.39Å; Q1237-N1281 PolarHBondContact N-O 3.49Å; Q1237-N1281 VanDerWaalsContact N-O 3.1Å; Q1237-N1281 PolarHBondContact N-OD1 2.91Å; Q1237-N1281 PolarHBondContact O-N 3.27Å; Q1237-N1281 VanDerWaalsContact O-N 3.13Å; Q1237-N1281 PolarHBondContact O-OD1 3.26Å; N1281-S1290 PolarHBondContact ND2-O 3.44Å; N1281-A1291 WeakPolarHBondContact CB-O 3.23Å; N1281-Y1292 HydrophobicContact CB-CD1 3.83Å; N1281-Y1292 HydrophobicContact CB-CD2 4.12Å; N1281-Y1292 HydrophobicContact CB-CE1 4.04Å; N1281-Y1292 HydrophobicContact CB-CE2 4.33Å; N1281-Y1292 HydrophobicContact CB-CG 3.87Å
1282	S	93.7	Very high	91.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	157	170.9	51.5	0	0	0	0	109.9	D1205 T1235 A1289 S1290	D1205-S1282 PolarHBondContact O-OG 3.18Å; T1235-S1282 CarbonylContact O-C 3.47Å; T1235-S1282 VanDerWaalsContact O-CA 3.32Å; T1235-S1282 WeakPolarHBondContact O-CA 3.35Å; S1282-A1289 CarbonylContact O-C 3.57Å; S1282-A1289 VanDerWaalsContact O-CA 3.32Å; S1282-A1289 WeakPolarHBondContact O-CA 3.44Å; S1282-S1290 PolarHBondContact N-OG 3.22Å; S1282-S1290 PolarHBondContact O-N 3.07Å; S1282-S1290 PolarHBondContact O-OG 3.45Å; S1282-S1290 WeakPolarHBondContact OG-CB 2.94Å; S1282-S1290 PolarHBondContact OG-OG 2.85Å; S1282-S1290 VanDerWaalsContact OG-OG 3.06Å
1283	M	91.6	Very high	91.7	Very high	60 Å²	60	35.2 Å²	35.2	30%	0.296	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	151.6	175.6	65.6	-175.1	-69.4	0	0	112.5	Q1234 T1235 G1288 A1289	Q1234-M1283 CarbonylContact C-O 3.54Å; Q1234-M1283 WeakPolarHBondContact CA-O 3.44Å; T1235-M1283 PolarHBondContact N-O 3.18Å; T1235-M1283 PolarHBondContact O-N 2.82Å; T1235-M1283 WeakPolarHBondContact OG1-CG 2.98Å; M1283-G1288 CarbonylContact C-O 3.55Å; M1283-G1288 VanDerWaalsContact CA-O 3.26Å; M1283-G1288 WeakPolarHBondContact CA-O 3.45Å; M1283-A1289 HydrophobicContact CB-CB 3.71Å
1284	N	89.9	Confident	91.9	Very high	5 Å²	5	40.7 Å²	40.7	3%	0.027	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	161.4	169.8	74.7	35.9	0	0	0	112.1	S1202 P1204 D1229 L1232 A1233 K1286 H1287 G1288	S1202-N1284 PolarHBondContact O-ND2 2.95Å; P1204-N1284 HydrophobicContact CG-CB 3.94Å; D1229-N1284 PolarHBondContact O-ND2 2.81Å; L1232-N1284 HydrophobicContact CB-CB 4.16Å; A1233-N1284 WeakPolarHBondContact O-CB 3.2Å; N1284-K1286 PolarHBondContact O-N 3.41Å; N1284-K1286 VanDerWaalsContact O-N 3.09Å; N1284-K1286 PolarHBondContact OD1-N 2.99Å; N1284-H1287 PolarHBondContact OD1-N 2.82Å; N1284-G1288 PolarHBondContact N-O 2.84Å; N1284-G1288 PolarHBondContact O-N 2.96Å; N1284-G1288 VanDerWaalsContact O-N 3.12Å
1285	S	87.2	Confident	91.9	Very high	117 Å²	117	42.9 Å²	42.9	82%	0.818	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-11.2	-167.5	57	0	0	0	0	116.1
1286	K	87.1	Confident	91.8	Very high	110 Å²	110	42.9 Å²	42.9	48%	0.478	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	-35.7	-171.7	-171	-178.3	-179.4	-176	0	113.8	E1104 L1232 N1284	E1104-K1286 IonicContact OE1-NZ 2.7Å; E1104-K1286 PolarHBondContact OE1-NZ 2.89Å; L1232-K1286 HydrophobicContact CD1-CB 3.42Å; L1232-K1286 VanDerWaalsContact CD1-CB 3.42Å; L1232-K1286 HydrophobicContact CD1-CD 3.71Å; L1232-K1286 HydrophobicContact CD1-CG 4.22Å; N1284-K1286 PolarHBondContact O-N 3.41Å; N1284-K1286 VanDerWaalsContact O-N 3.09Å; N1284-K1286 PolarHBondContact OD1-N 2.99Å
1287	H	89.1	Confident	91.8	Very high	74 Å²	74	47.3 Å²	47.3	34%	0.343	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-8.6	-176.4	-59.8	-86.8	0	0	0	113.2	T1201 S1202 T1203 N1284	T1201-H1287 VanDerWaalsContact C-NE2 3.33Å; T1201-H1287 WeakPolarHBondContact CB-NE2 3.1Å; T1201-H1287 PolarHBondContact O-CE1 2.8Å; T1201-H1287 PolarHBondContact O-NE2 3.03Å; T1201-H1287 VanDerWaalsContact O-NE2 3.1Å; T1201-H1287 PolarHBondContact OG1-NE2 2.82Å; S1202-H1287 PolarHBondContact O-CD2 2.89Å; T1203-H1287 HydrophobicContact CG2-CB 3.76Å; T1203-H1287 WeakPolarHBondContact CG2-O 3.39Å; N1284-H1287 PolarHBondContact OD1-N 2.82Å
1288	G	88.3	Confident	91.6	Very high	29 Å²	29	47.1 Å²	47.1	30%	0.299	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	86.2	-149	178	0	0	0	0	0	113	M1283 N1284	M1283-G1288 CarbonylContact C-O 3.55Å; M1283-G1288 VanDerWaalsContact CA-O 3.26Å; M1283-G1288 WeakPolarHBondContact CA-O 3.45Å; N1284-G1288 PolarHBondContact N-O 2.84Å; N1284-G1288 PolarHBondContact O-N 2.96Å; N1284-G1288 VanDerWaalsContact O-N 3.12Å
1289	A	89.3	Confident	91.4	Very high	53 Å²	53	54.5 Å²	54.5	44%	0.438	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	149.7	-166.7	0	0	0	0	0	114.2	S1282 M1283	S1282-A1289 CarbonylContact O-C 3.57Å; S1282-A1289 VanDerWaalsContact O-CA 3.32Å; S1282-A1289 WeakPolarHBondContact O-CA 3.44Å; M1283-A1289 HydrophobicContact CB-CB 3.71Å
1290	S	93.8	Very high	91.2	Very high	15 Å²	15	54.8 Å²	54.8	11%	0.105	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-71.1	169.4	167.2	79.4	0	0	0	0	111.4	N1281 S1282	N1281-S1290 PolarHBondContact ND2-O 3.44Å; S1282-S1290 PolarHBondContact N-OG 3.22Å; S1282-S1290 PolarHBondContact O-N 3.07Å; S1282-S1290 PolarHBondContact O-OG 3.45Å; S1282-S1290 WeakPolarHBondContact OG-CB 2.94Å; S1282-S1290 PolarHBondContact OG-OG 2.85Å; S1282-S1290 VanDerWaalsContact OG-OG 3.06Å
1291	A	93.6	Very high	90.6	Very high	69 Å²	69	59.7 Å²	59.7	57%	0.57	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-58.7	154.8	157.9	0	0	0	0	0	110.7	V1206 N1281	V1206-A1291 HydrophobicContact CG2-CB 4.08Å; N1281-A1291 WeakPolarHBondContact CB-O 3.23Å
1292	Y	94	Very high	89.9	Confident	53 Å²	53	63.2 Å²	63.2	21%	0.208	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-73.8	152.4	170	-76.3	-95	0	0	0	110.9	Q1237 R1239 V1280 N1281	Q1237-Y1292 PolarHBondContact OE1-OH 3.33Å; R1239-Y1292 HydrophobicContact CB-CE1 4.18Å; R1239-Y1292 HydrophobicContact CG-CD1 3.98Å; R1239-Y1292 HydrophobicContact CG-CE1 3.58Å; R1239-Y1292 VanDerWaalsContact CZ-CG 3.42Å; V1280-Y1292 CarbonylContact O-C 3.58Å; V1280-Y1292 WeakPolarHBondContact O-CA 3.07Å; N1281-Y1292 HydrophobicContact CB-CD1 3.83Å; N1281-Y1292 HydrophobicContact CB-CD2 4.12Å; N1281-Y1292 HydrophobicContact CB-CE1 4.04Å; N1281-Y1292 HydrophobicContact CB-CE2 4.33Å; N1281-Y1292 HydrophobicContact CB-CG 3.87Å
1293	T	93.9	Very high	88.3	Confident	14 Å²	14	68 Å²	68	9%	0.086	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-55.6	158.6	164.3	60.8	0	0	0	0	111.2	V1206 P1207 F1210 S1279 V1280	V1206-T1293 HydrophobicContact CG1-CG2 4.19Å; P1207-T1293 HydrophobicContact CB-CG2 4.03Å; P1207-T1293 HydrophobicContact CG-CG2 4.49Å; P1207-T1293 WeakPolarHBondContact O-CG2 3.43Å; F1210-T1293 HydrophobicContact CB-CG2 4.19Å; S1279-T1293 WeakPolarHBondContact CB-O 3.31Å; V1280-T1293 HydrophobicContact CG1-CG2 3.72Å; V1280-T1293 PolarHBondContact N-OG1 3.4Å; V1280-T1293 VanDerWaalsContact N-OG1 3.12Å; V1280-T1293 WeakPolarHBondContact O-CG2 3.39Å; V1280-T1293 PolarHBondContact O-N 3.43Å; V1280-T1293 PolarHBondContact O-OG1 3.27Å
1294	D	90.2	Very high	86.4	Confident	143 Å²	143	72.5 Å²	72.5	77%	0.765	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-51.2	138	164.8	-66.7	-54.2	0	0	0	110.8	I1296	D1294-I1296 PolarHBondContact O-N 2.89Å
1295	P	89.2	Confident	83.9	Confident	73 Å²	73	79.7 Å²	79.7	47%	0.474	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-73.6	125.3	-176.9	26.8	-32.3	0	0	0	111.7	I1277 V1278	I1277-P1295 HydrophobicContact CG2-CB 3.71Å; V1278-P1295 WeakPolarHBondContact O-CA 3.33Å
1296	I	90.6	Very high	81.4	Confident	51 Å²	51	83.9 Å²	83.9	26%	0.262	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	131.8	173.5	-52.7	-176.2	0	0	0	109.4	F1210 V1278 D1294 L1298	F1210-I1296 HydrophobicContact CB-CD1 4.42Å; F1210-I1296 HydrophobicContact CD1-CD1 3.36Å; F1210-I1296 HydrophobicContact CD1-CG1 3.75Å; F1210-I1296 HydrophobicContact CE1-CB 4.25Å; F1210-I1296 HydrophobicContact CE1-CD1 3.81Å; F1210-I1296 HydrophobicContact CE1-CG1 3.93Å; F1210-I1296 HydrophobicContact CG-CD1 4.09Å; F1210-I1296 VanDerWaalsContact O-CD1 3.25Å; F1210-I1296 WeakPolarHBondContact O-CD1 3.32Å; V1278-I1296 PolarHBondContact N-O 2.95Å; V1278-I1296 PolarHBondContact O-N 3.15Å; D1294-I1296 PolarHBondContact O-N 2.89Å; I1296-L1298 HydrophobicContact CB-CG 4.4Å; I1296-L1298 HydrophobicContact CG2-CD2 3.57Å; I1296-L1298 HydrophobicContact CG2-CG 3.88Å
1297	H	92.4	Very high	78.9	Confident	106 Å²	106	85.4 Å²	85.4	49%	0.491	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	120.3	170	-78	-121	0	0	0	109.7	E1275 Y1276	E1275-H1297 IonicContact OE1-CE1 2.94Å; E1275-H1297 IonicContact OE1-CG 3.69Å; E1275-H1297 IonicContact OE1-ND1 2.7Å; E1275-H1297 PolarHBondContact OE1-ND1 3.01Å; Y1276-H1297 WeakPolarHBondContact O-CA 3.38Å
1298	L	90.3	Very high	76.3	Confident	12 Å²	12	85.3 Å²	85.3	6%	0.063	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	133.3	-174	-62.6	176.9	0	0	0	109.9	L1212 L1220 V1222 E1275 Y1276 V1278 I1296	L1212-L1298 HydrophobicContact CB-CD2 3.87Å; L1212-L1298 HydrophobicContact CD1-CD1 4.07Å; L1212-L1298 HydrophobicContact CD1-CD2 4.13Å; L1212-L1298 HydrophobicContact CD2-CD2 4.28Å; L1212-L1298 HydrophobicContact CG-CD2 4.32Å; L1220-L1298 HydrophobicContact CD1-CB 3.65Å; L1220-L1298 HydrophobicContact CD1-CD1 4.33Å; L1220-L1298 HydrophobicContact CD2-CB 4.22Å; V1222-L1298 HydrophobicContact CG1-CD1 3.68Å; E1275-L1298 WeakPolarHBondContact CA-O 3.05Å; Y1276-L1298 PolarHBondContact N-O 2.81Å; Y1276-L1298 PolarHBondContact O-N 2.89Å; V1278-L1298 HydrophobicContact CB-CD1 4.14Å; V1278-L1298 HydrophobicContact CG2-CD1 3.86Å; I1296-L1298 HydrophobicContact CB-CG 4.4Å; I1296-L1298 HydrophobicContact CG2-CD2 3.57Å; I1296-L1298 HydrophobicContact CG2-CG 3.88Å
1299	R	90.8	Very high	73.7	Confident	155 Å²	155	95.2 Å²	95.2	59%	0.585	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.5	133.2	-178	-163	178.7	-69.7	-174.1	-1.9	111.1	S1274 E1275	S1274-R1299 WeakPolarHBondContact O-CA 3.39Å; S1274-R1299 WeakPolarHBondContact O-CG 3.4Å; E1275-R1299 HydrophobicContact CB-CG 4.4Å; E1275-R1299 HydrophobicContact CG-CB 4.49Å; E1275-R1299 IonicContact OE2-CZ 2.74Å; E1275-R1299 IonicContact OE2-NE 2.85Å; E1275-R1299 PolarHBondContact OE2-NE 2.83Å; E1275-R1299 IonicContact OE2-NH2 3.54Å; E1275-R1299 PolarHBondContact OE2-NH2 2.87Å
1300	T	89.3	Confident	70.8	Confident	5 Å²	5	100.8 Å²	100.8	3%	0.031	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-71.9	156.2	169.6	51.4	0	0	0	0	110.8	T1216 L1220 L1270 K1271 G1273 S1274 Y1276	T1216-T1300 WeakPolarHBondContact O-CA 3.4Å; T1216-T1300 WeakPolarHBondContact O-CB 3.37Å; L1220-T1300 HydrophobicContact CD2-CG2 4.39Å; L1220-T1300 HydrophobicContact CG-CG2 4.29Å; L1270-T1300 HydrophobicContact CB-CG2 3.77Å; L1270-T1300 HydrophobicContact CD1-CG2 3.96Å; K1271-T1300 WeakPolarHBondContact O-CB 3.49Å; K1271-T1300 PolarHBondContact O-OG1 2.68Å; G1273-T1300 WeakPolarHBondContact CA-O 3.49Å; G1273-T1300 PolarHBondContact N-OG1 2.97Å; G1273-T1300 VanDerWaalsContact N-OG1 3.16Å; S1274-T1300 PolarHBondContact N-OG1 2.9Å; S1274-T1300 PolarHBondContact O-N 2.66Å; S1274-T1300 PolarHBondContact O-OG1 3.29Å; Y1276-T1300 HydrophobicContact CE2-CG2 4.28Å
1301	L	84	Confident	67.8	Low	103 Å²	103	105.9 Å²	105.9	54%	0.539	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-65.1	145.7	174.2	-58.8	-179.9	0	0	0	110.8	T1216 S1217 P1272 G1273	T1216-L1301 PolarHBondContact O-N 2.95Å; S1217-L1301 WeakPolarHBondContact CA-O 3.41Å; P1272-L1301 WeakPolarHBondContact CA-O 3.25Å; G1273-L1301 PolarHBondContact N-O 2.79Å
1302	S	79.3	Confident	64.9	Low	80 Å²	80	109.4 Å²	109.4	56%	0.559	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-64.2	158.7	170.9	-63.7	0	0	0	0	111.3
1303	L	61.6	Low	61.9	Low	100 Å²	100	111.5 Å²	111.5	52%	0.524	58%	0.578	S	S	.	*			trans	-91.2	109.3	165.3	-136.3	80	0	0	0	108.1	P1272 L1305	P1272-L1303 HydrophobicContact CB-CB 4.18Å; P1272-L1303 HydrophobicContact CB-CD1 4.26Å; P1272-L1303 HydrophobicContact CG-CD1 3.99Å; L1303-L1305 PolarHBondContact O-N 2.89Å
1304	D	50.8	Low	58.9	Low	155 Å²	155	115.6 Å²	115.6	83%	0.829	61%	0.605	S	S	*	*			trans	-73.6	96	-179.7	-71.4	-36.8	0	0	0	110.7	Y1306	D1304-Y1306 PolarHBondContact O-N 2.91Å
1305	L	36.5	Very low	56	Low	157 Å²	157	116.2 Å²	116.2	82%	0.822	61%	0.608	S	S	*	*			trans	-79.6	81.4	-179.3	-80.1	164.6	0	0	0	111.5	L1303	L1303-L1305 PolarHBondContact O-N 2.89Å
1306	Y	35.9	Very low	53.1	Low	205 Å²	205	117.7 Å²	117.7	80%	0.804	62%	0.62	S	S	*	*	S	Bend	trans	-135.3	90.9	164.5	-144.2	-98	0	0	0	112.6	D1304	D1304-Y1306 PolarHBondContact O-N 2.91Å
1307	N	35.1	Very low	50.4	Low	142 Å²	142	121.7 Å²	121.7	76%	0.759	65%	0.647	S	S	*	*	S	Bend	trans	48.1	98.6	156.3	-55.9	-27.2	0	0	0	118
1308	G	33.3	Very low	47.4	Very low	72 Å²	72	121.6 Å²	121.6	74%	0.742	66%	0.658	S	S	*	*			trans	-150.9	-73.6	179	0	0	0	0	0	117.4
1309	R	33	Very low	44.8	Very low	236 Å²	236	124.6 Å²	124.6	89%	0.891	69%	0.692	S	S	*	*			trans	67.6	123.3	-159.2	-66.5	176	170.2	162.3	-4.7	113.9
1310	E	28.9	Very low	42.3	Very low	170 Å²	170	124.2 Å²	124.2	79%	0.794	69%	0.692	S	S	*	*			cis	-140.9	136.8	-20	-71.7	-177.1	151.2	0	0	106.6	M1312	E1310-M1312 PolarHBondContact O-N 2.76Å; E1310-M1312 VanDerWaalsContact O-N 3.14Å
1311	P	30.6	Very low	39.9	Very low	122 Å²	122	126.5 Å²	126.5	79%	0.792	71%	0.708	S	S	*	*			trans	-72.1	109.1	168.9	29.5	-30.8	0	0	0	108.3
1312	M	33.1	Very low	38.1	Very low	144 Å²	144	128.1 Å²	128.1	71%	0.709	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-52.4	130.8	172.6	-153.2	172.8	80	0	0	108.2	E1310	E1310-M1312 PolarHBondContact O-N 2.76Å; E1310-M1312 VanDerWaalsContact O-N 3.14Å
1313	P	31.9	Very low	36.8	Very low	96 Å²	96	130.4 Å²	130.4	62%	0.623	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-59.7	144.9	-173.8	24.7	-34.7	0	0	0	109.4	L1315	P1313-L1315 PolarHBondContact O-N 2.94Å
1314	P	30.8	Very low	36.3	Very low	100 Å²	100	128.1 Å²	128.1	65%	0.649	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-54.1	131.9	162.2	26.7	-32.9	0	0	0	106.4	S1316	P1314-S1316 PolarHBondContact O-N 2.99Å
1315	L	27.9	Very low	36.3	Very low	156 Å²	156	122.2 Å²	122.2	82%	0.817	68%	0.684	S	S	*	*			trans	-62.8	95	165.7	-97.9	84.7	0	0	0	106.1	P1313 T1317	P1313-L1315 PolarHBondContact O-N 2.94Å; L1315-T1317 PolarHBondContact O-N 2.83Å
1316	S	30.2	Very low	37.5	Very low	105 Å²	105	120.7 Å²	120.7	73%	0.734	68%	0.676	S	S	*	*			trans	-63.2	96.4	172.5	48.6	0	0	0	0	106	P1314 S1318	P1314-S1316 PolarHBondContact O-N 2.99Å; S1316-S1318 PolarHBondContact O-N 2.97Å
1317	T	32.3	Very low	38.7	Very low	134 Å²	134	116 Å²	116	82%	0.822	66%	0.664	S	S	*	*			trans	-43.1	109.7	164	45.4	0	0	0	0	106.2	L1315 G1319	L1315-T1317 PolarHBondContact O-N 2.83Å; T1317-G1319 PolarHBondContact O-N 2.04Å
1318	S	30.7	Very low	40.1	Very low	104 Å²	104	113.1 Å²	113.1	73%	0.727	65%	0.648	S	S	*	*			trans	-67.3	90.9	175.5	51.6	0	0	0	0	106.5	S1316 Y1320	S1316-S1318 PolarHBondContact O-N 2.97Å; S1318-Y1320 PolarHBondContact O-N 2.92Å
1319	G	35.9	Very low	41.8	Very low	76 Å²	76	114.8 Å²	114.8	78%	0.784	64%	0.639	S	S	*	*			trans	-61.6	78.7	165.3	0	0	0	0	0	107.6	T1317 S1321	T1317-G1319 PolarHBondContact O-N 2.04Å; G1319-S1321 PolarHBondContact O-N 2.89Å
1320	Y	37.9	Very low	43.8	Very low	146 Å²	146	107.1 Å²	107.1	57%	0.573	62%	0.618	S	S	*	*			trans	-59.5	125.6	175.7	-143.6	-119.3	0	0	0	106.2	S1318 N1324 I1328	S1318-Y1320 PolarHBondContact O-N 2.92Å; Y1320-N1324 HydrophobicContact CD1-CB 3.3Å; Y1320-N1324 HydrophobicContact CE1-CB 3.43Å; Y1320-N1324 VanDerWaalsContact CE1-CB 3.43Å; Y1320-N1324 HydrophobicContact CG-CB 4.38Å; Y1320-I1328 HydrophobicContact CD1-CD1 3.43Å; Y1320-I1328 VanDerWaalsContact CD1-CD1 3.43Å; Y1320-I1328 HydrophobicContact CD1-CG1 4.48Å; Y1320-I1328 HydrophobicContact CE1-CD1 3.67Å; Y1320-I1328 HydrophobicContact CE1-CG1 4.48Å; Y1320-I1328 HydrophobicContact CG-CD1 4.36Å
1321	S	38.9	Very low	46.1	Very low	54 Å²	54	101.6 Å²	101.6	38%	0.378	60%	0.599	S	S	.	*			trans	-56.6	147.1	-169.3	68.1	0	0	0	0	111.4	G1319 D1323 N1324 A1325	G1319-S1321 PolarHBondContact O-N 2.89Å; S1321-D1323 VanDerWaalsContact CB-OD2 3.28Å; S1321-D1323 WeakPolarHBondContact CB-OD2 3.12Å; S1321-D1323 PolarHBondContact O-N 2.95Å; S1321-D1323 PolarHBondContact OG-OD2 2.75Å; S1321-N1324 WeakPolarHBondContact O-CA 3.34Å; S1321-N1324 WeakPolarHBondContact O-CB 2.99Å; S1321-N1324 PolarHBondContact O-N 2.86Å; S1321-N1324 PolarHBondContact OG-ND2 3.17Å; S1321-A1325 PolarHBondContact O-N 2.93Å
1322	D	45.3	Very low	48.2	Very low	137 Å²	137	98.6 Å²	98.6	73%	0.733	58%	0.584	S	S	*	*	H	α-helix	trans	-62.5	-19.8	-172.6	-68.4	-70.5	0	0	0	113.7	N1324 A1325 L1326	D1322-N1324 PolarHBondContact O-N 3.26Å; D1322-A1325 HydrophobicContact CB-CB 4.38Å; D1322-A1325 WeakPolarHBondContact O-CB 3.36Å; D1322-A1325 PolarHBondContact O-N 2.98Å; D1322-L1326 PolarHBondContact O-N 2.76Å
1323	D	52.4	Low	50.5	Low	127 Å²	127	95.7 Å²	95.7	68%	0.679	58%	0.577	S	S	*	*	H	α-helix	trans	-51.2	-38.7	165.9	-39.6	-72.2	0	0	0	111.9	S1321	S1321-D1323 VanDerWaalsContact CB-OD2 3.28Å; S1321-D1323 WeakPolarHBondContact CB-OD2 3.12Å; S1321-D1323 PolarHBondContact O-N 2.95Å; S1321-D1323 PolarHBondContact OG-OD2 2.75Å
1324	N	50.6	Low	53	Low	53 Å²	53	94.8 Å²	94.8	28%	0.283	57%	0.569	S	S	.	*	H	α-helix	trans	-92.6	-17.1	176.2	-66.1	-66.8	0	0	0	113.2	Y1320 S1321 D1322 L1326 L1327 I1328	Y1320-N1324 HydrophobicContact CD1-CB 3.3Å; Y1320-N1324 HydrophobicContact CE1-CB 3.43Å; Y1320-N1324 VanDerWaalsContact CE1-CB 3.43Å; Y1320-N1324 HydrophobicContact CG-CB 4.38Å; S1321-N1324 WeakPolarHBondContact O-CA 3.34Å; S1321-N1324 WeakPolarHBondContact O-CB 2.99Å; S1321-N1324 PolarHBondContact O-N 2.86Å; S1321-N1324 PolarHBondContact OG-ND2 3.17Å; D1322-N1324 PolarHBondContact O-N 3.26Å; N1324-L1326 VanDerWaalsContact C-N 3.26Å; N1324-L1326 PolarHBondContact O-N 3.13Å; N1324-L1327 CarbonylContact O-C 3.56Å; N1324-L1327 PolarHBondContact O-N 3.22Å; N1324-L1327 VanDerWaalsContact O-N 3.17Å; N1324-I1328 WeakPolarHBondContact O-CB 3.39Å; N1324-I1328 WeakPolarHBondContact O-CG1 3.12Å; N1324-I1328 PolarHBondContact O-N 2.78Å
1325	A	52	Low	55.4	Low	30 Å²	30	96.7 Å²	96.7	25%	0.248	57%	0.568	C	S	.	*	H	α-helix	trans	-62.4	-38.6	170.6	0	0	0	0	0	110.5	S1321 D1322 I1328 I1329	S1321-A1325 PolarHBondContact O-N 2.93Å; D1322-A1325 HydrophobicContact CB-CB 4.38Å; D1322-A1325 WeakPolarHBondContact O-CB 3.36Å; D1322-A1325 PolarHBondContact O-N 2.98Å; A1325-I1328 PolarHBondContact O-N 3.35Å; A1325-I1329 WeakPolarHBondContact O-CB 3.37Å; A1325-I1329 VanDerWaalsContact O-CG1 3.28Å; A1325-I1329 WeakPolarHBondContact O-CG1 3.09Å; A1325-I1329 PolarHBondContact O-N 3.28Å
1326	L	60.7	Low	57.8	Low	125 Å²	125	91 Å²	91	65%	0.654	55%	0.546	S	S	*	.	H	α-helix	trans	-64.3	-42.5	170.7	-159.4	86.4	0	0	0	111.6	D1322 N1324 I1328 I1329 V1330	D1322-L1326 PolarHBondContact O-N 2.76Å; N1324-L1326 VanDerWaalsContact C-N 3.26Å; N1324-L1326 PolarHBondContact O-N 3.13Å; L1326-I1328 PolarHBondContact O-N 3.06Å; L1326-I1329 PolarHBondContact O-N 3.18Å; L1326-V1330 HydrophobicContact CG-CG2 4.43Å; L1326-V1330 WeakPolarHBondContact O-CB 3.27Å; L1326-V1330 WeakPolarHBondContact O-CG2 3.2Å; L1326-V1330 PolarHBondContact O-N 3.49Å
1327	L	60.6	Low	60.5	Low	106 Å²	106	92 Å²	92	56%	0.555	54%	0.538	S	S	*	.	H	α-helix	trans	-69.9	-27.6	177	-73.9	169.9	0	0	0	113.5	N1324 S1331	N1324-L1327 CarbonylContact O-C 3.56Å; N1324-L1327 PolarHBondContact O-N 3.22Å; N1324-L1327 VanDerWaalsContact O-N 3.17Å; L1327-S1331 WeakPolarHBondContact O-CA 3.48Å; L1327-S1331 WeakPolarHBondContact O-CB 3.16Å; L1327-S1331 PolarHBondContact O-N 3.01Å; L1327-S1331 PolarHBondContact O-OG 2.96Å
1328	I	65.2	Low	63	Low	82 Å²	82	87.2 Å²	87.2	42%	0.421	51%	0.508	S	S	.	.	H	α-helix	trans	-80.6	-38.7	174.3	-71.8	176.7	0	0	0	110.6	Y1320 N1324 A1325 L1326 S1331 A1332	Y1320-I1328 HydrophobicContact CD1-CD1 3.43Å; Y1320-I1328 VanDerWaalsContact CD1-CD1 3.43Å; Y1320-I1328 HydrophobicContact CD1-CG1 4.48Å; Y1320-I1328 HydrophobicContact CE1-CD1 3.67Å; Y1320-I1328 HydrophobicContact CE1-CG1 4.48Å; Y1320-I1328 HydrophobicContact CG-CD1 4.36Å; N1324-I1328 WeakPolarHBondContact O-CB 3.39Å; N1324-I1328 WeakPolarHBondContact O-CG1 3.12Å; N1324-I1328 PolarHBondContact O-N 2.78Å; A1325-I1328 PolarHBondContact O-N 3.35Å; L1326-I1328 PolarHBondContact O-N 3.06Å; I1328-S1331 WeakPolarHBondContact CA-OG 3.18Å; I1328-S1331 PolarHBondContact O-N 3.3Å; I1328-A1332 WeakPolarHBondContact O-CA 3.33Å; I1328-A1332 WeakPolarHBondContact O-CB 3.15Å; I1328-A1332 PolarHBondContact O-N 2.55Å
1329	I	69	Low	65.5	Low	107 Å²	107	86.5 Å²	86.5	55%	0.549	50%	0.495	S	S	.	.	H	α-helix	trans	-67.9	-42.9	172.1	-68.3	167.2	0	0	0	109.8	A1325 L1326 C1333	A1325-I1329 WeakPolarHBondContact O-CB 3.37Å; A1325-I1329 VanDerWaalsContact O-CG1 3.28Å; A1325-I1329 WeakPolarHBondContact O-CG1 3.09Å; A1325-I1329 PolarHBondContact O-N 3.28Å; L1326-I1329 PolarHBondContact O-N 3.18Å; I1329-C1333 WeakPolarHBondContact O-CA 3.44Å; I1329-C1333 WeakPolarHBondContact O-CB 3.41Å; I1329-C1333 PolarHBondContact O-N 3.41Å; I1329-C1333 PolarHBondContact O-SG 2.83Å
1330	V	76.2	Confident	67.7	Low	75 Å²	75	87.6 Å²	87.6	46%	0.455	48%	0.483	S	S	.	.	H	α-helix	trans	-66	-43.3	174.1	170.9	0	0	0	0	110.8	L1326 C1333 V1334	L1326-V1330 HydrophobicContact CG-CG2 4.43Å; L1326-V1330 WeakPolarHBondContact O-CB 3.27Å; L1326-V1330 WeakPolarHBondContact O-CG2 3.2Å; L1326-V1330 PolarHBondContact O-N 3.49Å; V1330-C1333 CarbonylContact O-C 3.52Å; V1330-C1333 PolarHBondContact O-N 2.9Å; V1330-V1334 HydrophobicContact CG1-CG2 4.21Å; V1330-V1334 WeakPolarHBondContact O-CA 3.37Å; V1330-V1334 WeakPolarHBondContact O-CB 3.42Å; V1330-V1334 WeakPolarHBondContact O-CG2 3.28Å; V1330-V1334 PolarHBondContact O-N 2.91Å
1331	S	75.5	Confident	69.9	Low	55 Å²	55	81.5 Å²	81.5	39%	0.385	46%	0.46	S	S	.	.	H	α-helix	trans	-75.8	-23.4	177.9	65.6	0	0	0	0	113.9	L1327 I1328 F1335	L1327-S1331 WeakPolarHBondContact O-CA 3.48Å; L1327-S1331 WeakPolarHBondContact O-CB 3.16Å; L1327-S1331 PolarHBondContact O-N 3.01Å; L1327-S1331 PolarHBondContact O-OG 2.96Å; I1328-S1331 WeakPolarHBondContact CA-OG 3.18Å; I1328-S1331 PolarHBondContact O-N 3.3Å; S1331-F1335 WeakPolarHBondContact O-CA 3.04Å; S1331-F1335 WeakPolarHBondContact O-CB 3.35Å; S1331-F1335 WeakPolarHBondContact O-CD2 3.42Å; S1331-F1335 PolarHBondContact O-N 3.05Å
1332	A	75.8	Confident	72.1	Confident	59 Å²	59	82.8 Å²	82.8	49%	0.488	46%	0.462	S	S	.	.	H	α-helix	trans	-85.4	-26	171.5	0	0	0	0	0	112.3	I1328 G1336	I1328-A1332 WeakPolarHBondContact O-CA 3.33Å; I1328-A1332 WeakPolarHBondContact O-CB 3.15Å; I1328-A1332 PolarHBondContact O-N 2.55Å; A1332-G1336 WeakPolarHBondContact O-CA 3.15Å; A1332-G1336 PolarHBondContact O-N 2.87Å
1333	C	81.3	Confident	73.6	Confident	82 Å²	82	80.3 Å²	80.3	55%	0.554	45%	0.448	S	S	*	.	H	α-helix	trans	-76.6	-29.1	164.1	-74.1	0	0	0	0	111.4	I1329 V1330 F1337	I1329-C1333 WeakPolarHBondContact O-CA 3.44Å; I1329-C1333 WeakPolarHBondContact O-CB 3.41Å; I1329-C1333 PolarHBondContact O-N 3.41Å; I1329-C1333 PolarHBondContact O-SG 2.83Å; V1330-C1333 CarbonylContact O-C 3.52Å; V1330-C1333 PolarHBondContact O-N 2.9Å; C1333-F1337 WeakPolarHBondContact O-CA 3.39Å; C1333-F1337 WeakPolarHBondContact O-CB 3.18Å; C1333-F1337 PolarHBondContact O-N 3.1Å
1334	V	83.7	Confident	75.1	Confident	78 Å²	78	77.9 Å²	77.9	47%	0.473	44%	0.435	S	S	.	.	H	α-helix	trans	-81.3	-44.2	174.1	167.2	0	0	0	0	110.8	V1330 G1336 F1337 V1338	V1330-V1334 HydrophobicContact CG1-CG2 4.21Å; V1330-V1334 WeakPolarHBondContact O-CA 3.37Å; V1330-V1334 WeakPolarHBondContact O-CB 3.42Å; V1330-V1334 WeakPolarHBondContact O-CG2 3.28Å; V1330-V1334 PolarHBondContact O-N 2.91Å; V1334-G1336 VanDerWaalsContact C-N 3.31Å; V1334-F1337 CarbonylContact O-C 3.44Å; V1334-F1337 PolarHBondContact O-N 3.04Å; V1334-V1338 HydrophobicContact CG1-CG2 4.2Å; V1334-V1338 WeakPolarHBondContact O-CA 3.41Å; V1334-V1338 WeakPolarHBondContact O-CB 3.4Å; V1334-V1338 WeakPolarHBondContact O-CG2 2.88Å; V1334-V1338 PolarHBondContact O-N 3.38Å
1335	F	80.6	Confident	76.7	Confident	140 Å²	140	75.9 Å²	75.9	61%	0.614	42%	0.424	S	S	*	.	H	α-helix	trans	-65.4	-36.7	166.8	-92.9	-84.3	0	0	0	110.8	S1331 V1338 I1339	S1331-F1335 WeakPolarHBondContact O-CA 3.04Å; S1331-F1335 WeakPolarHBondContact O-CB 3.35Å; S1331-F1335 WeakPolarHBondContact O-CD2 3.42Å; S1331-F1335 PolarHBondContact O-N 3.05Å; F1335-V1338 CarbonylContact O-C 3.44Å; F1335-V1338 PolarHBondContact O-N 2.7Å; F1335-I1339 HydrophobicContact CD1-CD1 4.38Å; F1335-I1339 WeakPolarHBondContact O-CA 3.1Å; F1335-I1339 WeakPolarHBondContact O-CB 3.32Å; F1335-I1339 WeakPolarHBondContact O-CD1 3.37Å; F1335-I1339 WeakPolarHBondContact O-CG1 3.2Å; F1335-I1339 PolarHBondContact O-N 2.9Å
1336	G	79.8	Confident	77.9	Confident	35 Å²	35	77.1 Å²	77.1	36%	0.361	43%	0.428	S	S	.	.	H	α-helix	trans	-65	-40.7	174.1	0	0	0	0	0	112.1	A1332 V1334 L1340	A1332-G1336 WeakPolarHBondContact O-CA 3.15Å; A1332-G1336 PolarHBondContact O-N 2.87Å; V1334-G1336 VanDerWaalsContact C-N 3.31Å; G1336-L1340 WeakPolarHBondContact O-CA 3.32Å; G1336-L1340 WeakPolarHBondContact O-CB 3.4Å; G1336-L1340 PolarHBondContact O-N 3Å
1337	F	87.1	Confident	78.7	Confident	127 Å²	127	75.3 Å²	75.3	56%	0.557	42%	0.418	S	S	*	.	H	α-helix	trans	-80.5	-21.5	174.3	-174	-116.5	0	0	0	112.5	C1333 V1334 L1341	C1333-F1337 WeakPolarHBondContact O-CA 3.39Å; C1333-F1337 WeakPolarHBondContact O-CB 3.18Å; C1333-F1337 PolarHBondContact O-N 3.1Å; V1334-F1337 CarbonylContact O-C 3.44Å; V1334-F1337 PolarHBondContact O-N 3.04Å; F1337-L1341 HydrophobicContact CD1-CD1 3.66Å; F1337-L1341 HydrophobicContact CD1-CG 4.4Å; F1337-L1341 HydrophobicContact CD2-CD1 4.45Å; F1337-L1341 HydrophobicContact CD2-CG 4.39Å; F1337-L1341 HydrophobicContact CE1-CD1 3.39Å; F1337-L1341 HydrophobicContact CE1-CG 4.26Å; F1337-L1341 HydrophobicContact CE2-CD1 4.23Å; F1337-L1341 HydrophobicContact CE2-CG 4.24Å; F1337-L1341 HydrophobicContact CG-CD1 4.2Å; F1337-L1341 HydrophobicContact CG-CG 4.47Å; F1337-L1341 HydrophobicContact CZ-CD1 3.71Å; F1337-L1341 HydrophobicContact CZ-CG 4.18Å; F1337-L1341 VanDerWaalsContact O-CA 3.27Å; F1337-L1341 WeakPolarHBondContact O-CA 3.4Å; F1337-L1341 WeakPolarHBondContact O-CB 3.39Å; F1337-L1341 WeakPolarHBondContact O-CD1 3.48Å; F1337-L1341 WeakPolarHBondContact O-CG 3.14Å; F1337-L1341 PolarHBondContact O-N 3.28Å
1338	V	85	Confident	79.7	Confident	34 Å²	34	74.2 Å²	74.2	21%	0.206	41%	0.412	C	S	.	.	H	α-helix	trans	-87.7	-16.1	171.4	169.1	0	0	0	0	110.7	V1334 F1335 I1342	V1334-V1338 HydrophobicContact CG1-CG2 4.2Å; V1334-V1338 WeakPolarHBondContact O-CA 3.41Å; V1334-V1338 WeakPolarHBondContact O-CB 3.4Å; V1334-V1338 WeakPolarHBondContact O-CG2 2.88Å; V1334-V1338 PolarHBondContact O-N 3.38Å; F1335-V1338 CarbonylContact O-C 3.44Å; F1335-V1338 PolarHBondContact O-N 2.7Å; V1338-I1342 HydrophobicContact CG1-CD1 3.9Å; V1338-I1342 HydrophobicContact CG1-CG1 4.43Å; V1338-I1342 WeakPolarHBondContact O-CA 3.38Å; V1338-I1342 WeakPolarHBondContact O-CB 3.16Å; V1338-I1342 WeakPolarHBondContact O-CD1 3.38Å; V1338-I1342 WeakPolarHBondContact O-CG1 3.2Å; V1338-I1342 PolarHBondContact O-N 3.2Å
1339	I	81.5	Confident	80.2	Confident	88 Å²	88	74 Å²	74	45%	0.451	41%	0.408	S	S	.	.	H	α-helix	trans	-94.4	-33.3	168.9	-69.8	166.2	0	0	0	110.6	F1335 I1342 N1343	F1335-I1339 HydrophobicContact CD1-CD1 4.38Å; F1335-I1339 WeakPolarHBondContact O-CA 3.1Å; F1335-I1339 WeakPolarHBondContact O-CB 3.32Å; F1335-I1339 WeakPolarHBondContact O-CD1 3.37Å; F1335-I1339 WeakPolarHBondContact O-CG1 3.2Å; F1335-I1339 PolarHBondContact O-N 2.9Å; I1339-I1342 CarbonylContact O-C 3.47Å; I1339-I1342 PolarHBondContact O-N 2.84Å; I1339-N1343 WeakPolarHBondContact O-CB 3.13Å; I1339-N1343 PolarHBondContact O-N 3.38Å; I1339-N1343 PolarHBondContact O-ND2 2.78Å
1340	L	82.3	Confident	80.2	Confident	99 Å²	99	71 Å²	71	52%	0.518	39%	0.393	S	S	.	.	H	α-helix	trans	-76.8	-36.1	169.9	-173.8	149.6	0	0	0	110.2	G1336 I1344	G1336-L1340 WeakPolarHBondContact O-CA 3.32Å; G1336-L1340 WeakPolarHBondContact O-CB 3.4Å; G1336-L1340 PolarHBondContact O-N 3Å; L1340-I1344 HydrophobicContact CD2-CD1 3.58Å; L1340-I1344 HydrophobicContact CD2-CG1 4.28Å; L1340-I1344 WeakPolarHBondContact O-CB 3.29Å; L1340-I1344 WeakPolarHBondContact O-CG1 3.34Å; L1340-I1344 PolarHBondContact O-N 2.83Å
1341	L	85.2	Confident	80.1	Confident	18 Å²	18	71.1 Å²	71.1	9%	0.094	39%	0.391	C	S	.	.	H	α-helix	trans	-60.6	-61.2	155.1	-70.8	166	0	0	0	108.2	F1337 N1343 I1344 I1345 T1374	F1337-L1341 HydrophobicContact CD1-CD1 3.66Å; F1337-L1341 HydrophobicContact CD1-CG 4.4Å; F1337-L1341 HydrophobicContact CD2-CD1 4.45Å; F1337-L1341 HydrophobicContact CD2-CG 4.39Å; F1337-L1341 HydrophobicContact CE1-CD1 3.39Å; F1337-L1341 HydrophobicContact CE1-CG 4.26Å; F1337-L1341 HydrophobicContact CE2-CD1 4.23Å; F1337-L1341 HydrophobicContact CE2-CG 4.24Å; F1337-L1341 HydrophobicContact CG-CD1 4.2Å; F1337-L1341 HydrophobicContact CG-CG 4.47Å; F1337-L1341 HydrophobicContact CZ-CD1 3.71Å; F1337-L1341 HydrophobicContact CZ-CG 4.18Å; F1337-L1341 VanDerWaalsContact O-CA 3.27Å; F1337-L1341 WeakPolarHBondContact O-CA 3.4Å; F1337-L1341 WeakPolarHBondContact O-CB 3.39Å; F1337-L1341 WeakPolarHBondContact O-CD1 3.48Å; F1337-L1341 WeakPolarHBondContact O-CG 3.14Å; F1337-L1341 PolarHBondContact O-N 3.28Å; L1341-N1343 CarbonylContact O-C 3.54Å; L1341-N1343 PolarHBondContact O-N 3.2Å; L1341-I1344 CarbonylContact O-C 3.57Å; L1341-I1344 WeakPolarHBondContact O-CA 3Å; L1341-I1344 PolarHBondContact O-N 2.96Å; L1341-I1345 VanDerWaalsContact C-CG1 3.44Å; L1341-I1345 HydrophobicContact CB-CD1 4.11Å; L1341-I1345 HydrophobicContact CB-CG1 4.28Å; L1341-I1345 WeakPolarHBondContact O-CA 3.47Å; L1341-I1345 WeakPolarHBondContact O-CB 3.36Å; L1341-I1345 WeakPolarHBondContact O-CG1 3.23Å; L1341-I1345 PolarHBondContact O-N 2.83Å; L1341-T1374 WeakPolarHBondContact CB-O 3.49Å; L1341-T1374 WeakPolarHBondContact CD1-O 3.14Å; L1341-T1374 WeakPolarHBondContact CD1-OG1 3.2Å; L1341-T1374 WeakPolarHBondContact CD2-OG1 3.16Å
1342	I	84.7	Confident	79.8	Confident	82 Å²	82	75.5 Å²	75.5	42%	0.421	40%	0.402	S	S	.	.	H	α-helix	trans	-52.5	-13.6	-179.4	-73.9	166.4	0	0	0	114.6	V1338 I1339 I1345 V1346	V1338-I1342 HydrophobicContact CG1-CD1 3.9Å; V1338-I1342 HydrophobicContact CG1-CG1 4.43Å; V1338-I1342 WeakPolarHBondContact O-CA 3.38Å; V1338-I1342 WeakPolarHBondContact O-CB 3.16Å; V1338-I1342 WeakPolarHBondContact O-CD1 3.38Å; V1338-I1342 WeakPolarHBondContact O-CG1 3.2Å; V1338-I1342 PolarHBondContact O-N 3.2Å; I1339-I1342 CarbonylContact O-C 3.47Å; I1339-I1342 PolarHBondContact O-N 2.84Å; I1342-I1345 VanDerWaalsContact CA-CB 3.4Å; I1342-I1345 HydrophobicContact CB-CD1 4.36Å; I1342-I1345 HydrophobicContact CB-CG2 4.22Å; I1342-I1345 HydrophobicContact CG1-CD1 3.65Å; I1342-I1345 HydrophobicContact CG1-CG2 4.19Å; I1342-I1345 HydrophobicContact CG2-CG2 4.33Å; I1342-I1345 WeakPolarHBondContact O-CB 3.1Å; I1342-I1345 VanDerWaalsContact O-CG2 3.25Å; I1342-I1345 WeakPolarHBondContact O-CG2 3.37Å; I1342-V1346 VanDerWaalsContact O-CB 3.25Å; I1342-V1346 WeakPolarHBondContact O-CB 3.11Å; I1342-V1346 WeakPolarHBondContact O-CG2 3.13Å; I1342-V1346 PolarHBondContact O-N 3.42Å
1343	N	77.5	Confident	79.4	Confident	84 Å²	84	77.2 Å²	77.2	45%	0.449	40%	0.396	S	S	.	.	H	α-helix	trans	-98.4	-32.6	164.8	-74.3	-78.3	0	0	0	115.3	I1339 L1341 V1346 I1347	I1339-N1343 WeakPolarHBondContact O-CB 3.13Å; I1339-N1343 PolarHBondContact O-N 3.38Å; I1339-N1343 PolarHBondContact O-ND2 2.78Å; L1341-N1343 CarbonylContact O-C 3.54Å; L1341-N1343 PolarHBondContact O-N 3.2Å; N1343-V1346 CarbonylContact O-C 3.59Å; N1343-V1346 PolarHBondContact O-N 3.43Å; N1343-I1347 WeakPolarHBondContact O-CB 3.27Å; N1343-I1347 VanDerWaalsContact O-CD1 3.3Å; N1343-I1347 WeakPolarHBondContact O-CD1 3.26Å; N1343-I1347 WeakPolarHBondContact O-CG1 3.03Å; N1343-I1347 PolarHBondContact O-N 2.95Å
1344	I	84.2	Confident	78.4	Confident	76 Å²	76	79.1 Å²	79.1	39%	0.39	39%	0.392	S	S	.	.	H	α-helix	trans	-68.7	-42.2	167.1	-74.1	178.5	0	0	0	111.7	L1340 L1341 I1347 I1348	L1340-I1344 HydrophobicContact CD2-CD1 3.58Å; L1340-I1344 HydrophobicContact CD2-CG1 4.28Å; L1340-I1344 WeakPolarHBondContact O-CB 3.29Å; L1340-I1344 WeakPolarHBondContact O-CG1 3.34Å; L1340-I1344 PolarHBondContact O-N 2.83Å; L1341-I1344 CarbonylContact O-C 3.57Å; L1341-I1344 WeakPolarHBondContact O-CA 3Å; L1341-I1344 PolarHBondContact O-N 2.96Å; I1344-I1347 PolarHBondContact O-N 2.7Å; I1344-I1348 HydrophobicContact CG2-CD1 3.71Å; I1344-I1348 HydrophobicContact CG2-CG1 4.44Å; I1344-I1348 WeakPolarHBondContact O-CB 3.17Å; I1344-I1348 WeakPolarHBondContact O-CD1 3.22Å; I1344-I1348 WeakPolarHBondContact O-CG1 3.23Å; I1344-I1348 PolarHBondContact O-N 3.2Å
1345	I	82.8	Confident	77.5	Confident	11 Å²	11	84 Å²	84	6%	0.056	40%	0.402	C	S	.	.	H	α-helix	trans	-32.6	-93.4	142.7	-70.3	-175	0	0	0	106.8	L1341 I1342 I1347 I1348 V1371 T1372 M1373 T1374	L1341-I1345 VanDerWaalsContact C-CG1 3.44Å; L1341-I1345 HydrophobicContact CB-CD1 4.11Å; L1341-I1345 HydrophobicContact CB-CG1 4.28Å; L1341-I1345 WeakPolarHBondContact O-CA 3.47Å; L1341-I1345 WeakPolarHBondContact O-CB 3.36Å; L1341-I1345 WeakPolarHBondContact O-CG1 3.23Å; L1341-I1345 PolarHBondContact O-N 2.83Å; I1342-I1345 VanDerWaalsContact CA-CB 3.4Å; I1342-I1345 HydrophobicContact CB-CD1 4.36Å; I1342-I1345 HydrophobicContact CB-CG2 4.22Å; I1342-I1345 HydrophobicContact CG1-CD1 3.65Å; I1342-I1345 HydrophobicContact CG1-CG2 4.19Å; I1342-I1345 HydrophobicContact CG2-CG2 4.33Å; I1342-I1345 WeakPolarHBondContact O-CB 3.1Å; I1342-I1345 VanDerWaalsContact O-CG2 3.25Å; I1342-I1345 WeakPolarHBondContact O-CG2 3.37Å; I1345-I1347 CarbonylContact O-C 3.59Å; I1345-I1347 PolarHBondContact O-N 3.36Å; I1345-I1348 PolarHBondContact O-N 2.87Å; I1345-V1371 WeakPolarHBondContact CG2-O 2.96Å; I1345-V1371 WeakPolarHBondContact O-CG2 3.17Å; I1345-T1372 VanDerWaalsContact CG1-C 3.47Å; I1345-T1372 VanDerWaalsContact CG2-N 3.33Å; I1345-M1373 WeakPolarHBondContact CG1-O 3.28Å; I1345-T1374 VanDerWaalsContact CD1-O 3.27Å; I1345-T1374 WeakPolarHBondContact CD1-O 3.28Å
1346	V	78.6	Confident	76.4	Confident	57 Å²	57	83.4 Å²	83.4	35%	0.345	40%	0.401	S	S	.	.	H	α-helix	trans	-52.7	-15.2	-168.4	168.3	0	0	0	0	114	I1342 N1343 L1350 G1370	I1342-V1346 VanDerWaalsContact O-CB 3.25Å; I1342-V1346 WeakPolarHBondContact O-CB 3.11Å; I1342-V1346 WeakPolarHBondContact O-CG2 3.13Å; I1342-V1346 PolarHBondContact O-N 3.42Å; N1343-V1346 CarbonylContact O-C 3.59Å; N1343-V1346 PolarHBondContact O-N 3.43Å; V1346-L1350 HydrophobicContact CG1-CD1 4.21Å; V1346-L1350 WeakPolarHBondContact O-CB 3.48Å; V1346-L1350 WeakPolarHBondContact O-CD1 2.96Å; V1346-L1350 WeakPolarHBondContact O-CG 3.01Å; V1346-L1350 PolarHBondContact O-N 2.95Å; V1346-G1370 CarbonylContact C-O 3.52Å
1347	I	77.2	Confident	75.1	Confident	86 Å²	86	86.5 Å²	86.5	44%	0.441	40%	0.402	S	S	.	.	H	α-helix	trans	-80.9	-29.3	168.8	-71	164.1	0	0	0	115.2	N1343 I1344 I1345 L1350 I1351	N1343-I1347 WeakPolarHBondContact O-CB 3.27Å; N1343-I1347 VanDerWaalsContact O-CD1 3.3Å; N1343-I1347 WeakPolarHBondContact O-CD1 3.26Å; N1343-I1347 WeakPolarHBondContact O-CG1 3.03Å; N1343-I1347 PolarHBondContact O-N 2.95Å; I1344-I1347 PolarHBondContact O-N 2.7Å; I1345-I1347 CarbonylContact O-C 3.59Å; I1345-I1347 PolarHBondContact O-N 3.36Å; I1347-L1350 CarbonylContact O-C 3.57Å; I1347-L1350 VanDerWaalsContact O-CB 3.3Å; I1347-L1350 WeakPolarHBondContact O-CB 3.26Å; I1347-L1350 PolarHBondContact O-N 3.02Å; I1347-I1351 HydrophobicContact CG2-CD1 3.59Å; I1347-I1351 HydrophobicContact CG2-CG1 4.28Å; I1347-I1351 VanDerWaalsContact O-CB 3.3Å; I1347-I1351 WeakPolarHBondContact O-CB 3.24Å; I1347-I1351 WeakPolarHBondContact O-CG1 3.17Å; I1347-I1351 PolarHBondContact O-N 2.57Å
1348	I	80.8	Confident	73.3	Confident	83 Å²	83	81.4 Å²	81.4	43%	0.426	38%	0.38	S	S	.	.	H	α-helix	trans	-76.2	-58.3	-168.9	-85.2	167.3	0	0	0	116.5	I1344 I1345 L1350 I1351 K1352 V1371	I1344-I1348 HydrophobicContact CG2-CD1 3.71Å; I1344-I1348 HydrophobicContact CG2-CG1 4.44Å; I1344-I1348 WeakPolarHBondContact O-CB 3.17Å; I1344-I1348 WeakPolarHBondContact O-CD1 3.22Å; I1344-I1348 WeakPolarHBondContact O-CG1 3.23Å; I1344-I1348 PolarHBondContact O-N 3.2Å; I1345-I1348 PolarHBondContact O-N 2.87Å; I1348-L1350 VanDerWaalsContact C-N 3.34Å; I1348-I1351 CarbonylContact O-C 3.59Å; I1348-I1351 WeakPolarHBondContact O-CB 3.47Å; I1348-I1351 PolarHBondContact O-N 2.87Å; I1348-K1352 WeakPolarHBondContact O-CB 3.12Å; I1348-K1352 PolarHBondContact O-N 3.43Å; I1348-V1371 HydrophobicContact CB-CG2 4.29Å
1349	F	74.8	Confident	71.7	Confident	77 Å²	77	86.8 Å²	86.8	34%	0.338	41%	0.405	S	S	.	.	H	α-helix	trans	-81.5	14	151.7	101.6	45.1	0	0	0	114.8	K1352 R1353 G1370 V1371	F1349-K1352 HydrophobicContact CB-CB 3.53Å; F1349-K1352 HydrophobicContact CB-CD 4.28Å; F1349-K1352 HydrophobicContact CB-CG 3.91Å; F1349-R1353 HydrophobicContact CB-CB 4.15Å; F1349-R1353 HydrophobicContact CD1-CB 3.37Å; F1349-R1353 HydrophobicContact CD1-CG 4.26Å; F1349-R1353 HydrophobicContact CE1-CB 4.13Å; F1349-R1353 HydrophobicContact CG-CB 3.96Å; F1349-R1353 WeakPolarHBondContact O-CA 3.13Å; F1349-R1353 WeakPolarHBondContact O-CB 3.36Å; F1349-R1353 PolarHBondContact O-N 2.96Å; F1349-G1370 CarbonylContact C-O 3.48Å; F1349-G1370 CarbonylContact O-C 3.54Å; F1349-G1370 WeakPolarHBondContact O-CA 3.38Å; F1349-V1371 VanDerWaalsContact CA-CG2 3.41Å; F1349-V1371 HydrophobicContact CB-CB 3.43Å; F1349-V1371 VanDerWaalsContact CB-CB 3.43Å; F1349-V1371 HydrophobicContact CB-CG1 3.31Å; F1349-V1371 HydrophobicContact CB-CG2 4.16Å; F1349-V1371 HydrophobicContact CD1-CB 3.28Å; F1349-V1371 HydrophobicContact CD1-CG1 3.72Å; F1349-V1371 VanDerWaalsContact CD1-N 3.3Å; F1349-V1371 HydrophobicContact CD2-CB 3.68Å; F1349-V1371 HydrophobicContact CD2-CG1 3.04Å; F1349-V1371 HydrophobicContact CE1-CB 3.85Å; F1349-V1371 HydrophobicContact CE1-CG1 4.24Å; F1349-V1371 VanDerWaalsContact CE1-N 3.28Å; F1349-V1371 HydrophobicContact CE2-CB 4.18Å; F1349-V1371 HydrophobicContact CE2-CG1 3.64Å; F1349-V1371 HydrophobicContact CG-CB 3.13Å; F1349-V1371 HydrophobicContact CG-CG1 3.04Å; F1349-V1371 HydrophobicContact CG-CG2 4.33Å; F1349-V1371 HydrophobicContact CZ-CB 4.25Å; F1349-V1371 HydrophobicContact CZ-CG1 4.19Å; F1349-V1371 VanDerWaalsContact N-CG1 3.31Å
1350	L	69.8	Low	70	Confident	46 Å²	46	89.8 Å²	89.8	24%	0.241	42%	0.419	C	S	.	.	H	α-helix	trans	-65.7	-74.3	140.4	-105	170.7	0	0	0	102.5	V1346 I1347 I1348 K1352 R1353 R1354 Q1369 G1370	V1346-L1350 HydrophobicContact CG1-CD1 4.21Å; V1346-L1350 WeakPolarHBondContact O-CB 3.48Å; V1346-L1350 WeakPolarHBondContact O-CD1 2.96Å; V1346-L1350 WeakPolarHBondContact O-CG 3.01Å; V1346-L1350 PolarHBondContact O-N 2.95Å; I1347-L1350 CarbonylContact O-C 3.57Å; I1347-L1350 VanDerWaalsContact O-CB 3.3Å; I1347-L1350 WeakPolarHBondContact O-CB 3.26Å; I1347-L1350 PolarHBondContact O-N 3.02Å; I1348-L1350 VanDerWaalsContact C-N 3.34Å; L1350-K1352 PolarHBondContact O-N 3.03Å; L1350-R1353 PolarHBondContact O-N 2.95Å; L1350-R1353 VanDerWaalsContact O-N 3.17Å; L1350-R1354 WeakPolarHBondContact O-CA 3.44Å; L1350-R1354 WeakPolarHBondContact O-CB 3.34Å; L1350-R1354 PolarHBondContact O-N 3.22Å; L1350-Q1369 VanDerWaalsContact CD2-C 3.47Å; L1350-Q1369 VanDerWaalsContact CD2-CA 3.41Å; L1350-G1370 PolarHBondContact N-O 2.79Å
1351	I	73.2	Confident	68.1	Low	77 Å²	77	93.5 Å²	93.5	40%	0.395	43%	0.426	S	S	.	.	H	α-helix	trans	-42.6	-35.5	176.2	-67.9	167.6	0	0	0	113.8	I1347 I1348 R1355	I1347-I1351 HydrophobicContact CG2-CD1 3.59Å; I1347-I1351 HydrophobicContact CG2-CG1 4.28Å; I1347-I1351 VanDerWaalsContact O-CB 3.3Å; I1347-I1351 WeakPolarHBondContact O-CB 3.24Å; I1347-I1351 WeakPolarHBondContact O-CG1 3.17Å; I1347-I1351 PolarHBondContact O-N 2.57Å; I1348-I1351 CarbonylContact O-C 3.59Å; I1348-I1351 WeakPolarHBondContact O-CB 3.47Å; I1348-I1351 PolarHBondContact O-N 2.87Å; I1351-R1355 WeakPolarHBondContact O-CA 3.45Å; I1351-R1355 WeakPolarHBondContact O-CB 3.43Å; I1351-R1355 WeakPolarHBondContact O-CD 3.43Å; I1351-R1355 WeakPolarHBondContact O-CG 3.28Å; I1351-R1355 PolarHBondContact O-N 3.12Å
1352	K	70.2	Confident	66.3	Low	146 Å²	146	100 Å²	100	64%	0.635	45%	0.449	S	S	*	.	H	α-helix	trans	-94.3	-31.6	179.5	175.4	-177.3	-179.9	-177.8	0	117.3	I1348 F1349 L1350 H1356	I1348-K1352 WeakPolarHBondContact O-CB 3.12Å; I1348-K1352 PolarHBondContact O-N 3.43Å; F1349-K1352 HydrophobicContact CB-CB 3.53Å; F1349-K1352 HydrophobicContact CB-CD 4.28Å; F1349-K1352 HydrophobicContact CB-CG 3.91Å; L1350-K1352 PolarHBondContact O-N 3.03Å; K1352-H1356 VanDerWaalsContact O-CB 3.29Å; K1352-H1356 WeakPolarHBondContact O-CB 3.11Å; K1352-H1356 PolarHBondContact O-N 2.66Å
1353	R	66.5	Low	64.1	Low	95 Å²	95	106.4 Å²	106.4	36%	0.358	47%	0.468	S	S	.	.	H	α-helix	trans	-89	-27.5	169.2	170.5	-168.4	-179.9	-178.2	1.7	110.3	F1349 L1350 H1356 R1357 Q1369	F1349-R1353 HydrophobicContact CB-CB 4.15Å; F1349-R1353 HydrophobicContact CD1-CB 3.37Å; F1349-R1353 HydrophobicContact CD1-CG 4.26Å; F1349-R1353 HydrophobicContact CE1-CB 4.13Å; F1349-R1353 HydrophobicContact CG-CB 3.96Å; F1349-R1353 WeakPolarHBondContact O-CA 3.13Å; F1349-R1353 WeakPolarHBondContact O-CB 3.36Å; F1349-R1353 PolarHBondContact O-N 2.96Å; L1350-R1353 PolarHBondContact O-N 2.95Å; L1350-R1353 VanDerWaalsContact O-N 3.17Å; R1353-H1356 PolarHBondContact O-N 2.84Å; R1353-R1357 WeakPolarHBondContact O-CB 3.19Å; R1353-R1357 PolarHBondContact O-N 3.41Å; R1353-Q1369 VanDerWaalsContact CB-O 3.27Å; R1353-Q1369 WeakPolarHBondContact CB-O 3.41Å; R1353-Q1369 WeakPolarHBondContact CD-O 3.44Å; R1353-Q1369 WeakPolarHBondContact CG-O 3.27Å
1354	R	61.4	Low	62	Low	123 Å²	123	110.8 Å²	110.8	46%	0.464	49%	0.486	S	S	.	.	H	α-helix	trans	-52.7	-67.3	149.9	-154.9	156.2	-167.6	168.5	9	108.6	L1350 H1356 R1357 N1358 S1367 D1368 Q1369	L1350-R1354 WeakPolarHBondContact O-CA 3.44Å; L1350-R1354 WeakPolarHBondContact O-CB 3.34Å; L1350-R1354 PolarHBondContact O-N 3.22Å; R1354-H1356 PolarHBondContact O-N 3.17Å; R1354-R1357 PolarHBondContact O-N 2.55Å; R1354-N1358 VanDerWaalsContact C-CG 3.43Å; R1354-N1358 WeakPolarHBondContact O-CA 2.91Å; R1354-N1358 WeakPolarHBondContact O-CB 3.44Å; R1354-N1358 PolarHBondContact O-N 2.69Å; R1354-N1358 PolarHBondContact O-ND2 2.68Å; R1354-N1358 PolarHBondContact O-OD1 2.8Å; R1354-S1367 WeakPolarHBondContact CD-O 3.24Å; R1354-S1367 WeakPolarHBondContact CG-O 3.42Å; R1354-S1367 PolarHBondContact NE-O 2.73Å; R1354-D1368 VanDerWaalsContact CA-O 3.25Å; R1354-D1368 WeakPolarHBondContact CA-O 3.39Å; R1354-D1368 PolarHBondContact N-O 2.8Å; R1354-D1368 VanDerWaalsContact NE-N 3.13Å; R1354-Q1369 PolarHBondContact N-O 3.22Å
1355	R	64.4	Low	59.6	Low	179 Å²	179	115.6 Å²	115.6	68%	0.675	50%	0.5	S	S	*	.	H	α-helix	trans	-54.3	-24.4	177.7	-79.2	162.3	-173.9	179.9	1.7	114.7	I1351 N1358 M1359	I1351-R1355 WeakPolarHBondContact O-CA 3.45Å; I1351-R1355 WeakPolarHBondContact O-CB 3.43Å; I1351-R1355 WeakPolarHBondContact O-CD 3.43Å; I1351-R1355 WeakPolarHBondContact O-CG 3.28Å; I1351-R1355 PolarHBondContact O-N 3.12Å; R1355-N1358 CarbonylContact O-C 3.51Å; R1355-N1358 VanDerWaalsContact O-CA 3.27Å; R1355-N1358 WeakPolarHBondContact O-CA 2.91Å; R1355-M1359 PolarHBondContact O-N 3.34Å
1356	H	57.3	Low	57.6	Low	128 Å²	128	117.2 Å²	117.2	59%	0.593	51%	0.507	S	S	*	.	H	α-helix	trans	-84.2	-48.1	175.3	-159.8	-90	0	0	0	115.4	K1352 R1353 R1354 N1358 M1359 M1360	K1352-H1356 VanDerWaalsContact O-CB 3.29Å; K1352-H1356 WeakPolarHBondContact O-CB 3.11Å; K1352-H1356 PolarHBondContact O-N 2.66Å; R1353-H1356 PolarHBondContact O-N 2.84Å; R1354-H1356 PolarHBondContact O-N 3.17Å; H1356-N1358 CarbonylContact O-C 3.6Å; H1356-M1359 PolarHBondContact O-N 2.07Å; H1356-M1360 PolarHBondContact O-N 3.34Å
1357	R	52.7	Low	55.6	Low	101 Å²	101	116 Å²	116	38%	0.381	50%	0.501	S	S	.	.	H	α-helix	trans	-64.2	-51.1	173.2	-86.9	-176.1	168.6	164.6	1	110.4	R1353 R1354 M1360 R1361 S1367 D1368	R1353-R1357 WeakPolarHBondContact O-CB 3.19Å; R1353-R1357 PolarHBondContact O-N 3.41Å; R1354-R1357 PolarHBondContact O-N 2.55Å; R1357-M1360 CarbonylContact O-C 3.57Å; R1357-M1360 WeakPolarHBondContact O-CA 3.48Å; R1357-M1360 PolarHBondContact O-N 2.7Å; R1357-R1361 PolarHBondContact O-N 3.13Å; R1357-S1367 WeakPolarHBondContact CB-OG 3.48Å; R1357-D1368 IonicContact CZ-OD2 2.73Å; R1357-D1368 IonicContact NH1-OD2 3.59Å; R1357-D1368 PolarHBondContact NH1-OD2 3.3Å
1358	N	48.8	Very low	53.4	Low	20 Å²	20	114.8 Å²	114.8	11%	0.107	50%	0.495	C	S	.	.	H	α-helix		36	-113.4	105.9	21.2	-29.4	0	0	0	115.3	R1354 R1355 H1356 M1360 R1361 R1362 K1366 S1367	R1354-N1358 VanDerWaalsContact C-CG 3.43Å; R1354-N1358 WeakPolarHBondContact O-CA 2.91Å; R1354-N1358 WeakPolarHBondContact O-CB 3.44Å; R1354-N1358 PolarHBondContact O-N 2.69Å; R1354-N1358 PolarHBondContact O-ND2 2.68Å; R1354-N1358 PolarHBondContact O-OD1 2.8Å; R1355-N1358 CarbonylContact O-C 3.51Å; R1355-N1358 VanDerWaalsContact O-CA 3.27Å; R1355-N1358 WeakPolarHBondContact O-CA 2.91Å; H1356-N1358 CarbonylContact O-C 3.6Å; N1358-M1360 PolarHBondContact O-N 2.66Å; N1358-R1361 PolarHBondContact O-N 2.76Å; N1358-R1362 PolarHBondContact O-N 3.02Å; N1358-K1366 HydrophobicContact CB-CB 3.61Å; N1358-K1366 HydrophobicContact CB-CD 3.83Å; N1358-K1366 HydrophobicContact CB-CG 3.61Å; N1358-K1366 VanDerWaalsContact CG-C 3.49Å; N1358-K1366 VanDerWaalsContact CG-CB 3.41Å; N1358-K1366 PolarHBondContact ND2-O 3.07Å; N1358-K1366 WeakPolarHBondContact O-CE 3.46Å; N1358-K1366 WeakPolarHBondContact O-CG 3.1Å; N1358-K1366 PolarHBondContact O-NZ 2.96Å; N1358-K1366 WeakPolarHBondContact OD1-CA 3.41Å; N1358-K1366 PolarHBondContact OD1-O 2.79Å; N1358-K1366 VanDerWaalsContact OD1-O 3.08Å; N1358-S1367 WeakPolarHBondContact OD1-CA 3.5Å; N1358-S1367 WeakPolarHBondContact OD1-CB 3.47Å; N1358-S1367 PolarHBondContact OD1-N 2.79Å; N1358-S1367 VanDerWaalsContact OD1-N 3.16Å; N1358-S1367 PolarHBondContact OD1-O 2.64Å; N1358-S1367 PolarHBondContact OD1-OG 2.77Å
1359	M	51.4	Low	51.1	Low	147 Å²	147	114.9 Å²	114.9	72%	0.724	49%	0.494	S	S	*	.	H	α-helix	trans	-52.2	-33	179.9	-121.5	65	170	0	0	113.8	R1355 H1356	R1355-M1359 PolarHBondContact O-N 3.34Å; H1356-M1359 PolarHBondContact O-N 2.07Å
1360	M	46.7	Very low	49.1	Very low	151 Å²	151	112 Å²	112	74%	0.744	49%	0.485	S	S	*	.	H	α-helix	trans	-81.4	-32.7	-179.2	-72.1	-65.1	-168.5	0	0	115.1	H1356 R1357 N1358 R1363	H1356-M1360 PolarHBondContact O-N 3.34Å; R1357-M1360 CarbonylContact O-C 3.57Å; R1357-M1360 WeakPolarHBondContact O-CA 3.48Å; R1357-M1360 PolarHBondContact O-N 2.7Å; N1358-M1360 PolarHBondContact O-N 2.66Å; M1360-R1363 PolarHBondContact O-N 3.46Å
1361	R	41	Very low	47.2	Very low	176 Å²	176	111 Å²	111	66%	0.664	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	38.7	174.9	-73.9	-160.2	171.4	174.3	-1.7	113.9	R1357 N1358 R1363 Q1364 Y1365 K1366	R1357-R1361 PolarHBondContact O-N 3.13Å; N1358-R1361 PolarHBondContact O-N 2.76Å; R1361-R1363 VanDerWaalsContact C-N 3.25Å; R1361-R1363 WeakPolarHBondContact CA-O 3.11Å; R1361-R1363 WeakPolarHBondContact CG-O 3.42Å; R1361-Q1364 CarbonylContact O-C 3.49Å; R1361-Q1364 WeakPolarHBondContact O-CA 2.92Å; R1361-Q1364 PolarHBondContact O-N 2.76Å; R1361-Q1364 VanDerWaalsContact O-O 3.04Å; R1361-Y1365 CarbonylContact O-C 3.52Å; R1361-Y1365 WeakPolarHBondContact O-CA 3.33Å; R1361-Y1365 PolarHBondContact O-N 2.84Å; R1361-K1366 VanDerWaalsContact O-CG 3.27Å; R1361-K1366 WeakPolarHBondContact O-CG 3.48Å; R1361-K1366 PolarHBondContact O-N 3.4Å
1362	R	48.7	Very low	45.4	Very low	154 Å²	154	110.9 Å²	110.9	58%	0.581	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn		-102.2	59.5	129	-113.7	178.4	-143.6	168.5	-0.8	103.9	N1358 Y1365 K1366	N1358-R1362 PolarHBondContact O-N 3.02Å; R1362-Y1365 HydrophobicContact CG-CD2 4.42Å; R1362-Y1365 PolarHBondContact NH2-OH 3Å; R1362-K1366 HydrophobicContact CB-CD 3.86Å; R1362-K1366 HydrophobicContact CB-CG 4.01Å; R1362-K1366 HydrophobicContact CG-CD 3.57Å; R1362-K1366 HydrophobicContact CG-CG 3.87Å
1363	R	37.5	Very low	43.4	Very low	218 Å²	218	109.8 Å²	109.8	82%	0.823	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn		-119.6	113.2	79.9	-48.4	160.3	-178.5	164.8	-3.6	113.4	M1360 R1361	M1360-R1363 PolarHBondContact O-N 3.46Å; R1361-R1363 VanDerWaalsContact C-N 3.25Å; R1361-R1363 WeakPolarHBondContact CA-O 3.11Å; R1361-R1363 WeakPolarHBondContact CG-O 3.42Å
1364	Q	34.1	Very low	41.7	Very low	175 Å²	175	108.5 Å²	108.5	82%	0.818	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	cis	-124	149.2	-16.5	-77.3	132.9	-76.4	0	0	109.4	R1361 K1366	R1361-Q1364 CarbonylContact O-C 3.49Å; R1361-Q1364 WeakPolarHBondContact O-CA 2.92Å; R1361-Q1364 PolarHBondContact O-N 2.76Å; R1361-Q1364 VanDerWaalsContact O-O 3.04Å; Q1364-K1366 PolarHBondContact O-N 2.91Å
1365	Y	34.1	Very low	40.2	Very low	178 Å²	178	108.4 Å²	108.4	70%	0.698	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	18.6	65.8	-174.7	-114.8	-99.1	0	0	0	123	R1361 R1362 S1367	R1361-Y1365 CarbonylContact O-C 3.52Å; R1361-Y1365 WeakPolarHBondContact O-CA 3.33Å; R1361-Y1365 PolarHBondContact O-N 2.84Å; R1362-Y1365 HydrophobicContact CG-CD2 4.42Å; R1362-Y1365 PolarHBondContact NH2-OH 3Å; Y1365-S1367 PolarHBondContact O-N 2.7Å
1366	K	40.7	Very low	38.6	Very low	44 Å²	44	102.5 Å²	102.5	19%	0.191	49%	0.489	C	S	.	.				52.5	64.8	114.2	-63	-168	96	72.5	0	118.7	N1358 R1361 R1362 Q1364	N1358-K1366 HydrophobicContact CB-CB 3.61Å; N1358-K1366 HydrophobicContact CB-CD 3.83Å; N1358-K1366 HydrophobicContact CB-CG 3.61Å; N1358-K1366 VanDerWaalsContact CG-C 3.49Å; N1358-K1366 VanDerWaalsContact CG-CB 3.41Å; N1358-K1366 PolarHBondContact ND2-O 3.07Å; N1358-K1366 WeakPolarHBondContact O-CE 3.46Å; N1358-K1366 WeakPolarHBondContact O-CG 3.1Å; N1358-K1366 PolarHBondContact O-NZ 2.96Å; N1358-K1366 WeakPolarHBondContact OD1-CA 3.41Å; N1358-K1366 PolarHBondContact OD1-O 2.79Å; N1358-K1366 VanDerWaalsContact OD1-O 3.08Å; R1361-K1366 VanDerWaalsContact O-CG 3.27Å; R1361-K1366 WeakPolarHBondContact O-CG 3.48Å; R1361-K1366 PolarHBondContact O-N 3.4Å; R1362-K1366 HydrophobicContact CB-CD 3.86Å; R1362-K1366 HydrophobicContact CB-CG 4.01Å; R1362-K1366 HydrophobicContact CG-CD 3.57Å; R1362-K1366 HydrophobicContact CG-CG 3.87Å; Q1364-K1366 PolarHBondContact O-N 2.91Å
1367	S	35.6	Very low	37.3	Very low	33 Å²	33	102.9 Å²	102.9	23%	0.231	50%	0.5	C	S	.	.				37.3	164.7	128.1	133.4	0	0	0	0	120.9	R1354 R1357 N1358 Y1365	R1354-S1367 WeakPolarHBondContact CD-O 3.24Å; R1354-S1367 WeakPolarHBondContact CG-O 3.42Å; R1354-S1367 PolarHBondContact NE-O 2.73Å; R1357-S1367 WeakPolarHBondContact CB-OG 3.48Å; N1358-S1367 WeakPolarHBondContact OD1-CA 3.5Å; N1358-S1367 WeakPolarHBondContact OD1-CB 3.47Å; N1358-S1367 PolarHBondContact OD1-N 2.79Å; N1358-S1367 VanDerWaalsContact OD1-N 3.16Å; N1358-S1367 PolarHBondContact OD1-O 2.64Å; N1358-S1367 PolarHBondContact OD1-OG 2.77Å; Y1365-S1367 PolarHBondContact O-N 2.7Å
1368	D	31.7	Very low	36.2	Very low	59 Å²	59	101.9 Å²	101.9	32%	0.316	51%	0.514	S	S	.	.			cis	105.5	125.8	11.4	-174.2	61.3	0	0	0	118.7	R1354 R1357	R1354-D1368 VanDerWaalsContact CA-O 3.25Å; R1354-D1368 WeakPolarHBondContact CA-O 3.39Å; R1354-D1368 PolarHBondContact N-O 2.8Å; R1354-D1368 VanDerWaalsContact NE-N 3.13Å; R1357-D1368 IonicContact CZ-OD2 2.73Å; R1357-D1368 IonicContact NH1-OD2 3.59Å; R1357-D1368 PolarHBondContact NH1-OD2 3.3Å
1369	Q	33	Very low	35.1	Very low	86 Å²	86	108.3 Å²	108.3	40%	0.402	55%	0.547	S	S	.	.			trans	61.2	141.2	154.3	-80.1	162.2	43.1	0	0	127.8	L1350 R1353 R1354	L1350-Q1369 VanDerWaalsContact CD2-C 3.47Å; L1350-Q1369 VanDerWaalsContact CD2-CA 3.41Å; R1353-Q1369 VanDerWaalsContact CB-O 3.27Å; R1353-Q1369 WeakPolarHBondContact CB-O 3.41Å; R1353-Q1369 WeakPolarHBondContact CD-O 3.44Å; R1353-Q1369 WeakPolarHBondContact CG-O 3.27Å; R1354-Q1369 PolarHBondContact N-O 3.22Å
1370	G	32.8	Very low	34.1	Very low	15 Å²	15	106.4 Å²	106.4	16%	0.155	54%	0.544	C	S	.	.			trans	134	172.9	137.9	0	0	0	0	0	122.1	V1346 F1349 L1350	V1346-G1370 CarbonylContact C-O 3.52Å; F1349-G1370 CarbonylContact C-O 3.48Å; F1349-G1370 CarbonylContact O-C 3.54Å; F1349-G1370 WeakPolarHBondContact O-CA 3.38Å; L1350-G1370 PolarHBondContact N-O 2.79Å
1371	V	29.2	Very low	33	Very low	25 Å²	25	107.1 Å²	107.1	15%	0.152	55%	0.545	C	S	.	.			trans	103.4	-168	151.4	-145.9	0	0	0	0	125.3	I1345 I1348 F1349	I1345-V1371 WeakPolarHBondContact CG2-O 2.96Å; I1345-V1371 WeakPolarHBondContact O-CG2 3.17Å; I1348-V1371 HydrophobicContact CB-CG2 4.29Å; F1349-V1371 VanDerWaalsContact CA-CG2 3.41Å; F1349-V1371 HydrophobicContact CB-CB 3.43Å; F1349-V1371 VanDerWaalsContact CB-CB 3.43Å; F1349-V1371 HydrophobicContact CB-CG1 3.31Å; F1349-V1371 HydrophobicContact CB-CG2 4.16Å; F1349-V1371 HydrophobicContact CD1-CB 3.28Å; F1349-V1371 HydrophobicContact CD1-CG1 3.72Å; F1349-V1371 VanDerWaalsContact CD1-N 3.3Å; F1349-V1371 HydrophobicContact CD2-CB 3.68Å; F1349-V1371 HydrophobicContact CD2-CG1 3.04Å; F1349-V1371 HydrophobicContact CE1-CB 3.85Å; F1349-V1371 HydrophobicContact CE1-CG1 4.24Å; F1349-V1371 VanDerWaalsContact CE1-N 3.28Å; F1349-V1371 HydrophobicContact CE2-CB 4.18Å; F1349-V1371 HydrophobicContact CE2-CG1 3.64Å; F1349-V1371 HydrophobicContact CG-CB 3.13Å; F1349-V1371 HydrophobicContact CG-CG1 3.04Å; F1349-V1371 HydrophobicContact CG-CG2 4.33Å; F1349-V1371 HydrophobicContact CZ-CB 4.25Å; F1349-V1371 HydrophobicContact CZ-CG1 4.19Å; F1349-V1371 VanDerWaalsContact N-CG1 3.31Å
1372	T	36.7	Very low	32.4	Very low	76 Å²	76	105 Å²	105	47%	0.466	54%	0.542	S	S	.	.			trans	-173.6	173.9	-142	26.7	0	0	0	0	113.4	I1345	I1345-T1372 VanDerWaalsContact CG1-C 3.47Å; I1345-T1372 VanDerWaalsContact CG2-N 3.33Å
1373	M	27.2	Very low	31.1	Very low	123 Å²	123	105.6 Å²	105.6	61%	0.606	56%	0.558	S	S	*	*			trans	74.6	117.3	177.6	-32.9	-155.1	81.6	0	0	119.2	I1345	I1345-M1373 WeakPolarHBondContact CG1-O 3.28Å
1374	T	31.3	Very low	30.3	Very low	68 Å²	68	101.1 Å²	101.1	42%	0.417	55%	0.546	S	S	.	.			cis	-114.9	159.3	15.1	43.6	0	0	0	0	113.4	L1341 I1345	L1341-T1374 WeakPolarHBondContact CB-O 3.49Å; L1341-T1374 WeakPolarHBondContact CD1-O 3.14Å; L1341-T1374 WeakPolarHBondContact CD1-OG1 3.2Å; L1341-T1374 WeakPolarHBondContact CD2-OG1 3.16Å; I1345-T1374 VanDerWaalsContact CD1-O 3.27Å; I1345-T1374 WeakPolarHBondContact CD1-O 3.28Å
1375	N	29.5	Very low	29.8	Very low	121 Å²	121	99 Å²	99	65%	0.647	55%	0.545	S	S	*	.			cis	96.2	73.9	27.6	-64.3	16.3	0	0	0	116.2
1376	G	31.6	Very low	29.1	Very low	54 Å²	54	95.2 Å²	95.2	56%	0.557	55%	0.545	S	S	*	.				-128.7	129.2	123.5	0	0	0	0	0	106.2
1377	V	29.5	Very low	28	Very low	136 Å²	136	97.4 Å²	97.4	82%	0.824	56%	0.562	S	S	*	*			cis	69.8	119.8	33.8	-169.5	0	0	0	0	111.4
1378	A	29.8	Very low	27.5	Very low	81 Å²	81	103.8 Å²	103.8	67%	0.669	59%	0.593	S	S	*	*			cis	-105.6	173.8	-2.2	0	0	0	0	0	111
1379	L	26.1	Very low	26.9	Very low	155 Å²	155	108 Å²	108	81%	0.812	61%	0.613	S	S	*	*			cis	-141.4	135.5	24.2	-73.7	160.2	0	0	0	107.6
1380	T	28.8	Very low	26.3	Very low	107 Å²	107	112.1 Å²	112.1	66%	0.656	63%	0.629	S	S	*	*				66.8	121.1	70.3	69.6	0	0	0	0	117.3
1381	H	24.8	Very low	25.7	Very low	165 Å²	165	115.5 Å²	115.5	76%	0.764	65%	0.65	S	S	*	*			trans	79.9	153.4	162	-75.3	-79.6	0	0	0	122.1
1382	H	26.9	Very low	25.7	Very low	131 Å²	131	121 Å²	121	61%	0.606	67%	0.674	S	S	*	*			trans	60	91.1	174.3	-57.2	-62.2	0	0	0	116.3	Q1384	H1382-Q1384 WeakPolarHBondContact CB-O 3.43Å; H1382-Q1384 VanDerWaalsContact ND1-CB 3.27Å; H1382-Q1384 WeakPolarHBondContact ND1-CB 3.37Å; H1382-Q1384 PolarHBondContact ND1-O 2.83Å; H1382-Q1384 VanDerWaalsContact ND1-O 3.13Å
1383	N	22.4	Very low	25.7	Very low	168 Å²	168	125.2 Å²	125.2	90%	0.898	69%	0.693	S	S	*	*	S	Bend		-65.1	98.5	78.5	-164.1	26.1	0	0	0	116.6
1384	Q	20.2	Very low	25.8	Very low	124 Å²	124	126.1 Å²	126.1	58%	0.579	70%	0.696	S	S	*	*			trans	175	110.7	163	-106.2	169.6	-5.4	0	0	103.4	H1382	H1382-Q1384 WeakPolarHBondContact CB-O 3.43Å; H1382-Q1384 VanDerWaalsContact ND1-CB 3.27Å; H1382-Q1384 WeakPolarHBondContact ND1-CB 3.37Å; H1382-Q1384 PolarHBondContact ND1-O 2.83Å; H1382-Q1384 VanDerWaalsContact ND1-O 3.13Å
1385	T	24.5	Very low	25.8	Very low	130 Å²	130	127.2 Å²	127.2	80%	0.798	71%	0.707	S	S	*	*				36.6	87.7	88.1	67.3	0	0	0	0	112.7
1386	S	18.5	Very low	25.7	Very low	99 Å²	99	125.5 Å²	125.5	69%	0.692	70%	0.704	S	S	*	*			trans	-112.4	115.1	140.2	-169.7	0	0	0	0	107.3
1387	T	18.3	Very low	25.6	Very low	89 Å²	89	131.9 Å²	131.9	55%	0.546	72%	0.717	S	S	.	*			trans	50.4	127.3	146.4	57.4	0	0	0	0	118.2	M1389	T1387-M1389 PolarHBondContact O-N 2.68Å
1388	D	24.7	Very low	25.6	Very low	167 Å²	167	131.9 Å²	131.9	89%	0.893	71%	0.711	S	S	*	*				39.8	36.8	68	-71	-37.4	0	0	0	114.7
1389	M	20.2	Very low	25.4	Very low	148 Å²	148	134.1 Å²	134.1	73%	0.729	71%	0.711	S	S	*	*			trans	-118.3	109	154.5	-73	-158.4	73.1	0	0	108.4	T1387	T1387-M1389 PolarHBondContact O-N 2.68Å
1390	K	18.9	Very low	25.6	Very low	173 Å²	173	133.8 Å²	133.8	75%	0.752	71%	0.706	S	S	*	*	S	Bend	cis	-142.1	136.4	12	-124.6	178.4	-177.7	179.3	0	112
1391	S	20.8	Very low	25.5	Very low	85 Å²	85	135 Å²	135	59%	0.594	71%	0.708	S	S	*	*			trans	56.6	133.3	151	51.8	0	0	0	0	119.3
1392	H	29.8	Very low	25.7	Very low	141 Å²	141	133.7 Å²	133.7	65%	0.653	71%	0.707	S	S	*	*			trans	19.8	112.4	133.5	-39	-72.7	0	0	0	115.1	Q1394	H1392-Q1394 PolarHBondContact ND1-OE1 3.14Å
1393	L	36	Very low	25.6	Very low	165 Å²	165	133 Å²	133	86%	0.864	71%	0.707	S	S	*	*			cis	-131.8	127	47.2	-67.3	114.6	0	0	0	110.2
1394	Q	30.2	Very low	25.7	Very low	141 Å²	141	133.5 Å²	133.5	66%	0.659	70%	0.702	S	S	*	*			cis	59.9	135.3	27.3	-158.4	-176.2	8.5	0	0	114.1	H1392	H1392-Q1394 PolarHBondContact ND1-OE1 3.14Å
1395	S	29.7	Very low	25.9	Very low	92 Å²	92	133.5 Å²	133.5	64%	0.643	70%	0.704	S	S	*	*			trans	64.3	117.1	-164.1	63.2	0	0	0	0	113
1396	S	27.5	Very low	26	Very low	85 Å²	85	133.3 Å²	133.3	59%	0.594	70%	0.697	S	S	*	*			cis	81.9	147	40.1	82.1	0	0	0	0	113.7
1397	F	29.3	Very low	26.4	Very low	187 Å²	187	132.5 Å²	132.5	82%	0.82	69%	0.688	S	S	*	*			trans	69	140.5	-170.8	-45.5	-69.9	0	0	0	111.9
1398	I	30.9	Very low	26.8	Very low	137 Å²	137	131.5 Å²	131.5	70%	0.703	68%	0.68	S	S	*	*			cis	-143.8	129.2	4.2	-120.1	148.9	0	0	0	105.2
1399	D	25.9	Very low	27	Very low	127 Å²	127	128.7 Å²	128.7	68%	0.679	66%	0.664	S	S	*	*				78.7	149.6	78.7	-163	18.9	0	0	0	113.1
1400	Q	29.1	Very low	27.3	Very low	149 Å²	149	124.7 Å²	124.7	70%	0.696	65%	0.651	S	S	*	*			trans	72.3	131.9	-172.3	-63.9	147.1	49.8	0	0	114.7
1401	N	26.4	Very low	27.9	Very low	131 Å²	131	122.2 Å²	122.2	70%	0.701	65%	0.65	S	S	*	*				69.3	135.2	55.1	-60.2	-17.4	0	0	0	111.4
1402	D	28.6	Very low	28.2	Very low	138 Å²	138	124.8 Å²	124.8	74%	0.738	66%	0.662	S	S	*	*			cis	-125.9	162.5	20.7	-82.2	-55.5	0	0	0	112.6
1403	N	25.5	Very low	28.3	Very low	116 Å²	116	123.6 Å²	123.6	62%	0.62	67%	0.668	S	S	*	*			cis	73.8	135.5	44.9	-70.3	-46.5	0	0	0	116.1
1404	F	25.4	Very low	28	Very low	179 Å²	179	123 Å²	123	79%	0.785	67%	0.665	S	S	*	*			trans	65.5	159.4	166.3	-77.4	-140	0	0	0	115.4
1405	M	24.3	Very low	28	Very low	125 Å²	125	120 Å²	120	62%	0.616	66%	0.659	S	S	*	*			cis	-153.8	153.1	-22.3	-112.1	-171.6	165.5	0	0	106.6
1406	D	25.7	Very low	28.3	Very low	125 Å²	125	120.2 Å²	120.2	67%	0.668	66%	0.659	S	S	*	*				36.7	123.7	90.9	-91.9	-32.3	0	0	0	117.3
1407	T	26.3	Very low	28.7	Very low	82 Å²	82	124.3 Å²	124.3	50%	0.503	67%	0.668	S	S	.	*			trans	67.5	135.9	150.4	63.6	0	0	0	0	123.1	Q1683	T1407-Q1683 PolarHBondContact O-OE1 2.73Å
1408	D	27.3	Very low	29.3	Very low	69 Å²	69	119.4 Å²	119.4	37%	0.369	66%	0.655	S	S	.	*			trans	54.7	126.5	161.7	-52.8	167	0	0	0	123	Q1683 L1684 R1685	D1408-Q1683 PolarHBondContact O-OE1 3.06Å; D1408-Q1683 VanDerWaalsContact O-OE1 3.1Å; D1408-L1684 WeakPolarHBondContact CA-O 3.07Å; D1408-L1684 WeakPolarHBondContact CB-O 2.97Å; D1408-L1684 VanDerWaalsContact CG-O 3.3Å; D1408-R1685 VanDerWaalsContact CG-NE 3.27Å; D1408-R1685 VanDerWaalsContact CG-NH2 3.33Å; D1408-R1685 IonicContact OD1-CZ 2.73Å; D1408-R1685 IonicContact OD1-NE 3.28Å; D1408-R1685 PolarHBondContact OD1-NE 2.88Å; D1408-R1685 IonicContact OD1-NH2 3.36Å; D1408-R1685 PolarHBondContact OD1-NH2 3.28Å; D1408-R1685 IonicContact OD2-CZ 3.74Å; D1408-R1685 IonicContact OD2-NE 3.96Å; D1408-R1685 PolarHBondContact OD2-NE 3.2Å; D1408-R1685 IonicContact OD2-NH2 2.75Å; D1408-R1685 PolarHBondContact OD2-NH2 2.89Å
1409	I	28.5	Very low	29.4	Very low	107 Å²	107	118.4 Å²	118.4	55%	0.549	65%	0.651	S	S	.	*			cis	-161.1	173.3	20.9	-166.7	151.3	0	0	0	117	L1684	I1409-L1684 WeakPolarHBondContact CA-O 3.5Å; I1409-L1684 VanDerWaalsContact CB-O 3.3Å; I1409-L1684 WeakPolarHBondContact CB-O 3.15Å; I1409-L1684 VanDerWaalsContact CG1-O 3.25Å; I1409-L1684 WeakPolarHBondContact CG1-O 3.06Å
1410	S	26.8	Very low	29.8	Very low	65 Å²	65	122 Å²	122	46%	0.455	66%	0.661	S	S	.	*			trans	-91.3	165.3	-170.6	70.5	0	0	0	0	118.9
1411	T	31.3	Very low	29.8	Very low	120 Å²	120	122 Å²	122	74%	0.736	66%	0.66	S	S	*	*			trans	63.2	121.7	154.4	50.2	0	0	0	0	119.5
1412	T	28.5	Very low	29.8	Very low	140 Å²	140	124.1 Å²	124.1	86%	0.859	66%	0.664	S	S	*	*				-178	-157.1	89.4	33.5	0	0	0	0	111
1413	C	30.4	Very low	29.8	Very low	115 Å²	115	125.1 Å²	125.1	78%	0.777	67%	0.668	S	S	*	*				-158	-166.9	-93.8	-160.1	0	0	0	0	111.3
1414	I	30.7	Very low	30	Very low	153 Å²	153	123.6 Å²	123.6	79%	0.785	67%	0.671	S	S	*	*			trans	77.7	136.8	163	-62	168.7	0	0	0	117.2
1415	C	30.2	Very low	30.1	Very low	79 Å²	79	120.9 Å²	120.9	53%	0.534	68%	0.675	S	S	.	*			cis	-168.7	147.9	-18.4	-103.2	0	0	0	0	114.2
1416	C	35	Very low	30.3	Very low	96 Å²	96	119.7 Å²	119.7	65%	0.649	68%	0.679	S	S	*	*			trans	50.8	167.4	140.8	-56.6	0	0	0	0	122.1
1417	H	37.4	Very low	30.3	Very low	171 Å²	171	116.7 Å²	116.7	79%	0.792	68%	0.677	S	S	*	*			cis	-152.4	-147.1	17.3	-148.4	22.1	0	0	0	115.3
1418	P	41.6	Very low	30.2	Very low	83 Å²	83	122.8 Å²	122.8	54%	0.539	69%	0.693	S	S	.	*				-141.5	-166.9	-124.9	48.6	-28.1	0	0	0	121
1419	N	32.1	Very low	30.1	Very low	117 Å²	117	125.3 Å²	125.3	63%	0.626	71%	0.71	S	S	*	*			trans	105.3	114.6	134.4	-102.3	-30.7	0	0	0	123.7
1420	K	34	Very low	29.8	Very low	203 Å²	203	129.4 Å²	129.4	88%	0.883	72%	0.724	S	S	*	*				162.4	105.9	128.5	-89.4	160.6	-175.4	172.2	0	109.1
1421	Q	29.6	Very low	29.6	Very low	147 Å²	147	130.1 Å²	130.1	69%	0.687	73%	0.734	S	S	*	*				83.9	139.9	52.1	-71.8	-155.5	-0.3	0	0	116.9
1422	K	27.4	Very low	29.3	Very low	177 Å²	177	131 Å²	131	77%	0.77	73%	0.734	S	S	*	*			trans	82.1	137.2	164.2	-54	-160.2	175.9	-179.8	0	116.7
1423	L	27	Very low	29.1	Very low	159 Å²	159	129.6 Å²	129.6	83%	0.832	73%	0.73	S	S	*	*			cis	-155.4	175.1	-5.3	-148.3	64.8	0	0	0	112.5
1424	A	31.6	Very low	28.9	Very low	83 Å²	83	133.8 Å²	133.8	69%	0.686	73%	0.731	S	S	*	*			trans	72.1	108.9	174.3	0	0	0	0	0	116
1425	S	26.9	Very low	28.7	Very low	122 Å²	122	129 Å²	129	85%	0.853	72%	0.719	S	S	*	*			cis	76.2	132	40	85.4	0	0	0	0	113.8
1426	S	29	Very low	28.6	Very low	100 Å²	100	132 Å²	132	70%	0.699	73%	0.73	S	S	*	*			cis	-136.6	157.5	13.2	-173.9	0	0	0	0	109
1427	G	25.2	Very low	28.1	Very low	62 Å²	62	135.9 Å²	135.9	64%	0.639	74%	0.736	S	S	*	*			cis	88	133.3	31.8	0	0	0	0	0	109.6
1428	Y	24.8	Very low	27.5	Very low	211 Å²	211	132.4 Å²	132.4	83%	0.827	73%	0.731	S	S	*	*			cis	-153.8	161.8	27.6	-103	-110	0	0	0	112.1
1429	V	23.9	Very low	26.7	Very low	122 Å²	122	138.4 Å²	138.4	74%	0.739	74%	0.743	S	S	*	*			trans	67.9	124	151.1	163.8	0	0	0	0	116.9
1430	K	22.5	Very low	26.4	Very low	192 Å²	192	136.9 Å²	136.9	84%	0.835	74%	0.738	S	S	*	*			cis	82.6	147.1	40.5	-166.8	178.1	-178.6	177.6	0	112.3
1431	A	23.2	Very low	26	Very low	80 Å²	80	134.3 Å²	134.3	66%	0.661	73%	0.729	S	S	*	*			trans	71.3	142	-168.9	0	0	0	0	0	113.9
1432	D	24.1	Very low	25.9	Very low	140 Å²	140	130.1 Å²	130.1	75%	0.749	73%	0.725	S	S	*	*			cis	-148.4	160	-7.3	-107.3	-17.4	0	0	0	112.1	Y1434	D1432-Y1434 HydrophobicContact CB-CD2 4.21Å; D1432-Y1434 HydrophobicContact CB-CE2 4.43Å
1433	S	25.7	Very low	26	Very low	110 Å²	110	126.7 Å²	126.7	77%	0.769	71%	0.708	S	S	*	*			trans	-86.4	120.9	165.7	179.9	0	0	0	0	109.8
1434	Y	24.3	Very low	26.3	Very low	203 Å²	203	123.2 Å²	123.2	80%	0.796	70%	0.702	S	S	*	*			trans	-136.4	86.3	166	-92.7	-78.6	0	0	0	111.3	D1432	D1432-Y1434 HydrophobicContact CB-CD2 4.21Å; D1432-Y1434 HydrophobicContact CB-CE2 4.43Å
1435	G	26.9	Very low	26.7	Very low	52 Å²	52	124.1 Å²	124.1	54%	0.536	70%	0.701	S	S	.	*			trans	-88.1	158.6	151.8	0	0	0	0	0	110.6
1436	N	29	Very low	26.7	Very low	143 Å²	143	125.5 Å²	125.5	77%	0.765	69%	0.694	S	S	*	*			trans	66.7	152.3	-178.2	-55.3	-36.2	0	0	0	113.4
1437	F	24	Very low	26.7	Very low	176 Å²	176	126.7 Å²	126.7	77%	0.772	69%	0.692	S	S	*	*			cis	-125.5	163.3	26.7	-81.3	-103.5	0	0	0	111.8
1438	S	23.8	Very low	26.8	Very low	99 Å²	99	130.8 Å²	130.8	69%	0.692	70%	0.698	S	S	*	*	S	Bend	cis	-157.4	161.9	36.9	79.7	0	0	0	0	111.9
1439	R	25.5	Very low	27.6	Very low	209 Å²	209	125.1 Å²	125.1	79%	0.789	69%	0.688	S	S	*	*			cis	-158.2	126.1	13.4	-130.3	147.9	-166.7	-155.3	5.3	110.5
1440	T	25.5	Very low	28.1	Very low	85 Å²	85	124.3 Å²	124.3	52%	0.521	69%	0.685	S	S	.	*			trans	37	129.4	131.8	60.5	0	0	0	0	120.3
1441	H	26.7	Very low	28.7	Very low	148 Å²	148	119.8 Å²	119.8	69%	0.685	68%	0.678	S	S	*	*			cis	-155.7	171.2	4.4	-69	-78.5	0	0	0	108.3
1442	G	26.9	Very low	29.3	Very low	60 Å²	60	123.5 Å²	123.5	62%	0.619	68%	0.682	S	S	*	*			cis	111.8	93.8	-8.5	0	0	0	0	0	116.8
1443	Y	29.5	Very low	29.6	Very low	105 Å²	105	121.8 Å²	121.8	41%	0.412	68%	0.68	S	S	.	*			trans	-130.8	159.5	165.6	-99.3	-74.7	0	0	0	113.8	L1634 P1635 Y1636 S1637	Y1443-L1634 HydrophobicContact CD2-CB 4.39Å; Y1443-L1634 VanDerWaalsContact CE2-CA 3.44Å; Y1443-L1634 HydrophobicContact CE2-CB 3.42Å; Y1443-L1634 VanDerWaalsContact CE2-CB 3.42Å; Y1443-L1634 HydrophobicContact CE2-CD2 4.01Å; Y1443-L1634 HydrophobicContact CE2-CG 3.8Å; Y1443-L1634 WeakPolarHBondContact OH-CD2 3.13Å; Y1443-P1635 HydrophobicContact CD1-CG 3.73Å; Y1443-P1635 HydrophobicContact CE1-CG 3.98Å; Y1443-P1635 WeakPolarHBondContact CE1-O 3.43Å; Y1443-P1635 HydrophobicContact CG-CG 4.33Å; Y1443-Y1636 VanDerWaalsContact CE1-O 3.23Å; Y1443-Y1636 WeakPolarHBondContact CE1-O 3.19Å; Y1443-Y1636 WeakPolarHBondContact OH-CA 3.39Å; Y1443-Y1636 PolarHBondContact OH-N 3.16Å; Y1443-Y1636 VanDerWaalsContact OH-N 3.11Å; Y1443-Y1636 PolarHBondContact OH-O 3.01Å; Y1443-S1637 PolarHBondContact OH-N 3.47Å
1444	A	32.7	Very low	30.2	Very low	85 Å²	85	121.5 Å²	121.5	70%	0.702	68%	0.675	S	S	*	*			trans	-156.9	-165.3	-168.1	0	0	0	0	0	109.7
1445	P	39.9	Very low	30.2	Very low	102 Å²	102	120.1 Å²	120.1	66%	0.662	68%	0.676	S	S	*	*			cis	-136.6	177.6	-11	35.1	-14.4	0	0	0	115.6
1446	H	28.1	Very low	30.2	Very low	152 Å²	152	125.2 Å²	125.2	70%	0.704	68%	0.68	S	S	*	*				166.3	140.9	123.1	-98.8	-79.9	0	0	0	116.1
1447	D	28.1	Very low	30.3	Very low	124 Å²	124	124.4 Å²	124.4	66%	0.663	67%	0.674	S	S	*	*			trans	60.3	144.8	142.8	-59.8	-5.7	0	0	0	123.8
1448	I	28.4	Very low	30.8	Very low	148 Å²	148	120.6 Å²	120.6	76%	0.759	67%	0.668	S	S	*	*			cis	-163.7	157.3	-23.1	-117.8	163.3	0	0	0	110
1449	C	40.6	Very low	31.3	Very low	92 Å²	92	121.4 Å²	121.4	62%	0.622	67%	0.669	S	S	*	*			trans	-111.1	172.3	178.3	-60.2	0	0	0	0	114.3
1450	P	33.9	Very low	31.5	Very low	105 Å²	105	117.7 Å²	117.7	68%	0.682	66%	0.664	S	S	*	*			trans	-144.4	166.1	139.2	38.1	-23.9	0	0	0	115.7
1451	S	35.5	Very low	31.9	Very low	98 Å²	98	119.8 Å²	119.8	69%	0.685	68%	0.677	S	S	*	*			cis	-177.1	123.1	-35.5	55	0	0	0	0	113.8
1452	Q	35.4	Very low	32.2	Very low	158 Å²	158	118.4 Å²	118.4	74%	0.738	67%	0.674	S	S	*	*			trans	57.6	-176.3	147.1	-51.4	-171.5	-0.2	0	0	118.8
1453	C	31.2	Very low	32.4	Very low	103 Å²	103	121.9 Å²	121.9	70%	0.696	68%	0.675	S	S	*	*			cis	-159	-168.8	7.3	-140.8	0	0	0	0	108.3
1454	P	37.3	Very low	32.5	Very low	105 Å²	105	125.2 Å²	125.2	68%	0.682	69%	0.694	S	S	*	*			cis	-129.2	-177	-13.2	44.2	-26	0	0	0	113.7
1455	Q	26.1	Very low	32.4	Very low	173 Å²	173	124.5 Å²	124.5	81%	0.808	70%	0.695	S	S	*	*				-163.7	132.7	84	-86.1	-169.9	-5	0	0	113.6
1456	Y	26.7	Very low	32	Very low	159 Å²	159	127.8 Å²	127.8	62%	0.624	70%	0.701	S	S	*	*			trans	50.7	143.1	140.4	-86.2	-118.5	0	0	0	122.2
1457	I	30.9	Very low	32	Very low	126 Å²	126	127.3 Å²	127.3	65%	0.646	70%	0.703	S	S	*	*			cis	-176.7	162	-23.7	-136.1	165.2	0	0	0	107.6
1458	P	34.7	Very low	31.9	Very low	97 Å²	97	128.6 Å²	128.6	63%	0.63	71%	0.707	S	S	*	*			cis	-100.6	-135.8	-19.7	22.3	1.6	0	0	0	109.6
1459	T	33	Very low	31.8	Very low	116 Å²	116	127.4 Å²	127.4	71%	0.712	70%	0.702	S	S	*	*			cis	-158.4	-173.2	8.2	-22.8	0	0	0	0	110.9
1460	D	31.3	Very low	31.4	Very low	131 Å²	131	130.1 Å²	130.1	70%	0.701	71%	0.705	S	S	*	*				-145.7	-178.3	-120.3	-52.4	-56.6	0	0	0	110.7
1461	V	32.6	Very low	31	Very low	129 Å²	129	131.4 Å²	131.4	78%	0.782	71%	0.706	S	S	*	*			trans	71.1	136.4	160.9	167.1	0	0	0	0	116
1462	D	32.7	Very low	30.6	Very low	119 Å²	119	133.8 Å²	133.8	64%	0.636	71%	0.71	S	S	*	*			cis	-173.1	175.2	-6.1	-113.7	15.4	0	0	0	109.2
1463	Q	32.7	Very low	30.2	Very low	133 Å²	133	131.8 Å²	131.8	62%	0.621	71%	0.709	S	S	*	*			cis	-164.7	163.3	-26.1	-133.5	-167.5	103.6	0	0	109.5
1464	Q	30.9	Very low	29.9	Very low	174 Å²	174	131.7 Å²	131.7	81%	0.813	71%	0.709	S	S	*	*			trans	62.6	148.6	158.4	-62.8	177.3	21.9	0	0	121.1
1465	G	30.7	Very low	29.5	Very low	70 Å²	70	131.1 Å²	131.1	72%	0.722	71%	0.708	S	S	*	*			trans	163.6	22.4	166.6	0	0	0	0	0	125.2
1466	H	32	Very low	29.8	Very low	172 Å²	172	126.3 Å²	126.3	80%	0.796	69%	0.687	S	S	*	*			trans	48.6	107.1	160.2	-75.1	-87.8	0	0	0	123.6
1467	L	28.4	Very low	30.3	Very low	141 Å²	141	122.3 Å²	122.3	74%	0.738	68%	0.681	S	S	*	*				62.4	140.8	110.7	-91.7	158.1	0	0	0	125.5
1468	M	26	Very low	30.4	Very low	151 Å²	151	120.4 Å²	120.4	74%	0.744	67%	0.672	S	S	*	*			trans	97.4	106	148.9	-74.8	-171.5	178.6	0	0	123.6
1469	N	26.3	Very low	30.2	Very low	124 Å²	124	122.4 Å²	122.4	66%	0.663	67%	0.671	S	S	*	*				77.8	147.4	123	-68.5	12.6	0	0	0	125.3
1470	H	30.9	Very low	30.2	Very low	149 Å²	149	120.7 Å²	120.7	69%	0.69	66%	0.657	S	S	*	*			trans	87.2	100.7	149.9	-69.1	-49.3	0	0	0	122.9
1471	N	26.3	Very low	30.4	Very low	132 Å²	132	120.7 Å²	120.7	71%	0.706	65%	0.653	S	S	*	*				73.8	145	114.5	-70.8	9.3	0	0	0	124
1472	I	27.4	Very low	30.2	Very low	147 Å²	147	119.1 Å²	119.1	75%	0.754	64%	0.64	S	S	*	*			trans	92	101.2	144	-73.7	157	0	0	0	121.1
1473	T	25.8	Very low	30.1	Very low	117 Å²	117	118.6 Å²	118.6	72%	0.718	64%	0.641	S	S	*	*			trans	63.3	125.9	136.1	66.9	0	0	0	0	126.8
1474	S	25.4	Very low	30	Very low	100 Å²	100	115.2 Å²	115.2	70%	0.699	63%	0.632	S	S	*	*				82.6	106.2	122.6	69.7	0	0	0	0	126.5
1475	S	29.1	Very low	30	Very low	94 Å²	94	111.9 Å²	111.9	66%	0.657	62%	0.62	S	S	*	*				73.7	133.2	116.4	71.1	0	0	0	0	127.6
1476	N	31.2	Very low	30	Very low	71 Å²	71	114.9 Å²	114.9	38%	0.38	62%	0.615	S	S	.	*			trans	88.4	159.1	137.8	-86.5	33.4	0	0	0	123.7	T517	T517-N1476 VanDerWaalsContact CG2-ND2 3.33Å; T517-N1476 WeakPolarHBondContact CG2-ND2 3.47Å
1477	P	38	Very low	29.7	Very low	75 Å²	75	114 Å²	114	49%	0.487	61%	0.613	S	S	.	*			trans	-136.7	-157.3	-143.2	42.7	-21	0	0	0	118.2
1478	D	33.5	Very low	29.7	Very low	87 Å²	87	112.9 Å²	112.9	47%	0.465	61%	0.612	S	S	.	*			trans	105.1	138	141.3	-85.5	15	0	0	0	128.5	Y526	Y526-D1478 PolarHBondContact OH-OD2 3.15Å
1479	F	30.9	Very low	29.9	Very low	138 Å²	138	111 Å²	111	61%	0.605	61%	0.609	S	S	*	*			trans	56.6	113.1	148.7	-83	-117.6	0	0	0	128.3
1480	N	33.1	Very low	30	Very low	80 Å²	80	109.4 Å²	109.4	43%	0.428	61%	0.608	S	S	.	*				50.7	141.1	113	-78.9	-37.3	0	0	0	128.6
1481	H	33.7	Very low	29.8	Very low	132 Å²	132	113 Å²	113	61%	0.611	62%	0.617	S	S	*	*				113.2	116.3	127.3	-84.9	-23.1	0	0	0	124.9
1482	L	30.2	Very low	30.4	Very low	95 Å²	95	111 Å²	111	50%	0.497	61%	0.611	S	S	.	*			trans	71.7	178.6	136.1	-63.2	171.5	0	0	0	117
1483	T	30.8	Very low	30.5	Very low	109 Å²	109	110 Å²	110	67%	0.669	61%	0.612	S	S	*	*			cis	-151.4	152.9	11.8	-36	0	0	0	0	113.5
1484	S	30.1	Very low	30.8	Very low	61 Å²	61	111.9 Å²	111.9	43%	0.427	61%	0.606	S	S	.	*			trans	68.2	-179.7	160.2	-131.8	0	0	0	0	115.5
1485	N	30.7	Very low	31	Very low	105 Å²	105	113.4 Å²	113.4	56%	0.561	60%	0.602	S	S	*	*			cis	-151.7	179.4	-5.3	-140.7	-15.6	0	0	0	107.2
1486	Q	29.5	Very low	30.9	Very low	132 Å²	132	115.4 Å²	115.4	62%	0.617	60%	0.604	S	S	*	*			cis	-156.9	-176	-4.8	-159.4	175.4	104.9	0	0	108.3
1487	M	27.1	Very low	30.7	Very low	153 Å²	153	117.7 Å²	117.7	75%	0.754	62%	0.621	S	S	*	*			trans	66.9	-159.5	157.7	-68.8	-162.9	175	0	0	116.8
1488	T	28.5	Very low	30.1	Very low	118 Å²	118	119.5 Å²	119.5	72%	0.724	64%	0.636	S	S	*	*				-129.9	-172.5	-104.6	51.5	0	0	0	0	109.4
1489	T	29.1	Very low	30.1	Very low	111 Å²	111	120.7 Å²	120.7	68%	0.681	65%	0.648	S	S	*	*			cis	-156.2	161.8	12.8	-31.7	0	0	0	0	109.9
1490	S	28.9	Very low	29.9	Very low	92 Å²	92	121.4 Å²	121.4	64%	0.643	66%	0.658	S	S	*	*			trans	59.2	179.2	164.7	47.6	0	0	0	0	116.5
1491	Y	26	Very low	30	Very low	225 Å²	225	121.8 Å²	121.8	88%	0.882	67%	0.665	S	S	*	*				-141.6	164.2	-53	-90.9	-35.1	0	0	0	109.1
1492	P	39.5	Very low	29.6	Very low	88 Å²	88	125.8 Å²	125.8	57%	0.571	68%	0.676	S	S	*	*			trans	-132.9	174.3	-148.9	42.1	-26.9	0	0	0	117	T1561	P1492-T1561 HydrophobicContact CG-CG2 3.78Å
1493	V	29.9	Very low	29.4	Very low	128 Å²	128	126.2 Å²	126.2	78%	0.776	67%	0.672	S	S	*	*				-174	166.9	128	143.2	0	0	0	0	112.5
1494	R	31.9	Very low	29.1	Very low	155 Å²	155	126.9 Å²	126.9	59%	0.585	67%	0.671	S	S	*	*			trans	-86.1	-173.4	-161.8	-43.7	165.2	-173.5	-175.5	-2.1	113.3	G1560	R1494-G1560 PolarHBondContact NH2-O 3.08Å
1495	H	29.6	Very low	29	Very low	133 Å²	133	130.9 Å²	130.9	62%	0.616	69%	0.688	S	S	*	*			cis	-168.5	148.6	31	-107.1	-61.5	0	0	0	114.4
1496	L	26.7	Very low	28.7	Very low	135 Å²	135	132.3 Å²	132.3	71%	0.707	70%	0.7	S	S	*	*			trans	74.1	113.5	136.3	-66.6	166.5	0	0	0	127.1
1497	T	26	Very low	28.5	Very low	119 Å²	119	133.7 Å²	133.7	73%	0.73	71%	0.711	S	S	*	*				61	117	127.1	58	0	0	0	0	126.6
1498	S	27.3	Very low	28.4	Very low	114 Å²	114	132.8 Å²	132.8	80%	0.797	71%	0.71	S	S	*	*				48.7	161.4	117.8	-117.2	0	0	0	0	123
1499	P	33	Very low	28.1	Very low	111 Å²	111	138.1 Å²	138.1	72%	0.721	72%	0.718	S	S	*	*			cis	-143.4	159.9	3.2	42.4	-23.4	0	0	0	119.5
1500	N	27.1	Very low	27.9	Very low	154 Å²	154	137.4 Å²	137.4	82%	0.824	72%	0.715	S	S	*	*			trans	64.8	-169.5	144.4	-140	21.7	0	0	0	119.5
1501	P	34.2	Very low	27.7	Very low	87 Å²	87	140.9 Å²	140.9	57%	0.565	72%	0.723	S	S	*	*				-115.3	-174.7	-102.6	35	-18.4	0	0	0	117.3
1502	Y	24.4	Very low	27.6	Very low	216 Å²	216	135.6 Å²	135.6	85%	0.847	72%	0.715	S	S	*	*			trans	70.6	112.9	173.2	-66.9	-83.5	0	0	0	117.7
1503	Y	26.5	Very low	26.9	Very low	104 Å²	104	141.5 Å²	141.5	41%	0.408	73%	0.725	S	S	.	*				-159.9	-173.8	125.1	-132.7	-21	0	0	0	115.5	A921 G922 S923 V924 E926	A921-Y1503 PolarHBondContact O-OH 2.87Å; G922-Y1503 WeakPolarHBondContact CA-OH 3.12Å; G922-Y1503 PolarHBondContact O-OH 3.43Å; S923-Y1503 VanDerWaalsContact C-CE2 3.46Å; S923-Y1503 VanDerWaalsContact C-CZ 3.48Å; S923-Y1503 WeakPolarHBondContact CA-OH 3.5Å; S923-Y1503 WeakPolarHBondContact CB-OH 3.13Å; S923-Y1503 PolarHBondContact N-OH 2.91Å; S923-Y1503 WeakPolarHBondContact OG-CD1 3.39Å; S923-Y1503 WeakPolarHBondContact OG-CD2 3.42Å; S923-Y1503 WeakPolarHBondContact OG-CE1 3.41Å; S923-Y1503 WeakPolarHBondContact OG-CE2 3.19Å; S923-Y1503 PolarHBondContact OG-OH 3.1Å; V924-Y1503 HydrophobicContact CB-CE2 4.3Å; V924-Y1503 HydrophobicContact CG1-CE2 4.28Å; V924-Y1503 HydrophobicContact CG2-CE2 3.92Å; V924-Y1503 VanDerWaalsContact N-CZ 3.29Å; V924-Y1503 PolarHBondContact N-OH 2.81Å; E926-Y1503 VanDerWaalsContact CD-CE2 3.43Å; E926-Y1503 VanDerWaalsContact CD-CZ 3.44Å; E926-Y1503 WeakPolarHBondContact OE1-CE2 3.37Å; E926-Y1503 PolarHBondContact OE1-OH 2.98Å; E926-Y1503 WeakPolarHBondContact OE2-CE2 3.36Å; E926-Y1503 PolarHBondContact OE2-OH 3.23Å
1504	N	26.1	Very low	26.7	Very low	124 Å²	124	144 Å²	144	66%	0.663	73%	0.728	S	S	*	*			trans	-135.8	165.8	179.7	-87.7	-26.8	0	0	0	109.7
1505	N	26.3	Very low	26.4	Very low	144 Å²	144	139.8 Å²	139.8	77%	0.77	73%	0.733	S	S	*	*			trans	50.4	92.8	153.7	-61.2	-13.8	0	0	0	119.9
1506	T	24.8	Very low	26.5	Very low	135 Å²	135	137.9 Å²	137.9	83%	0.828	74%	0.735	S	S	*	*				-168.3	164.4	122	15.1	0	0	0	0	112
1507	L	25.2	Very low	26.7	Very low	161 Å²	161	136.1 Å²	136.1	84%	0.843	73%	0.73	S	S	*	*			trans	-62.4	133.2	-176.5	-64.9	85.9	0	0	0	112.3
1508	N	24.8	Very low	26.7	Very low	135 Å²	135	135.3 Å²	135.3	72%	0.722	72%	0.718	S	S	*	*			trans	-153.9	121.4	153.8	-99	-50.2	0	0	0	112.4	P1510	N1508-P1510 WeakPolarHBondContact O-CD 3.46Å
1509	Y	22.9	Very low	26.9	Very low	230 Å²	230	138.5 Å²	138.5	90%	0.902	73%	0.725	S	S	*	*			trans	-90.3	119.4	151	-93.2	-94.8	0	0	0	107.7
1510	P	25.6	Very low	26.8	Very low	95 Å²	95	136.4 Å²	136.4	62%	0.617	72%	0.723	S	S	*	*			trans	-131.6	143	152.3	32.7	-17.9	0	0	0	112.2	N1508	N1508-P1510 WeakPolarHBondContact O-CD 3.46Å
1511	M	23.8	Very low	26.9	Very low	166 Å²	166	136.9 Å²	136.9	82%	0.818	72%	0.724	S	S	*	*			trans	-80.9	142.4	172.7	-94.2	-169.4	168.7	0	0	112.3
1512	T	24.4	Very low	26.6	Very low	114 Å²	114	138.5 Å²	138.5	70%	0.699	73%	0.732	S	S	*	*			trans	73.5	120.7	146.3	51.6	0	0	0	0	122.7
1513	R	24.3	Very low	26.7	Very low	211 Å²	211	137.6 Å²	137.6	80%	0.796	73%	0.728	S	S	*	*			trans	70.2	113.7	135.6	-64.4	176	175.5	-173.5	1.7	120.7
1514	H	25.3	Very low	26.7	Very low	181 Å²	181	138.1 Å²	138.1	84%	0.838	75%	0.747	S	S	*	*				175.4	139	88.3	-100.6	-75.4	0	0	0	113.9
1515	G	26.6	Very low	26.7	Very low	67 Å²	67	137.7 Å²	137.7	69%	0.691	75%	0.754	S	S	*	*			trans	108.3	94.9	142.2	0	0	0	0	0	121.8
1516	S	30.8	Very low	26.9	Very low	92 Å²	92	135.1 Å²	135.1	64%	0.643	75%	0.753	S	S	*	*			trans	13	146.7	130.4	53.5	0	0	0	0	121.6
1517	T	31.4	Very low	27	Very low	98 Å²	98	135.4 Å²	135.4	60%	0.601	75%	0.749	S	S	*	*			cis	-161.6	166.5	-0.6	21.5	0	0	0	0	107.8	Y1620	T1517-Y1620 PolarHBondContact OG1-O 2.81Å
1518	E	26.7	Very low	27.5	Very low	103 Å²	103	133.5 Å²	133.5	48%	0.481	75%	0.747	S	S	.	*				176.7	145.4	82.5	-89.3	170.6	-160.3	0	0	112.9	Q1618 Q1619 Y1620	E1518-Q1618 VanDerWaalsContact OE2-C 3.29Å; E1518-Q1619 VanDerWaalsContact CD-N 3.27Å; E1518-Q1619 VanDerWaalsContact OE1-CA 3.23Å; E1518-Q1619 WeakPolarHBondContact OE1-CA 3.36Å; E1518-Q1619 PolarHBondContact OE1-N 2.99Å; E1518-Q1619 VanDerWaalsContact OE1-N 3.11Å; E1518-Q1619 PolarHBondContact OE2-N 2.98Å; E1518-Y1620 WeakPolarHBondContact CG-O 3.46Å; E1518-Y1620 PolarHBondContact OE1-N 2.79Å
1519	L	30.1	Very low	27.6	Very low	181 Å²	181	132 Å²	132	95%	0.948	74%	0.742	S	S	*	*			trans	-174.8	153.4	141.8	-104.7	168.1	0	0	0	108.4
1520	G	30.4	Very low	28	Very low	66 Å²	66	127.2 Å²	127.2	68%	0.68	73%	0.732	S	S	*	*			trans	-172.1	180	-175.2	0	0	0	0	0	116.4
1521	I	30	Very low	28	Very low	164 Å²	164	129.6 Å²	129.6	84%	0.841	74%	0.735	S	S	*	*			trans	-175.6	145.3	175.3	-107	151.6	0	0	0	110
1522	V	27.7	Very low	28.2	Very low	121 Å²	121	128.4 Å²	128.4	73%	0.733	73%	0.731	S	S	*	*				-116.2	-90.9	-53.2	-168	0	0	0	0	109.8
1523	Y	27.6	Very low	28.4	Very low	197 Å²	197	132.3 Å²	132.3	77%	0.773	73%	0.733	S	S	*	*			cis	-157.1	106.1	-23.5	-145.2	-49.3	0	0	0	112
1524	S	26.1	Very low	28.6	Very low	115 Å²	115	128.4 Å²	128.4	80%	0.804	72%	0.724	S	S	*	*			trans	63.7	139.9	176.4	80.2	0	0	0	0	116.9
1525	S	26.5	Very low	28.8	Very low	115 Å²	115	126.7 Å²	126.7	80%	0.804	72%	0.716	S	S	*	*			cis	-147.7	-160.9	3.8	50.5	0	0	0	0	108.7
1526	A	29.9	Very low	29.1	Very low	90 Å²	90	132 Å²	132	74%	0.744	72%	0.722	S	S	*	*			cis	-158.7	-158.8	12.5	0	0	0	0	0	112.1
1527	N	27.8	Very low	29.3	Very low	142 Å²	142	130.9 Å²	130.9	76%	0.759	73%	0.725	S	S	*	*			trans	-100.4	167.6	172.1	-89.7	-35.8	0	0	0	111.1
1528	P	34.2	Very low	29.3	Very low	121 Å²	121	132.2 Å²	132.2	79%	0.786	74%	0.739	S	S	*	*			cis	-116.1	156	23.7	11.5	14.2	0	0	0	114.7
1529	V	27.1	Very low	29.6	Very low	104 Å²	104	134.7 Å²	134.7	63%	0.63	75%	0.754	S	S	*	*				89	134.7	51.3	172.3	0	0	0	0	114.3
1530	N	30.9	Very low	29.7	Very low	129 Å²	129	134.9 Å²	134.9	69%	0.69	75%	0.747	S	S	*	*			trans	75	148.9	172.3	-72.8	-12.2	0	0	0	119.1
1531	Q	26.7	Very low	29.9	Very low	145 Å²	145	140 Å²	140	68%	0.678	75%	0.753	S	S	*	*			cis	-175.4	150.3	-27	-119.7	179.7	23.3	0	0	110.5
1532	L	26.9	Very low	30	Very low	140 Å²	140	136.2 Å²	136.2	73%	0.733	74%	0.741	S	S	*	*			trans	66.5	161.9	152	-58.1	165	0	0	0	118.7
1533	R	28.6	Very low	30.3	Very low	197 Å²	197	136.6 Å²	136.6	74%	0.743	74%	0.744	S	S	*	*			cis	-176.1	154.8	-31.2	-156.2	-178.6	-173.6	-156.9	12.6	110.7
1534	H	29.9	Very low	30.5	Very low	128 Å²	128	137.8 Å²	137.8	59%	0.593	75%	0.747	S	S	*	*			trans	66.1	163.5	166.5	-55.7	-73.4	0	0	0	119.1
1535	E	29.4	Very low	31	Very low	145 Å²	145	142.4 Å²	142.4	68%	0.678	75%	0.748	S	S	*	*			cis	-165.7	162.9	-24.3	-107.6	170.4	-156.7	0	0	115.4
1536	H	33.5	Very low	31.3	Very low	178 Å²	178	139.9 Å²	139.9	82%	0.824	74%	0.74	S	S	*	*			trans	37.8	146.9	152.3	-66.8	-63.2	0	0	0	127.2
1537	G	34.5	Very low	31.4	Very low	69 Å²	69	144 Å²	144	71%	0.711	74%	0.744	S	S	*	*			trans	155.8	74.6	141.9	0	0	0	0	0	127
1538	S	31.8	Very low	31.7	Very low	127 Å²	127	144.3 Å²	144.3	89%	0.888	74%	0.741	S	S	*	*			trans	77.2	-178.3	140.9	85.2	0	0	0	0	125.2
1539	I	31.5	Very low	31.5	Very low	154 Å²	154	144.4 Å²	144.4	79%	0.79	74%	0.739	S	S	*	*			trans	-156.4	154.9	-144.2	-74.9	158.9	0	0	0	114.1
1540	K	32.7	Very low	31.7	Very low	185 Å²	185	144.9 Å²	144.9	80%	0.804	75%	0.745	S	S	*	*			trans	-171.9	125.9	141	-105.4	155.9	-175.7	177.3	0	118.2
1541	H	34	Very low	31.6	Very low	175 Å²	175	147 Å²	147	81%	0.81	74%	0.743	S	S	*	*			trans	68.5	166.2	149	-77.5	-132.2	0	0	0	120
1542	S	33.1	Very low	31.7	Very low	84 Å²	84	148.8 Å²	148.8	59%	0.587	75%	0.751	S	S	*	*			cis	-174.4	155.4	-28.9	175.5	0	0	0	0	113.2
1543	T	33.7	Very low	32.1	Very low	128 Å²	128	147.2 Å²	147.2	79%	0.785	75%	0.749	S	S	*	*			trans	67.1	170.5	155	30.5	0	0	0	0	119.4
1544	R	32.4	Very low	32.1	Very low	222 Å²	222	142.2 Å²	142.2	84%	0.838	74%	0.737	S	S	*	*			cis	-132.7	-93.4	4.1	-142	-165.6	-174	-156.1	1.4	116.7
1545	Y	35.5	Very low	32.4	Very low	212 Å²	212	142.3 Å²	142.3	83%	0.831	74%	0.738	S	S	*	*			trans	-141.4	148.4	-168.8	-88	-82.9	0	0	0	113.3
1546	G	33.4	Very low	32.7	Very low	62 Å²	62	140.6 Å²	140.6	64%	0.639	74%	0.742	S	S	*	*			cis	177.2	167.2	-7.5	0	0	0	0	0	116.5
1547	Q	32	Very low	32.4	Very low	178 Å²	178	144.2 Å²	144.2	83%	0.832	75%	0.748	S	S	*	*			trans	66.1	138.6	169.7	-66.3	172.2	-13.1	0	0	117
1548	H	33.2	Very low	32	Very low	148 Å²	148	150.3 Å²	150.3	69%	0.685	75%	0.752	S	S	*	*			cis	-142.6	130.4	18.6	-133.3	-78.9	0	0	0	114.3
1549	T	30.8	Very low	31.8	Very low	123 Å²	123	154.5 Å²	154.5	76%	0.755	75%	0.749	S	S	*	*			trans	63.8	150	155.1	36.4	0	0	0	0	121.9
1550	P	30.8	Very low	31.5	Very low	114 Å²	114	149.6 Å²	149.6	74%	0.74	74%	0.737	S	S	*	*			trans	-139	146.7	-141.1	39.4	-19.2	0	0	0	120.8
1551	R	30	Very low	31.3	Very low	172 Å²	172	145.4 Å²	145.4	65%	0.649	73%	0.727	S	S	*	*			trans	23.2	136.5	137.7	-79.3	168.9	152.6	158.1	-7	122.5	N1554	R1551-N1554 PolarHBondContact NE-ND2 3.3Å; R1551-N1554 VanDerWaalsContact NE-ND2 3.11Å; R1551-N1554 PolarHBondContact NE-OD1 2.85Å; R1551-N1554 PolarHBondContact NH2-OD1 3.18Å
1552	Q	29	Very low	30.9	Very low	184 Å²	184	146.4 Å²	146.4	86%	0.86	73%	0.729	S	S	*	*	S	Bend		-126.2	173.9	124.5	-108.1	-170.3	6.5	0	0	110.1
1553	P	33.8	Very low	31	Very low	107 Å²	107	146.9 Å²	146.9	70%	0.695	73%	0.73	S	S	*	*			trans	-74	139	-136.1	30.1	-36.9	0	0	0	115.3
1554	N	29.3	Very low	30.7	Very low	92 Å²	92	146.2 Å²	146.2	49%	0.492	72%	0.721	S	S	.	*			cis	72.9	138.4	45.2	-68.8	-21.7	0	0	0	114.6	R1551	R1551-N1554 PolarHBondContact NE-ND2 3.3Å; R1551-N1554 VanDerWaalsContact NE-ND2 3.11Å; R1551-N1554 PolarHBondContact NE-OD1 2.85Å; R1551-N1554 PolarHBondContact NH2-OD1 3.18Å
1555	Q	36.4	Very low	30.4	Very low	130 Å²	130	144.3 Å²	144.3	61%	0.607	72%	0.72	S	S	*	*			cis	-173	110.7	-27.4	-120.7	164.2	1.1	0	0	105.7
1556	S	36.3	Very low	30.1	Very low	109 Å²	109	138.1 Å²	138.1	76%	0.762	71%	0.712	S	S	*	*				58.3	104.1	62.2	79.3	0	0	0	0	113.5
1557	R	26.9	Very low	29.7	Very low	253 Å²	253	138.3 Å²	138.3	96%	0.955	70%	0.704	S	S	*	*			trans	-152.5	166.8	-172.5	-110.3	178.6	-178.9	174.9	-0.1	114.9
1558	Y	25.7	Very low	29.5	Very low	198 Å²	198	132.1 Å²	132.1	78%	0.776	68%	0.678	S	S	*	*			trans	-85.9	166.5	-166.6	-110	-111.2	0	0	0	115.7
1559	Y	26.3	Very low	29.3	Very low	214 Å²	214	135.6 Å²	135.6	84%	0.839	69%	0.685	S	S	*	*			trans	70.4	152.2	167.8	-59.8	-68.4	0	0	0	118.4
1560	G	27	Very low	29.1	Very low	51 Å²	51	135.2 Å²	135.2	53%	0.526	67%	0.671	S	S	.	*			trans	127.9	122.2	176.9	0	0	0	0	0	113.9	R1494	R1494-G1560 PolarHBondContact NH2-O 3.08Å
1561	T	27.3	Very low	28.9	Very low	98 Å²	98	138.5 Å²	138.5	60%	0.601	67%	0.674	S	S	*	*			trans	-107.4	137.9	179	45	0	0	0	0	112.1	P1492	P1492-T1561 HydrophobicContact CG-CG2 3.78Å
1562	K	26.5	Very low	28.7	Very low	196 Å²	196	136.8 Å²	136.8	85%	0.852	69%	0.686	S	S	*	*			trans	48.6	158	146.7	-85.1	-162.8	173.5	-170.3	0	120.4
1563	P	34.5	Very low	28.5	Very low	94 Å²	94	132.2 Å²	132.2	61%	0.61	68%	0.675	S	S	*	*			cis	-141.3	-165.6	-26	41	-22.5	0	0	0	113.7
1564	N	27.2	Very low	28.1	Very low	113 Å²	113	132.1 Å²	132.1	60%	0.604	68%	0.677	S	S	*	*			trans	83	146.7	147.2	-75.6	15.7	0	0	0	122.6
1565	F	26.7	Very low	27.9	Very low	183 Å²	183	137.7 Å²	137.7	80%	0.803	69%	0.691	S	S	*	*			trans	75.7	110.3	159.6	-72	-61.9	0	0	0	121.6
1566	A	29.2	Very low	27.4	Very low	81 Å²	81	137.9 Å²	137.9	67%	0.669	69%	0.692	S	S	*	*				73.4	145.8	129.6	0	0	0	0	0	119.4
1567	S	25.7	Very low	27	Very low	67 Å²	67	138.3 Å²	138.3	47%	0.469	69%	0.689	S	S	.	*			cis	-165.6	157.6	-21.1	57.6	0	0	0	0	109.2
1568	T	27.3	Very low	27	Very low	48 Å²	48	132.3 Å²	132.3	29%	0.294	68%	0.675	S	S	.	*			trans	-21.1	144.4	149.3	47.1	0	0	0	0	116.5	E1617	T1568-E1617 HydrophobicContact CG2-CB 4.44Å; T1568-E1617 HydrophobicContact CG2-CG 4.29Å; T1568-E1617 VanDerWaalsContact CG2-OE2 3.23Å; T1568-E1617 WeakPolarHBondContact CG2-OE2 3.32Å; T1568-E1617 PolarHBondContact N-OE2 3.32Å
1569	R	28.5	Very low	27.1	Very low	221 Å²	221	130.8 Å²	130.8	83%	0.834	68%	0.675	S	S	*	*			trans	-154.5	109.4	139.2	-133.7	166.8	-78.5	-162.4	-2.9	113.3
1570	Y	26.4	Very low	27.3	Very low	114 Å²	114	124.6 Å²	124.6	45%	0.447	66%	0.663	S	S	.	*			trans	-60.8	130.7	137.9	-84.6	-91.6	0	0	0	107.9	Q1613 C1614	Y1570-Q1613 HydrophobicContact CE1-CB 4.28Å; Y1570-Q1613 PolarHBondContact OH-O 2.95Å; Y1570-C1614 HydrophobicContact CE2-CB 3.92Å; Y1570-C1614 WeakPolarHBondContact OH-CB 3.49Å; Y1570-C1614 PolarHBondContact OH-N 2.78Å; Y1570-C1614 PolarHBondContact OH-O 3.18Å
1571	F	27.2	Very low	27.5	Very low	184 Å²	184	128.5 Å²	128.5	81%	0.807	67%	0.672	S	S	*	*				-176	125.9	124.8	-111.2	-74.2	0	0	0	109.7
1572	C	25.6	Very low	27.7	Very low	135 Å²	135	129.7 Å²	129.7	91%	0.912	68%	0.679	S	S	*	*			trans	-101.6	110	159.4	-82.8	0	0	0	0	108.3
1573	S	25.3	Very low	28	Very low	89 Å²	89	125.2 Å²	125.2	62%	0.622	67%	0.673	S	S	*	*			trans	-157.9	133.3	158.4	57.4	0	0	0	0	110.3
1574	S	25.3	Very low	27.7	Very low	104 Å²	104	131.5 Å²	131.5	73%	0.727	68%	0.684	S	S	*	*			trans	66.5	126.4	-179.4	84.3	0	0	0	0	113.8
1575	R	25.4	Very low	28	Very low	210 Å²	210	134.5 Å²	134.5	79%	0.792	69%	0.692	S	S	*	*				66.6	134.8	91.6	-67.3	174.7	167.8	-133.2	11.2	112.2
1576	E	26	Very low	28.3	Very low	133 Å²	133	132 Å²	132	62%	0.621	69%	0.687	S	S	*	*			cis	-163.1	148.7	13.3	-129	156.6	-140.7	0	0	112
1577	V	26.3	Very low	28.3	Very low	118 Å²	118	135 Å²	135	72%	0.715	69%	0.69	S	S	*	*				84.3	139.2	129.4	136.4	0	0	0	0	123.2
1578	I	27.6	Very low	28.9	Very low	127 Å²	127	137 Å²	137	65%	0.651	70%	0.701	S	S	*	*			trans	69.1	100.7	157.9	-79.4	170.6	0	0	0	117.1
1579	Q	27.7	Very low	29.1	Very low	167 Å²	167	141.8 Å²	141.8	78%	0.78	72%	0.72	S	S	*	*				94	149.3	86.4	-84	177.6	7.1	0	0	112.5
1580	S	29.9	Very low	29.2	Very low	83 Å²	83	139.4 Å²	139.4	58%	0.58	71%	0.712	S	S	*	*			cis	-168.2	-180	-11.2	54.3	0	0	0	0	111.1
1581	N	32.4	Very low	29.5	Very low	133 Å²	133	140.2 Å²	140.2	71%	0.711	72%	0.72	S	S	*	*			trans	73.2	105.1	151.7	-69	-9.2	0	0	0	118.6
1582	T	31.6	Very low	29.6	Very low	124 Å²	124	138.3 Å²	138.3	76%	0.761	72%	0.718	S	S	*	*				73.5	144.9	90.7	63.8	0	0	0	0	114.6
1583	S	31.6	Very low	30.3	Very low	102 Å²	102	141.6 Å²	141.6	71%	0.713	71%	0.712	S	S	*	*			cis	-161.5	146	12	4.9	0	0	0	0	109.1
1584	R	29.8	Very low	30.4	Very low	226 Å²	226	145.9 Å²	145.9	85%	0.853	72%	0.722	S	S	*	*				85.4	133.1	62.7	-155.9	-168.5	-159.5	179.1	7.4	113.6
1585	K	31.8	Very low	30.5	Very low	176 Å²	176	146.1 Å²	146.1	77%	0.765	72%	0.724	S	S	*	*			trans	82.2	158	172.1	-54.3	-179.1	179.3	-179.2	0	117.5
1586	N	33.1	Very low	30.7	Very low	129 Å²	129	142.2 Å²	142.2	69%	0.69	72%	0.723	S	S	*	*			cis	-168.9	139.9	-30.4	-98.9	1	0	0	0	110.9
1587	I	30.6	Very low	31	Very low	145 Å²	145	142.3 Å²	142.3	74%	0.744	73%	0.728	S	S	*	*				25.7	137	117.5	-63.4	157.2	0	0	0	117.6
1588	P	36.9	Very low	31.2	Very low	109 Å²	109	143.3 Å²	143.3	71%	0.708	73%	0.729	S	S	*	*			cis	-151.4	169.2	34.4	37.8	-14.4	0	0	0	122.2
1589	H	33	Very low	31.3	Very low	148 Å²	148	144.1 Å²	144.1	69%	0.685	73%	0.734	S	S	*	*			trans	66.8	159.1	137.2	-87.4	-102.4	0	0	0	128.3
1590	Y	30.7	Very low	31.3	Very low	171 Å²	171	141.7 Å²	141.7	67%	0.671	73%	0.73	S	S	*	*			trans	61	121.6	176.7	-70.5	-82.8	0	0	0	115.3
1591	E	32	Very low	31.4	Very low	132 Å²	132	146 Å²	146	62%	0.617	74%	0.741	S	S	*	*			cis	105.4	135.5	43.9	-90.7	-174	-152.8	0	0	108.5
1592	N	29.8	Very low	31.2	Very low	143 Å²	143	143.8 Å²	143.8	77%	0.765	74%	0.741	S	S	*	*			cis	-134.4	128.7	-10.4	-135.9	-26.8	0	0	0	107.6	Q1594	N1592-Q1594 PolarHBondContact O-N 2.81Å
1593	R	38.6	Very low	31.2	Very low	205 Å²	205	145.3 Å²	145.3	77%	0.774	74%	0.743	S	S	*	*				-99	107.4	-125.1	-64.8	-177.6	176.2	179.8	-3.2	116.6
1594	Q	28.5	Very low	30.9	Very low	179 Å²	179	145.4 Å²	145.4	84%	0.836	74%	0.744	S	S	*	*			trans	-87.1	160.8	162.3	-66.2	-179.5	-24.3	0	0	112.7	N1592	N1592-Q1594 PolarHBondContact O-N 2.81Å
1595	S	27.5	Very low	30.9	Very low	109 Å²	109	139.1 Å²	139.1	76%	0.762	74%	0.735	S	S	*	*			trans	74	171.4	150.3	80	0	0	0	0	119.8
1596	V	29.1	Very low	30.9	Very low	127 Å²	127	138.3 Å²	138.3	77%	0.77	73%	0.733	S	S	*	*			trans	68.8	90.9	-179.7	-168.7	0	0	0	0	113.2
1597	N	33.3	Very low	30.8	Very low	136 Å²	136	137.4 Å²	137.4	73%	0.727	73%	0.728	S	S	*	*				55.7	108.8	58.5	-69.7	-20.1	0	0	0	115.9
1598	N	29.6	Very low	30.8	Very low	139 Å²	139	138 Å²	138	74%	0.743	73%	0.726	S	S	*	*			trans	63.9	122.4	132.8	-68.7	-10.4	0	0	0	122.3
1599	L	29	Very low	30.4	Very low	143 Å²	143	137.6 Å²	137.6	75%	0.749	72%	0.721	S	S	*	*			trans	87.1	139.4	130.3	-98.8	69.5	0	0	0	122.3
1600	T	29.2	Very low	30.4	Very low	116 Å²	116	137.6 Å²	137.6	71%	0.712	72%	0.721	S	S	*	*			trans	90.9	136.6	141.3	43.7	0	0	0	0	123.5
1601	H	30.8	Very low	30.4	Very low	174 Å²	174	135.2 Å²	135.2	81%	0.806	72%	0.716	S	S	*	*			trans	70.7	78.5	157.7	-72.8	-66.1	0	0	0	122.1
1602	A	28.6	Very low	30.3	Very low	87 Å²	87	134.9 Å²	134.9	72%	0.719	72%	0.719	S	S	*	*				66.8	168	104.8	0	0	0	0	0	122.5
1603	I	30.9	Very low	30.1	Very low	155 Å²	155	133.7 Å²	133.7	80%	0.795	71%	0.709	S	S	*	*			trans	81.8	70.5	169.1	-46.6	-174.5	0	0	0	116.5
1604	S	27	Very low	29.6	Very low	105 Å²	105	127 Å²	127	73%	0.734	69%	0.692	S	S	*	*				49	153.9	118.3	66.1	0	0	0	0	124
1605	S	29.2	Very low	29.5	Very low	94 Å²	94	123.8 Å²	123.8	66%	0.657	68%	0.681	S	S	*	*			trans	87.9	143.8	141.4	170.7	0	0	0	0	118.3
1606	E	31.9	Very low	29.4	Very low	158 Å²	158	123.4 Å²	123.4	74%	0.738	68%	0.677	S	S	*	*			cis	-169.4	178.3	-16.5	-102.8	169	105.3	0	0	106.7
1607	L	30.9	Very low	29.2	Very low	111 Å²	111	123.1 Å²	123.1	58%	0.581	67%	0.667	S	S	*	*			cis	-159.2	-168.2	0	-130.5	173.7	0	0	0	108.7
1608	F	29.6	Very low	28.8	Very low	157 Å²	157	122.5 Å²	122.5	69%	0.689	66%	0.66	S	S	*	*			trans	83	139.8	152.5	-59.7	-50.7	0	0	0	119.2
1609	T	30.1	Very low	28.6	Very low	101 Å²	101	123.1 Å²	123.1	62%	0.62	66%	0.658	S	S	*	*			cis	-154.6	159.3	1.9	-0.1	0	0	0	0	107.6
1610	H	32.8	Very low	28.4	Very low	148 Å²	148	125 Å²	125	69%	0.685	66%	0.657	S	S	*	*			cis	-134.8	142	7.9	-93	-80.2	0	0	0	107.9
1611	Q	29.2	Very low	28.1	Very low	120 Å²	120	122.9 Å²	122.9	56%	0.561	65%	0.647	S	S	*	*				61.9	135.9	79.1	-86	178.7	-11.3	0	0	114.5
1612	N	30.4	Very low	27.9	Very low	125 Å²	125	121.7 Å²	121.7	67%	0.668	64%	0.644	S	S	*	*			cis	-128.8	148.2	12.5	-73.8	-58.5	0	0	0	111
1613	Q	26.9	Very low	27.6	Very low	119 Å²	119	124.7 Å²	124.7	56%	0.556	64%	0.643	S	S	*	*				69.5	137.3	51.6	-71.9	-158.5	-35.1	0	0	113.7	Y1570	Y1570-Q1613 HydrophobicContact CE1-CB 4.28Å; Y1570-Q1613 PolarHBondContact OH-O 2.95Å
1614	C	26.7	Very low	27.5	Very low	63 Å²	63	125.8 Å²	125.8	43%	0.426	64%	0.642	S	S	.	*			cis	179	156.1	-10.2	-116.5	0	0	0	0	112	Y1570	Y1570-C1614 HydrophobicContact CE2-CB 3.92Å; Y1570-C1614 WeakPolarHBondContact OH-CB 3.49Å; Y1570-C1614 PolarHBondContact OH-N 2.78Å; Y1570-C1614 PolarHBondContact OH-O 3.18Å
1615	N	26.4	Very low	27.6	Very low	113 Å²	113	124.8 Å²	124.8	60%	0.604	63%	0.632	S	S	*	*			trans	56.7	131	143.2	-57.5	2.1	0	0	0	123.2
1616	C	26.1	Very low	27.5	Very low	101 Å²	101	125.7 Å²	125.7	68%	0.682	63%	0.63	S	S	*	*				-173.2	128.6	112.4	-82.1	0	0	0	0	107.2
1617	E	24.4	Very low	27.1	Very low	120 Å²	120	123.6 Å²	123.6	56%	0.561	62%	0.62	S	S	*	*				82.6	133.3	50.7	-78.1	-158.9	-176.6	0	0	116.3	T1568	T1568-E1617 HydrophobicContact CG2-CB 4.44Å; T1568-E1617 HydrophobicContact CG2-CG 4.29Å; T1568-E1617 VanDerWaalsContact CG2-OE2 3.23Å; T1568-E1617 WeakPolarHBondContact CG2-OE2 3.32Å; T1568-E1617 PolarHBondContact N-OE2 3.32Å
1618	Q	26.1	Very low	26.7	Very low	123 Å²	123	122 Å²	122	58%	0.575	61%	0.611	S	S	*	*			trans	88.8	96.5	165.1	-59.7	172.1	39.8	0	0	119.3	E1518	E1518-Q1618 VanDerWaalsContact OE2-C 3.29Å
1619	Q	24.4	Very low	26.4	Very low	152 Å²	152	122 Å²	122	71%	0.71	61%	0.614	S	S	*	*				69.9	58.7	86.9	-69.6	-170.8	-1.7	0	0	118.7	E1518	E1518-Q1619 VanDerWaalsContact CD-N 3.27Å; E1518-Q1619 VanDerWaalsContact OE1-CA 3.23Å; E1518-Q1619 WeakPolarHBondContact OE1-CA 3.36Å; E1518-Q1619 PolarHBondContact OE1-N 2.99Å; E1518-Q1619 VanDerWaalsContact OE1-N 3.11Å; E1518-Q1619 PolarHBondContact OE2-N 2.98Å
1620	Y	25.9	Very low	26.4	Very low	182 Å²	182	119.8 Å²	119.8	71%	0.714	60%	0.601	S	S	*	*			trans	-160.8	139.3	158.9	-83.7	-65.5	0	0	0	111.8	T1517 E1518	T1517-Y1620 PolarHBondContact OG1-O 2.81Å; E1518-Y1620 WeakPolarHBondContact CG-O 3.46Å; E1518-Y1620 PolarHBondContact OE1-N 2.79Å
1621	S	23	Very low	26	Very low	72 Å²	72	117.5 Å²	117.5	50%	0.503	59%	0.591	S	S	.	*			cis	-162.4	168.4	-2.4	-168.8	0	0	0	0	110.6
1622	M	25.4	Very low	25.8	Very low	150 Å²	150	116.3 Å²	116.3	74%	0.739	58%	0.584	S	S	*	*			trans	-86.1	165.8	154.6	-146.1	-174.7	-159.5	0	0	109.7
1623	H	22.7	Very low	25.5	Very low	150 Å²	150	115.9 Å²	115.9	69%	0.694	57%	0.573	S	S	*	*			trans	74.3	124.9	-178.2	-67.4	-49	0	0	0	114.6
1624	K	29.5	Very low	25.8	Very low	178 Å²	178	113.4 Å²	113.4	77%	0.774	56%	0.563	S	S	*	*				70.9	155	75.4	-103.9	-167.9	-174.7	-176.4	0	110.5
1625	P	29	Very low	26	Very low	83 Å²	83	114.9 Å²	114.9	54%	0.539	57%	0.572	S	S	.	*			cis	-101.1	-166.8	24	13.4	10.8	0	0	0	111.7
1626	N	27	Very low	26	Very low	113 Å²	113	114.2 Å²	114.2	60%	0.604	56%	0.562	S	S	*	*				35.2	133.9	64.4	-90.1	30	0	0	0	110.9
1627	Q	22.9	Very low	25.8	Very low	115 Å²	115	113.4 Å²	113.4	54%	0.537	56%	0.557	S	S	.	*			cis	-167.3	-172.5	20.1	-141.5	159.3	-52.2	0	0	107.3
1628	I	22.5	Very low	25.9	Very low	76 Å²	76	112.8 Å²	112.8	39%	0.39	57%	0.565	S	S	.	*			trans	61.2	81.6	155.9	-62.3	155	0	0	0	112.1
1629	Q	23.9	Very low	25.9	Very low	159 Å²	159	112 Å²	112	74%	0.743	57%	0.573	S	S	*	*				50.2	132.6	79.3	-58.4	-178.1	-84.8	0	0	113.6
1630	C	30.2	Very low	26.1	Very low	54 Å²	54	110.4 Å²	110.4	37%	0.365	57%	0.573	S	S	.	*			trans	66.4	148.4	148.7	-61.1	0	0	0	0	116.4	K1632	C1630-K1632 HydrophobicContact CB-CD 4.25Å; C1630-K1632 HydrophobicContact CB-CG 3.92Å
1631	H	23.9	Very low	26.2	Very low	99 Å²	99	107.2 Å²	107.2	46%	0.458	58%	0.577	S	S	.	*			cis	-86.8	143.6	15.5	-85.4	-146	0	0	0	112.7
1632	K	24.3	Very low	26.6	Very low	96 Å²	96	110.7 Å²	110.7	42%	0.417	59%	0.589	S	S	.	*				61.2	146.3	56.1	-57.2	173.9	-160.2	150.2	0	110.1	C1630	C1630-K1632 HydrophobicContact CB-CD 4.25Å; C1630-K1632 HydrophobicContact CB-CG 3.92Å
1633	R	23.5	Very low	26.7	Very low	115 Å²	115	112.6 Å²	112.6	43%	0.434	59%	0.593	S	S	.	*			cis	-140.9	-178.8	19.3	-137.7	147.3	-169.7	172.5	-1.5	111.3	N670 N671	N670-R1633 PolarHBondContact O-NH2 2.8Å; N671-R1633 PolarHBondContact OD1-NE 3.19Å; N671-R1633 PolarHBondContact OD1-NH2 3.42Å
1634	L	34	Very low	26.8	Very low	67 Å²	67	110 Å²	110	35%	0.351	59%	0.592	S	S	.	*			trans	-72.8	167.1	169.7	-54.1	89.7	0	0	0	109.3	Y1443 Y1636	Y1443-L1634 HydrophobicContact CD2-CB 4.39Å; Y1443-L1634 VanDerWaalsContact CE2-CA 3.44Å; Y1443-L1634 HydrophobicContact CE2-CB 3.42Å; Y1443-L1634 VanDerWaalsContact CE2-CB 3.42Å; Y1443-L1634 HydrophobicContact CE2-CD2 4.01Å; Y1443-L1634 HydrophobicContact CE2-CG 3.8Å; Y1443-L1634 WeakPolarHBondContact OH-CD2 3.13Å; L1634-Y1636 VanDerWaalsContact CB-N 3.32Å
1635	P	30.5	Very low	26.6	Very low	94 Å²	94	112.5 Å²	112.5	61%	0.61	60%	0.596	S	S	*	*				-113.4	74.1	124.8	33.4	-37.3	0	0	0	113.5	Y1443	Y1443-P1635 HydrophobicContact CD1-CG 3.73Å; Y1443-P1635 HydrophobicContact CE1-CG 3.98Å; Y1443-P1635 WeakPolarHBondContact CE1-O 3.43Å; Y1443-P1635 HydrophobicContact CG-CG 4.33Å
1636	Y	26.8	Very low	26.3	Very low	100 Å²	100	113.7 Å²	113.7	39%	0.392	61%	0.607	S	S	.	*			trans	67.3	138.6	155.4	-64.6	-88.5	0	0	0	116.7	N671 Y1443 L1634	N671-Y1636 PolarHBondContact O-OH 3.32Å; Y1443-Y1636 VanDerWaalsContact CE1-O 3.23Å; Y1443-Y1636 WeakPolarHBondContact CE1-O 3.19Å; Y1443-Y1636 WeakPolarHBondContact OH-CA 3.39Å; Y1443-Y1636 PolarHBondContact OH-N 3.16Å; Y1443-Y1636 VanDerWaalsContact OH-N 3.11Å; Y1443-Y1636 PolarHBondContact OH-O 3.01Å; L1634-Y1636 VanDerWaalsContact CB-N 3.32Å
1637	S	23	Very low	26.1	Very low	83 Å²	83	112.8 Å²	112.8	58%	0.58	61%	0.61	S	S	*	*				49.1	135.8	73.7	126	0	0	0	0	110.8	Y1443	Y1443-S1637 PolarHBondContact OH-N 3.47Å
1638	C	25.6	Very low	26.1	Very low	108 Å²	108	114.4 Å²	114.4	73%	0.73	62%	0.621	S	S	*	*			cis	-171.8	-157.6	4.1	-125.6	0	0	0	0	105
1639	S	26.6	Very low	26.2	Very low	106 Å²	106	118 Å²	118	74%	0.741	64%	0.636	S	S	*	*			trans	69.6	137.4	162.9	76.9	0	0	0	0	114.9
1640	T	27.1	Very low	26.3	Very low	118 Å²	118	116.7 Å²	116.7	72%	0.724	63%	0.634	S	S	*	*			cis	-145.3	130	-11.4	0	0	0	0	0	106
1641	C	29.2	Very low	26	Very low	116 Å²	116	118.9 Å²	118.9	78%	0.784	65%	0.65	S	S	*	*				41.1	68.5	61.8	-76.7	0	0	0	0	112
1642	L	30.5	Very low	26	Very low	145 Å²	145	122.2 Å²	122.2	76%	0.759	66%	0.663	S	S	*	*			trans	176.3	143.6	130.8	-88.1	155.4	0	0	0	107.6
1643	K	28.8	Very low	26	Very low	189 Å²	189	125.5 Å²	125.5	82%	0.822	68%	0.68	S	S	*	*			cis	-117.1	111.6	14.2	-66.4	174.9	-177.9	173.5	0	112.9
1644	S	23.9	Very low	26	Very low	97 Å²	97	123.9 Å²	123.9	68%	0.678	69%	0.686	S	S	*	*			trans	-68.8	122.2	145.2	53.2	0	0	0	0	109.2
1645	R	25.4	Very low	25.5	Very low	229 Å²	229	128.9 Å²	128.9	86%	0.864	71%	0.706	S	S	*	*			trans	60.5	158.5	159.9	-74.8	-179.6	165.7	174.2	-3.9	119.2
1646	S	22.8	Very low	25.4	Very low	109 Å²	109	132.2 Å²	132.2	76%	0.762	71%	0.713	S	S	*	*			trans	67	146	158	67.6	0	0	0	0	118.1
1647	S	22.4	Very low	25.5	Very low	94 Å²	94	132.2 Å²	132.2	66%	0.657	72%	0.723	S	S	*	*			cis	-172.9	159.2	-22.1	50.1	0	0	0	0	109.2
1648	L	23.6	Very low	25.6	Very low	148 Å²	148	134.8 Å²	134.8	78%	0.775	73%	0.73	S	S	*	*			trans	63.2	129.2	157	-93.9	73.7	0	0	0	118.6
1649	H	25.3	Very low	25.8	Very low	153 Å²	153	135.8 Å²	135.8	71%	0.708	73%	0.728	S	S	*	*			trans	41.4	125.9	131.2	-79.6	-59.2	0	0	0	122.4
1650	N	24.9	Very low	25.9	Very low	130 Å²	130	135.2 Å²	135.2	70%	0.695	72%	0.72	S	S	*	*				70	99.2	126.9	-60.3	5.8	0	0	0	119.5
1651	S	24.4	Very low	25.9	Very low	101 Å²	101	137.3 Å²	137.3	71%	0.706	72%	0.722	S	S	*	*				108.2	153.4	102	78.9	0	0	0	0	119.9
1652	K	24.3	Very low	25.9	Very low	169 Å²	169	138 Å²	138	74%	0.735	72%	0.718	S	S	*	*			trans	72.9	115.1	153.4	-72.8	177	173.2	-176.7	0	120
1653	Q	24.1	Very low	25.8	Very low	164 Å²	164	135.9 Å²	135.9	77%	0.766	71%	0.714	S	S	*	*				68.9	141.6	123.5	-65.8	170.7	-62.4	0	0	118.1
1654	S	23.8	Very low	25.8	Very low	82 Å²	82	132.5 Å²	132.5	57%	0.573	71%	0.71	S	S	*	*			cis	-174.8	160.8	-5	43.3	0	0	0	0	111.2
1655	F	23.6	Very low	26	Very low	172 Å²	172	134.3 Å²	134.3	75%	0.754	71%	0.71	S	S	*	*			trans	68.5	147.3	174.7	-58.9	-82.5	0	0	0	115.1
1656	H	28	Very low	26.1	Very low	164 Å²	164	129 Å²	129	76%	0.759	70%	0.699	S	S	*	*			cis	-122.2	144.4	8.3	-112.1	-71	0	0	0	114.8
1657	T	27.3	Very low	26.4	Very low	100 Å²	100	129.7 Å²	129.7	61%	0.613	69%	0.694	S	S	*	*			trans	-40.8	159.3	152.9	19.9	0	0	0	0	114.5
1658	L	27.1	Very low	26.6	Very low	137 Å²	137	134.1 Å²	134.1	72%	0.717	70%	0.702	S	S	*	*			cis	-157.3	150.7	39.3	-101.7	114.1	0	0	0	112.7
1659	N	28.2	Very low	26.8	Very low	129 Å²	129	131.6 Å²	131.6	69%	0.69	70%	0.696	S	S	*	*			trans	53.6	150.2	136.8	-73.6	22.7	0	0	0	123.2
1660	T	28.6	Very low	27	Very low	93 Å²	93	132.3 Å²	132.3	57%	0.571	70%	0.7	S	S	*	*			cis	-167.4	158.8	-13.5	18.4	0	0	0	0	109.7
1661	Q	28.2	Very low	27.2	Very low	163 Å²	163	134.3 Å²	134.3	76%	0.762	71%	0.705	S	S	*	*			trans	67.5	151.1	146.4	-76	164.7	-12.7	0	0	118.1
1662	N	29.4	Very low	27.4	Very low	131 Å²	131	135 Å²	135	70%	0.701	70%	0.701	S	S	*	*			cis	-169.2	137.2	-25.5	-121.9	16.4	0	0	0	109.2
1663	S	28.3	Very low	27.5	Very low	99 Å²	99	134.2 Å²	134.2	69%	0.692	70%	0.697	S	S	*	*				65.4	159.1	128	92.9	0	0	0	0	119.4
1664	V	28.6	Very low	27.7	Very low	119 Å²	119	132.5 Å²	132.5	72%	0.721	69%	0.694	S	S	*	*			cis	-173.5	159.8	-1.5	95.8	0	0	0	0	112.6
1665	I	28	Very low	28	Very low	135 Å²	135	134 Å²	134	69%	0.692	70%	0.704	S	S	*	*			trans	76.8	117.1	149.6	-79.6	177.2	0	0	0	123.6
1666	D	26.7	Very low	28.2	Very low	118 Å²	118	132.1 Å²	132.1	63%	0.631	70%	0.702	S	S	*	*				69.6	112.3	124.6	-57.5	4.6	0	0	0	127.6
1667	N	30.3	Very low	28.2	Very low	122 Å²	122	134.4 Å²	134.4	65%	0.652	70%	0.704	S	S	*	*				68	149.7	110.2	-54.2	-38.6	0	0	0	125.1
1668	F	26.3	Very low	28.1	Very low	188 Å²	188	134.5 Å²	134.5	83%	0.825	71%	0.708	S	S	*	*			trans	68.8	113.5	164.9	-69	-69.2	0	0	0	116.4
1669	S	28.2	Very low	28.3	Very low	94 Å²	94	137.8 Å²	137.8	66%	0.657	71%	0.711	S	S	*	*				72.4	145.4	85.6	82.8	0	0	0	0	113.2
1670	E	27.8	Very low	28.1	Very low	169 Å²	169	141.9 Å²	141.9	79%	0.79	72%	0.719	S	S	*	*			cis	-158.1	176.2	12.6	-148	165.4	-174.6	0	0	110.9
1671	E	29.4	Very low	28.7	Very low	171 Å²	171	140.9 Å²	140.9	80%	0.799	72%	0.72	S	S	*	*			trans	64.5	149	160.1	-59.3	-161.6	126	0	0	124.1
1672	D	28.8	Very low	28.5	Very low	115 Å²	115	139 Å²	139	62%	0.615	72%	0.715	S	S	*	*			trans	78.3	115.1	141.8	-104.7	4.1	0	0	0	126.1
1673	K	27.2	Very low	28.4	Very low	153 Å²	153	135.1 Å²	135.1	67%	0.665	69%	0.693	S	S	*	*			trans	79.7	135.9	131.8	-80.4	175.9	-173.8	73	0	124.7
1674	D	29.1	Very low	28.4	Very low	128 Å²	128	136.1 Å²	136.1	68%	0.684	69%	0.69	S	S	*	*			trans	59.1	86.9	134.9	-56.3	-20.3	0	0	0	121.8
1675	S	28.4	Very low	28.3	Very low	113 Å²	113	136.2 Å²	136.2	79%	0.79	68%	0.677	S	S	*	*				83.4	144.7	113.7	77.6	0	0	0	0	122.4
1676	D	28.6	Very low	28.4	Very low	134 Å²	134	141.6 Å²	141.6	72%	0.717	69%	0.689	S	S	*	*			trans	85.1	145.5	148.5	-144	16.8	0	0	0	121
1677	R	27.3	Very low	28.6	Very low	212 Å²	212	140.8 Å²	140.8	80%	0.8	68%	0.683	S	S	*	*			trans	61.7	105.1	164.3	-75.3	166	-173.2	-143.6	-8	121.8
1678	S	26	Very low	28.3	Very low	101 Å²	101	143.4 Å²	143.4	71%	0.706	69%	0.692	S	S	*	*				52.9	96.3	110.3	-171	0	0	0	0	117.6
1679	R	30.4	Very low	28.4	Very low	207 Å²	207	144.5 Å²	144.5	78%	0.781	69%	0.692	S	S	*	*				58.3	91.9	91.7	-177.4	-138.6	-89.9	-155.9	-7.3	114.4
1680	Y	25.5	Very low	28.2	Very low	214 Å²	214	143.7 Å²	143.7	84%	0.839	70%	0.699	S	S	*	*				-148.7	129.1	117.5	-95.4	-86.2	0	0	0	105.1
1681	A	39.4	Very low	28.2	Very low	73 Å²	73	139.6 Å²	139.6	60%	0.603	70%	0.702	S	S	*	*			cis	76.9	74.5	36.5	0	0	0	0	0	113
1682	D	25.7	Very low	28.3	Very low	124 Å²	124	135.1 Å²	135.1	66%	0.663	70%	0.701	S	S	*	*			trans	-172.6	152.5	170.5	-100.6	-15.6	0	0	0	106.7
1683	Q	26.2	Very low	28.7	Very low	49 Å²	49	135 Å²	135	23%	0.229	71%	0.707	C	S	.	*			cis	-161.7	-177.7	13.2	-109.1	151.3	15.4	0	0	112.6	T1407 D1408	T1407-Q1683 PolarHBondContact O-OE1 2.73Å; D1408-Q1683 PolarHBondContact O-OE1 3.06Å; D1408-Q1683 VanDerWaalsContact O-OE1 3.1Å
1684	L	27.7	Very low	28.7	Very low	120 Å²	120	134 Å²	134	63%	0.628	71%	0.713	S	S	*	*			trans	-119.2	-165.8	-178.5	-54.5	92.2	0	0	0	110	D1408 I1409	D1408-L1684 WeakPolarHBondContact CA-O 3.07Å; D1408-L1684 WeakPolarHBondContact CB-O 2.97Å; D1408-L1684 VanDerWaalsContact CG-O 3.3Å; I1409-L1684 WeakPolarHBondContact CA-O 3.5Å; I1409-L1684 VanDerWaalsContact CB-O 3.3Å; I1409-L1684 WeakPolarHBondContact CB-O 3.15Å; I1409-L1684 VanDerWaalsContact CG1-O 3.25Å; I1409-L1684 WeakPolarHBondContact CG1-O 3.06Å
1685	R	27.8	Very low	28.6	Very low	120 Å²	120	132.1 Å²	132.1	45%	0.453	72%	0.716	S	S	.	*			cis	-149.4	135.6	-18.4	19.5	78.9	-143.4	-116.9	9	106	D1408 I1687	D1408-R1685 VanDerWaalsContact CG-NE 3.27Å; D1408-R1685 VanDerWaalsContact CG-NH2 3.33Å; D1408-R1685 IonicContact OD1-CZ 2.73Å; D1408-R1685 IonicContact OD1-NE 3.28Å; D1408-R1685 PolarHBondContact OD1-NE 2.88Å; D1408-R1685 IonicContact OD1-NH2 3.36Å; D1408-R1685 PolarHBondContact OD1-NH2 3.28Å; D1408-R1685 IonicContact OD2-CZ 3.74Å; D1408-R1685 IonicContact OD2-NE 3.96Å; D1408-R1685 PolarHBondContact OD2-NE 3.2Å; D1408-R1685 IonicContact OD2-NH2 2.75Å; D1408-R1685 PolarHBondContact OD2-NH2 2.89Å; R1685-I1687 PolarHBondContact O-N 3.06Å
1686	R	29.2	Very low	28.5	Very low	248 Å²	248	135 Å²	135	94%	0.936	72%	0.717	S	S	*	*			trans	-79.1	82.5	177.9	-165.5	-170.3	-104.9	-148.4	1.7	111.6
1687	I	32.2	Very low	28.4	Very low	101 Å²	101	135 Å²	135	52%	0.518	72%	0.717	S	S	.	*			trans	-65.8	136.6	164	-80.5	176.1	0	0	0	109.9	R1685 Y1689	R1685-I1687 PolarHBondContact O-N 3.06Å; I1687-Y1689 PolarHBondContact O-N 2.7Å
1688	Q	23.5	Very low	28.3	Very low	178 Å²	178	131.6 Å²	131.6	83%	0.832	71%	0.713	S	S	*	*	S	Bend	trans	-79.7	105.5	154.4	-108.9	-169.9	-22.3	0	0	108.1
1689	Y	27.3	Very low	28.2	Very low	211 Å²	211	134.4 Å²	134.4	83%	0.827	72%	0.719	S	S	*	*	S	Bend	trans	57	119.6	167.7	-63.7	-87.1	0	0	0	119.7	I1687	I1687-Y1689 PolarHBondContact O-N 2.7Å
1690	G	25.6	Very low	28	Very low	77 Å²	77	128 Å²	128	79%	0.794	72%	0.718	S	S	*	*				104	116.2	124.5	0	0	0	0	0	119.3
1691	G	27.3	Very low	28	Very low	83 Å²	83	124.1 Å²	124.1	86%	0.856	71%	0.712	S	S	*	*			trans	92.3	129.7	149.9	0	0	0	0	0	117.4
1692	G	30.7	Very low	27.4	Very low	77 Å²	77	126.6 Å²	126.6	79%	0.794	71%	0.714	S	S	*	*			trans	-97.4	-143.6	157.9	0	0	0	0	0	110.5
1693	P	37.5	Very low	27.5	Very low	113 Å²	113	126.6 Å²	126.6	73%	0.734	71%	0.714	S	S	*	*			cis	-137.7	176.5	0.5	41.4	-23.4	0	0	0	115.6
1694	T	28.1	Very low	27.5	Very low	130 Å²	130	128.5 Å²	128.5	80%	0.798	74%	0.737	S	S	*	*			trans	37.1	125.3	146.8	55.1	0	0	0	0	122
1695	A	26.6	Very low	27.4	Very low	89 Å²	89	129.8 Å²	129.8	74%	0.736	74%	0.74	S	S	*	*				146.5	114	119.1	0	0	0	0	0	110.2
1696	Q	27	Very low	27.4	Very low	173 Å²	173	130.4 Å²	130.4	81%	0.808	75%	0.753	S	S	*	*				77.3	132.6	64.9	-84.6	-166.1	-23.8	0	0	115.9
1697	L	25.6	Very low	27.3	Very low	136 Å²	136	123.8 Å²	123.8	71%	0.712	74%	0.736	S	S	*	*			trans	84.6	148	136	-87.9	168.9	0	0	0	121.7
1698	L	25.3	Very low	27.1	Very low	139 Å²	139	126.7 Å²	126.7	73%	0.728	75%	0.747	S	S	*	*			trans	75.6	108.5	165.1	-57.7	160.6	0	0	0	115.8
1699	L	24.2	Very low	27.4	Very low	160 Å²	160	123.4 Å²	123.4	84%	0.838	74%	0.744	S	S	*	*				74.2	127.9	71	-71.5	-171.1	0	0	0	114
1700	G	26.5	Very low	27.5	Very low	73 Å²	73	118.4 Å²	118.4	75%	0.753	74%	0.739	S	S	*	*			trans	139.7	61.6	175.7	0	0	0	0	0	113
1701	N	25.5	Very low	28.1	Very low	133 Å²	133	119.3 Å²	119.3	71%	0.711	73%	0.731	S	S	*	*				73.2	130.9	54	-148.5	21.7	0	0	0	113.8
1702	I	26.2	Very low	28.2	Very low	125 Å²	125	122 Å²	122	64%	0.641	73%	0.726	S	S	*	*			trans	82.2	121.5	151.9	-78.4	165.3	0	0	0	121.1
1703	N	27.3	Very low	28.4	Very low	124 Å²	124	123.3 Å²	123.3	66%	0.663	72%	0.723	S	S	*	*			trans	59.4	127.5	150.4	-60.3	6	0	0	0	120
1704	A	25.8	Very low	28.1	Very low	88 Å²	88	124.3 Å²	124.3	73%	0.727	72%	0.722	S	S	*	*			cis	74.6	159.2	20.8	0	0	0	0	0	116.7
1705	Q	26.6	Very low	28.1	Very low	147 Å²	147	125.5 Å²	125.5	69%	0.687	72%	0.723	S	S	*	*			trans	74	109.5	-176.3	-53	-173.1	-86.3	0	0	113
1706	N	27.3	Very low	28.2	Very low	134 Å²	134	126 Å²	126	72%	0.717	72%	0.721	S	S	*	*				84.5	164.2	88.2	-69	10.7	0	0	0	110.8
1707	D	26.4	Very low	28.7	Very low	109 Å²	109	123.8 Å²	123.8	58%	0.583	72%	0.722	S	S	*	*			cis	-157.2	167.3	20.8	-133.2	-42.8	0	0	0	112.3
1708	H	29.6	Very low	28.7	Very low	162 Å²	162	121.6 Å²	121.6	75%	0.75	72%	0.718	S	S	*	*			trans	66.6	150	156.3	-61.2	-1.8	0	0	0	118.3
1709	S	29.9	Very low	28.8	Very low	109 Å²	109	122.1 Å²	122.1	76%	0.762	72%	0.716	S	S	*	*			cis	-156.7	155.6	-12.4	46.3	0	0	0	0	112.4
1710	S	28.6	Very low	29	Very low	105 Å²	105	121.2 Å²	121.2	73%	0.734	71%	0.708	S	S	*	*			trans	-68.6	-169.6	159.8	53.6	0	0	0	0	110.6
1711	P	37.8	Very low	29.1	Very low	96 Å²	96	124.9 Å²	124.9	62%	0.623	71%	0.705	S	S	*	*			cis	-156.7	-175.6	20.7	48	-25.9	0	0	0	121.3
1712	D	29.8	Very low	29.5	Very low	141 Å²	141	125.5 Å²	125.5	75%	0.754	70%	0.704	S	S	*	*			trans	81.9	144.8	136.9	-74	-24.6	0	0	0	125
1713	S	34.1	Very low	29.8	Very low	103 Å²	103	125.7 Å²	125.7	72%	0.72	71%	0.706	S	S	*	*			trans	95.3	139.5	145.3	79.3	0	0	0	0	120.2
1714	N	31.5	Very low	30	Very low	135 Å²	135	126 Å²	126	72%	0.722	71%	0.706	S	S	*	*			cis	-164	151.9	-24.4	-109.4	-24.3	0	0	0	112.9
1715	L	29.4	Very low	30.4	Very low	154 Å²	154	127.8 Å²	127.8	81%	0.806	70%	0.704	S	S	*	*			trans	51.6	139.4	150	-86.6	77.1	0	0	0	123
1716	S	28.7	Very low	30.7	Very low	100 Å²	100	127.2 Å²	127.2	70%	0.699	71%	0.705	S	S	*	*			trans	-87.8	178.7	153	56	0	0	0	0	111.5
1717	P	35.6	Very low	30.7	Very low	127 Å²	127	130.8 Å²	130.8	83%	0.825	72%	0.715	S	S	*	*				-148.9	-141.8	96.8	41.4	-22.5	0	0	0	114.8
1718	S	26.5	Very low	31	Very low	90 Å²	90	133.7 Å²	133.7	63%	0.629	73%	0.725	S	S	*	*			trans	-131.2	-170.7	-150.3	50	0	0	0	0	115.1
1719	Q	28.1	Very low	30.9	Very low	149 Å²	149	130.2 Å²	130.2	70%	0.696	72%	0.718	S	S	*	*			trans	81.9	149	165.6	-64.4	162.7	-85.9	0	0	116
1720	E	28.8	Very low	30.8	Very low	141 Å²	141	131.4 Å²	131.4	66%	0.659	73%	0.725	S	S	*	*			cis	-155.9	167.1	-1.6	-128.3	144.7	-158.5	0	0	114.4
1721	E	27.7	Very low	30.7	Very low	150 Å²	150	133.9 Å²	133.9	70%	0.701	73%	0.73	S	S	*	*			trans	9.7	135.5	158.4	-66.8	172.7	154.3	0	0	123.7
1722	H	34.7	Very low	30	Very low	147 Å²	147	133.7 Å²	133.7	68%	0.681	73%	0.73	S	S	*	*				177	142.7	91.4	-106.5	-63.8	0	0	0	115.4
1723	N	31.9	Very low	29.8	Very low	129 Å²	129	135.7 Å²	135.7	69%	0.69	73%	0.732	S	S	*	*			trans	65.8	147.2	146.6	-63.9	-7.2	0	0	0	119.3
1724	I	32.1	Very low	29.4	Very low	129 Å²	129	135.8 Å²	135.8	66%	0.662	73%	0.733	S	S	*	*			cis	-154.9	146.7	0.5	-127.8	166.6	0	0	0	112.8
1725	N	33.2	Very low	29	Very low	127 Å²	127	138.7 Å²	138.7	68%	0.679	74%	0.739	S	S	*	*			trans	62.1	127.7	155.8	-62.7	-6.5	0	0	0	124.3
1726	N	32	Very low	28.7	Very low	135 Å²	135	136.4 Å²	136.4	72%	0.722	74%	0.736	S	S	*	*			trans	71.6	84.1	137.5	-58.8	-4.7	0	0	0	121.3
1727	F	28.7	Very low	28.7	Very low	209 Å²	209	138.7 Å²	138.7	92%	0.917	74%	0.74	S	S	*	*				-161.9	119.1	90.6	-120.5	-87.7	0	0	0	112
1728	H	31.4	Very low	28.1	Very low	170 Å²	170	140.5 Å²	140.5	79%	0.787	74%	0.74	S	S	*	*			trans	-93.3	172.9	173.2	-96.5	-109	0	0	0	110.3
1729	S	28.4	Very low	28.1	Very low	88 Å²	88	143.6 Å²	143.6	62%	0.615	74%	0.744	S	S	*	*			cis	172.9	149.3	-35.2	65.3	0	0	0	0	107.9
1730	C	27.4	Very low	28	Very low	134 Å²	134	144.9 Å²	144.9	91%	0.905	75%	0.747	S	S	*	*			trans	-164.4	150.1	133.7	-128.7	0	0	0	0	113.3
1731	L	26.7	Very low	27.9	Very low	158 Å²	158	144.3 Å²	144.3	83%	0.827	75%	0.748	S	S	*	*			trans	-132.8	123.8	-173.3	-93.1	162.9	0	0	0	111.8
1732	S	24.3	Very low	27.9	Very low	92 Å²	92	144.6 Å²	144.6	64%	0.643	75%	0.749	S	S	*	*			trans	68.5	154.5	142.6	83.2	0	0	0	0	121.3
1733	K	25	Very low	27.5	Very low	183 Å²	183	144.7 Å²	144.7	80%	0.796	75%	0.754	S	S	*	*			trans	82	120.4	153.6	-67.4	170.8	-177.6	171.5	0	121
1734	S	24.5	Very low	27.4	Very low	105 Å²	105	145.8 Å²	145.8	73%	0.734	76%	0.759	S	S	*	*			trans	70	114.3	135.3	61.6	0	0	0	0	122.3
1735	K	24.1	Very low	27.3	Very low	195 Å²	195	145.5 Å²	145.5	85%	0.848	76%	0.759	S	S	*	*			trans	53.1	124.7	136.6	-71.3	-169.3	173.1	-173.4	0	120.9
1736	S	23.2	Very low	27.2	Very low	106 Å²	106	145.3 Å²	145.3	74%	0.741	76%	0.758	S	S	*	*			trans	78.2	149.4	139.9	55.5	0	0	0	0	121
1737	N	28.2	Very low	27.2	Very low	148 Å²	148	144.5 Å²	144.5	79%	0.791	76%	0.757	S	S	*	*			trans	85.6	83.2	164.8	-59.9	-4.6	0	0	0	119.7
1738	M	23.8	Very low	27.4	Very low	165 Å²	165	142.1 Å²	142.1	81%	0.813	75%	0.749	S	S	*	*				34.8	128.9	121.5	-74.2	175.6	70.8	0	0	122.1
1739	H	26.5	Very low	27.5	Very low	155 Å²	155	140 Å²	140	72%	0.718	74%	0.744	S	S	*	*			trans	82.2	145.9	135.5	-92.3	-88.2	0	0	0	123.3
1740	K	25.9	Very low	27.9	Very low	176 Å²	176	141.5 Å²	141.5	77%	0.765	75%	0.745	S	S	*	*			trans	70.1	129.8	168.8	-66.9	-162.9	170.8	-166.5	0	116.9
1741	I	26.8	Very low	28.3	Very low	130 Å²	130	141.9 Å²	141.9	67%	0.667	73%	0.733	S	S	*	*			cis	101.2	133.3	29.7	-70.8	170.5	0	0	0	112.4
1742	E	27.5	Very low	28.6	Very low	156 Å²	156	141.6 Å²	141.6	73%	0.729	73%	0.731	S	S	*	*			trans	80.2	102.7	162.1	-80.2	161.6	152.3	0	0	122.4
1743	L	26.3	Very low	29.1	Very low	148 Å²	148	142.9 Å²	142.9	78%	0.775	73%	0.73	S	S	*	*				70.2	161.7	118	-67.7	176.2	0	0	0	122.1
1744	L	30.7	Very low	29.6	Very low	153 Å²	153	138.8 Å²	138.8	80%	0.801	72%	0.724	S	S	*	*			trans	74.3	142.7	167.5	-57.1	174.3	0	0	0	117.2
1745	N	29.5	Very low	30.1	Very low	123 Å²	123	139.7 Å²	139.7	66%	0.658	72%	0.721	S	S	*	*			cis	-164	153.8	-31.8	-144.7	3.9	0	0	0	110.6
1746	N	30.2	Very low	30.5	Very low	123 Å²	123	138.7 Å²	138.7	66%	0.658	72%	0.724	S	S	*	*			trans	53.2	149.1	151.1	-74.8	-11.6	0	0	0	123.6
1747	T	31.8	Very low	31	Very low	117 Å²	117	139.5 Å²	139.5	72%	0.718	72%	0.72	S	S	*	*			trans	66.7	147	149	44.9	0	0	0	0	118.6
1748	E	34	Very low	31.1	Very low	159 Å²	159	139.7 Å²	139.7	74%	0.743	72%	0.716	S	S	*	*			cis	-152.6	130	10.5	-138.4	154.2	-139.5	0	0	114.3
1749	N	33.9	Very low	31.5	Very low	127 Å²	127	141.5 Å²	141.5	68%	0.679	72%	0.715	S	S	*	*			trans	44.4	133.8	134.5	-64.1	-22.4	0	0	0	125.8
1750	N	35.1	Very low	31.6	Very low	119 Å²	119	141.3 Å²	141.3	64%	0.636	72%	0.719	S	S	*	*				109.8	127.7	120.5	-85.8	-11	0	0	0	123.6
1751	H	36.6	Very low	31.9	Very low	142 Å²	142	139.9 Å²	139.9	66%	0.657	72%	0.716	S	S	*	*			trans	68.8	147.4	146.2	-65.2	-35.2	0	0	0	119
1752	L	33.9	Very low	32.1	Very low	151 Å²	151	143.3 Å²	143.3	79%	0.791	72%	0.72	S	S	*	*			cis	-145.9	170.5	-0.1	-90.5	121.4	0	0	0	107.7
1753	I	34.7	Very low	32.5	Very low	120 Å²	120	140.7 Å²	140.7	62%	0.615	72%	0.717	S	S	*	*			cis	-176.1	159.3	-41.8	-115.3	166.7	0	0	0	108.2
1754	S	34.6	Very low	32.7	Very low	96 Å²	96	140.4 Å²	140.4	67%	0.671	72%	0.716	S	S	*	*			trans	70.5	150.2	164	77.8	0	0	0	0	119.1
1755	N	34.9	Very low	32.5	Very low	125 Å²	125	137.8 Å²	137.8	67%	0.668	71%	0.71	S	S	*	*			cis	-161.4	135.5	-21.5	-108.7	-16.9	0	0	0	110.7
1756	L	33.3	Very low	32.4	Very low	174 Å²	174	140.3 Å²	140.3	91%	0.911	72%	0.723	S	S	*	*			trans	-159.1	108.7	137.3	-115.1	166.6	0	0	0	108.9
1757	N	32.4	Very low	32.3	Very low	122 Å²	122	137.5 Å²	137.5	65%	0.652	72%	0.723	S	S	*	*			trans	-75.6	174.7	175.5	-55.7	-60.6	0	0	0	109
1758	Q	31.7	Very low	32.3	Very low	152 Å²	152	139 Å²	139	71%	0.71	73%	0.727	S	S	*	*			cis	-167.2	136.5	31.1	-152.9	168.7	-7	0	0	105.5
1759	Y	31.2	Very low	32.3	Very low	203 Å²	203	137.8 Å²	137.8	80%	0.796	73%	0.726	S	S	*	*				-160.8	166.7	70.7	-108.4	-94.8	0	0	0	111.1
1760	N	29.1	Very low	32.2	Very low	151 Å²	151	139.7 Å²	139.7	81%	0.807	73%	0.73	S	S	*	*			trans	-142	178.5	-177	-128.9	-15.5	0	0	0	109.7
1761	E	32	Very low	32	Very low	146 Å²	146	141.5 Å²	141.5	68%	0.682	74%	0.74	S	S	*	*			trans	76.3	148.3	171.5	-51.2	-162.8	-165.6	0	0	116.5
1762	R	30	Very low	31.8	Very low	202 Å²	202	141.5 Å²	141.5	76%	0.762	74%	0.744	S	S	*	*			cis	-158	176.1	-13.2	-115.1	-179.5	174.4	130.6	-5.2	109.1
1763	P	36.1	Very low	31.7	Very low	102 Å²	102	137.1 Å²	137.1	66%	0.662	72%	0.719	S	S	*	*			trans	-88.4	-165.4	-173.6	38.9	-38.2	0	0	0	114.2
1764	D	31.1	Very low	31.5	Very low	141 Å²	141	136.2 Å²	136.2	75%	0.754	72%	0.72	S	S	*	*			trans	92.1	101.1	161.6	-58.4	-28.9	0	0	0	120
1765	S	27.1	Very low	31.2	Very low	98 Å²	98	135.4 Å²	135.4	69%	0.685	71%	0.714	S	S	*	*				58.3	131.9	126.3	73	0	0	0	0	122.6
1766	L	27.1	Very low	30.9	Very low	177 Å²	177	139.6 Å²	139.6	93%	0.927	72%	0.721	S	S	*	*			trans	49.8	125	149.8	-80.1	83.8	0	0	0	119.2
1767	G	27.9	Very low	30.6	Very low	64 Å²	64	137.2 Å²	137.2	66%	0.66	71%	0.708	S	S	*	*			trans	149.8	112.4	136.6	0	0	0	0	0	117.3
1768	N	31.3	Very low	30.6	Very low	149 Å²	149	135.9 Å²	135.9	80%	0.797	70%	0.7	S	S	*	*			trans	75.1	124.9	138.2	-57.9	-6.1	0	0	0	120.3
1769	N	34.8	Very low	30.4	Very low	133 Å²	133	136.8 Å²	136.8	71%	0.711	70%	0.699	S	S	*	*			trans	78.1	122.2	148.2	-55.2	7.6	0	0	0	118.9
1770	E	31.4	Very low	30.4	Very low	167 Å²	167	131.1 Å²	131.1	78%	0.78	69%	0.688	S	S	*	*			cis	-158.1	160.4	-19	-136.5	160.7	-166.6	0	0	110.7	L1772	E1770-L1772 PolarHBondContact O-N 3.38Å
1771	N	30.5	Very low	30.5	Very low	156 Å²	156	130 Å²	130	83%	0.834	68%	0.682	S	S	*	*			trans	-88	99.8	-162.4	-68.7	-64.2	0	0	0	114.3
1772	L	32.4	Very low	30.1	Very low	143 Å²	143	132.2 Å²	132.2	75%	0.749	69%	0.69	S	S	*	*			trans	-119.7	59.8	159.2	-92.8	86.5	0	0	0	111.9	L40 E1770	L40-L1772 HydrophobicContact CD1-CD2 4Å; L40-L1772 HydrophobicContact CD1-CG 4.11Å; E1770-L1772 PolarHBondContact O-N 3.38Å
1773	E	32	Very low	29.8	Very low	58 Å²	58	129.8 Å²	129.8	27%	0.271	69%	0.685	S	S	.	*				47.9	117.9	115.9	-175.3	-173.7	-164.3	0	0	119.8	L40 L41 I42	L40-E1773 HydrophobicContact CD2-CB 3.51Å; L40-E1773 HydrophobicContact CD2-CG 3.57Å; L40-E1773 WeakPolarHBondContact CD2-O 3.5Å; L41-E1773 WeakPolarHBondContact CA-OE1 3.39Å; L41-E1773 PolarHBondContact N-OE1 2.84Å; I42-E1773 PolarHBondContact N-OE1 2.95Å; I42-E1773 VanDerWaalsContact N-OE1 3.14Å
1774	T	29.8	Very low	29.3	Very low	101 Å²	101	132.9 Å²	132.9	62%	0.62	70%	0.696	S	S	*	*			trans	31.9	146	146	79.7	0	0	0	0	124.3	T39	T39-T1774 WeakPolarHBondContact CB-O 3.06Å; T39-T1774 WeakPolarHBondContact CG2-O 3.33Å
1775	S	28.6	Very low	29	Very low	79 Å²	79	137.5 Å²	137.5	55%	0.552	70%	0.703	S	S	*	*			trans	75.3	140.9	-175.7	-61.8	0	0	0	0	114.5	T39	T39-S1775 VanDerWaalsContact CG2-O 3.27Å; T39-S1775 WeakPolarHBondContact CG2-O 3.29Å
1776	R	28.1	Very low	29	Very low	214 Å²	214	141 Å²	141	81%	0.808	71%	0.708	S	S	*	*			cis	-168.2	165.7	-22.2	-129.8	177.7	176.6	166.9	-0.6	107.8
1777	L	29.1	Very low	28.8	Very low	123 Å²	123	140.9 Å²	140.9	64%	0.644	70%	0.703	S	S	*	*			trans	71.8	130.1	143	-77.1	171.7	0	0	0	122.5
1778	L	31.6	Very low	28.6	Very low	94 Å²	94	145.9 Å²	145.9	49%	0.492	71%	0.709	S	S	.	*			trans	86.6	103.8	134.6	-61.9	166.3	0	0	0	122.6	D1781	L1778-D1781 HydrophobicContact CD2-CB 4.13Å; L1778-D1781 WeakPolarHBondContact CD2-OD1 3.33Å; L1778-D1781 WeakPolarHBondContact CD2-OD2 3.32Å
1779	Y	26.8	Very low	28.3	Very low	172 Å²	172	147.3 Å²	147.3	68%	0.675	71%	0.711	S	S	*	*	S	Bend		-124.7	127.6	114.3	-141.2	-69.5	0	0	0	108.2	L33	L33-Y1779 HydrophobicContact CD1-CE2 4.21Å
1780	S	30.7	Very low	27.9	Very low	83 Å²	83	147.7 Å²	147.7	58%	0.58	71%	0.713	S	S	*	*				-148.6	137	-66.1	54.5	0	0	0	0	113.4
1781	D	31.3	Very low	27.6	Very low	127 Å²	127	147.1 Å²	147.1	68%	0.679	71%	0.71	S	S	*	*			trans	-32	117.4	178	-61.6	-24.9	0	0	0	119	L1778	L1778-D1781 HydrophobicContact CD2-CB 4.13Å; L1778-D1781 WeakPolarHBondContact CD2-OD1 3.33Å; L1778-D1781 WeakPolarHBondContact CD2-OD2 3.32Å
1782	K	23.7	Very low	27.4	Very low	194 Å²	194	146.4 Å²	146.4	84%	0.843	70%	0.702	S	S	*	*				-151.1	135.1	124.9	-93.5	-177.2	-178.6	179.8	0	105.9
1783	F	24.7	Very low	27.1	Very low	151 Å²	151	146.3 Å²	146.3	66%	0.662	70%	0.7	S	S	*	*	S	Bend	cis	-146.4	116.6	18.3	-159.1	-97.3	0	0	0	109.7	E1786	F1783-E1786 HydrophobicContact CE1-CG 4.14Å
1784	N	25.4	Very low	26.8	Very low	167 Å²	167	148.1 Å²	148.1	89%	0.893	72%	0.716	S	S	*	*			trans	-147.9	63.1	171.6	-149.9	-5.7	0	0	0	111.7
1785	R	25.3	Very low	26.7	Very low	237 Å²	237	150 Å²	150	89%	0.894	72%	0.722	S	S	*	*			trans	-149.4	68.9	171.3	-100.8	-157.6	-179.1	-160.7	2.7	111.1
1786	E	26.2	Very low	26.6	Very low	172 Å²	172	151.5 Å²	151.5	80%	0.804	72%	0.724	S	S	*	*			trans	-128.4	59.4	153.5	-76.3	-163.9	164.8	0	0	110.4	F1783	F1783-E1786 HydrophobicContact CE1-CG 4.14Å
1787	Q	24.1	Very low	26.5	Very low	175 Å²	175	148.6 Å²	148.6	82%	0.818	72%	0.717	S	S	*	*	S	Bend	trans	-89.4	115.6	147.6	-81.5	-138.9	-12.9	0	0	109.2
1788	Q	23.3	Very low	26.4	Very low	169 Å²	169	145.6 Å²	145.6	79%	0.79	71%	0.707	S	S	*	*	S	Bend	trans	41.9	81.4	148.5	-56.3	-175	6.5	0	0	118.1
1789	Q	24.2	Very low	26.2	Very low	179 Å²	179	144.1 Å²	144.1	84%	0.836	70%	0.702	S	S	*	*				179	154.2	124.3	-98.9	166.9	30.3	0	0	111.4
1790	N	27.5	Very low	26.2	Very low	140 Å²	140	137.7 Å²	137.7	75%	0.749	68%	0.679	S	S	*	*			trans	60.8	102.4	176.7	-56.7	-15.9	0	0	0	114
1791	Q	23.4	Very low	26.3	Very low	155 Å²	155	138.1 Å²	138.1	72%	0.724	68%	0.68	S	S	*	*			cis	63.6	128.2	31.4	-146.2	-168.2	-24.1	0	0	113.1
1792	H	26.9	Very low	26.2	Very low	141 Å²	141	133.8 Å²	133.8	65%	0.653	66%	0.656	S	S	*	*			trans	83.6	130.7	166.1	-76.5	-70.7	0	0	0	121.5
1793	I	26.4	Very low	26.4	Very low	141 Å²	141	129.1 Å²	129.1	72%	0.723	64%	0.644	S	S	*	*			trans	77.7	124.5	136	-69.8	170.2	0	0	0	116
1794	T	26.3	Very low	26.5	Very low	97 Å²	97	125.5 Å²	125.5	60%	0.595	63%	0.632	S	S	*	*			cis	-163.3	152.7	2.7	15.6	0	0	0	0	111.9
1795	D	26.5	Very low	26.6	Very low	139 Å²	139	120.3 Å²	120.3	74%	0.743	60%	0.604	S	S	*	*			trans	57.9	157.6	142.1	-46.3	-22.6	0	0	0	119.8
1796	D	26.4	Very low	26.5	Very low	112 Å²	112	113.2 Å²	113.2	60%	0.599	59%	0.587	S	S	*	*			cis	-155.6	162	10.6	-148.4	-18.2	0	0	0	113.4
1797	F	27.5	Very low	26.4	Very low	152 Å²	152	112.9 Å²	112.9	67%	0.667	59%	0.585	S	S	*	*			trans	59.8	148.2	168.9	-52.1	-70.6	0	0	0	121.2
1798	S	26.3	Very low	26.4	Very low	61 Å²	61	110.9 Å²	110.9	43%	0.427	58%	0.579	S	S	.	*			cis	-175.3	163.1	-23.1	63.3	0	0	0	0	115.2	F11 I12	F11-S1798 WeakPolarHBondContact O-CB 3.34Å; I12-S1798 VanDerWaalsContact C-OG 3.3Å; I12-S1798 VanDerWaalsContact O-CB 3.27Å; I12-S1798 WeakPolarHBondContact O-CB 3.45Å; I12-S1798 PolarHBondContact O-OG 3.37Å
1799	T	26.8	Very low	26.4	Very low	62 Å²	62	113.4 Å²	113.4	38%	0.38	58%	0.581	S	S	.	*			trans	97.6	102.6	145.6	-35	0	0	0	0	125.1	K8 Q10 I12	K8-T1799 PolarHBondContact NZ-O 2.81Å; Q10-T1799 CarbonylContact O-C 3.57Å; Q10-T1799 WeakPolarHBondContact O-CA 3.23Å; Q10-T1799 PolarHBondContact O-N 3.09Å; I12-T1799 WeakPolarHBondContact CA-OG1 3.48Å; I12-T1799 PolarHBondContact N-OG1 3.48Å
1800	I	28.3	Very low	26.3	Very low	38 Å²	38	109.3 Å²	109.3	20%	0.195	57%	0.572	C	S	.	*				9.3	169.4	126.6	-24	-178.6	0	0	0	120.6	K8 Q10 F11	K8-I1800 VanDerWaalsContact NZ-C 3.26Å; K8-I1800 PolarHBondContact NZ-O 2.93Å; Q10-I1800 VanDerWaalsContact C-CG1 3.44Å; Q10-I1800 HydrophobicContact CG-CD1 3.9Å; Q10-I1800 WeakPolarHBondContact O-CG1 3.39Å; Q10-I1800 PolarHBondContact O-N 3.33Å; F11-I1800 HydrophobicContact CB-CD1 4.18Å; F11-I1800 HydrophobicContact CD1-CD1 3.4Å; F11-I1800 HydrophobicContact CD1-CG1 4.4Å; F11-I1800 HydrophobicContact CD2-CD1 4.14Å; F11-I1800 HydrophobicContact CE1-CD1 3.76Å; F11-I1800 HydrophobicContact CE2-CD1 4.44Å; F11-I1800 HydrophobicContact CG-CD1 3.62Å; F11-I1800 HydrophobicContact CZ-CD1 4.27Å
1801	P	32	Very low	26.1	Very low	92 Å²	92	108.3 Å²	108.3	60%	0.597	57%	0.572	S	S	*	*			cis	-94.8	164.4	-35.8	7.6	15.8	0	0	0	112.3	K8	K8-P1801 WeakPolarHBondContact CD-O 3.45Å; K8-P1801 PolarHBondContact NZ-O 3.23Å
1802	N	28.1	Very low	26.2	Very low	35 Å²	35	108.8 Å²	108.8	19%	0.187	57%	0.573	C	S	.	*			cis	86.6	101.4	43.8	-97.5	6.6	0	0	0	114.6	F6 L7 K8	F6-N1802 VanDerWaalsContact C-OD1 3.24Å; F6-N1802 WeakPolarHBondContact CA-OD1 3.4Å; F6-N1802 HydrophobicContact CB-CB 4.4Å; F6-N1802 WeakPolarHBondContact CB-OD1 3.16Å; F6-N1802 HydrophobicContact CD1-CB 3.28Å; F6-N1802 VanDerWaalsContact CD1-CG 3.42Å; F6-N1802 HydrophobicContact CE1-CB 3.66Å; F6-N1802 VanDerWaalsContact CE1-O 3.31Å; F6-N1802 WeakPolarHBondContact CE1-O 3.31Å; F6-N1802 HydrophobicContact CG-CB 4.07Å; L7-N1802 WeakPolarHBondContact CA-OD1 3.43Å; L7-N1802 HydrophobicContact CB-CB 4.45Å; L7-N1802 WeakPolarHBondContact CB-OD1 3.33Å; L7-N1802 PolarHBondContact O-OD1 2.71Å; K8-N1802 PolarHBondContact N-OD1 3.11Å; K8-N1802 PolarHBondContact O-ND2 3.27Å; K8-N1802 PolarHBondContact O-OD1 3.2Å
1803	V	29.5	Very low	26.1	Very low	97 Å²	97	109.6 Å²	109.6	59%	0.588	58%	0.582	S	S	*	*			trans	-159.1	-162.4	157.4	-104.6	0	0	0	0	114.1	F6	F6-V1803 VanDerWaalsContact CD1-N 3.35Å; F6-V1803 HydrophobicContact CE1-CG1 4.32Å; F6-V1803 PolarHBondContact N-O 3.24Å
1804	D	26.1	Very low	25.9	Very low	75 Å²	75	107.6 Å²	107.6	40%	0.401	58%	0.58	S	S	.	*	B	Isolated β-bridge	trans	-102.5	159	-147.9	-67	-108.4	0	0	0	120.9	K5	K5-D1804 VanDerWaalsContact CD-OD1 3.32Å; K5-D1804 WeakPolarHBondContact CD-OD1 3.29Å; K5-D1804 WeakPolarHBondContact CE-OD1 3.32Å; K5-D1804 WeakPolarHBondContact CE-OD2 3.2Å; K5-D1804 HydrophobicContact CG-CB 4.46Å; K5-D1804 WeakPolarHBondContact CG-OD1 3.17Å; K5-D1804 IonicContact NZ-OD1 2.66Å; K5-D1804 PolarHBondContact NZ-OD1 3.32Å; K5-D1804 IonicContact NZ-OD2 3.81Å; K5-D1804 PolarHBondContact NZ-OD2 3.49Å
1805	N	26.4	Very low	25.8	Very low	58 Å²	58	108.2 Å²	108.2	31%	0.31	58%	0.58	S	S	.	*			trans	-18.3	156.2	136.4	-119.9	8.6	0	0	0	116.8	I4	I4-N1805 PolarHBondContact N-ND2 3.44Å; I4-N1805 WeakPolarHBondContact O-CA 3.34Å; I4-N1805 VanDerWaalsContact O-CB 3.24Å; I4-N1805 WeakPolarHBondContact O-CB 3.48Å; I4-N1805 PolarHBondContact O-N 3.46Å
1806	T	24.4	Very low	25.7	Very low	87 Å²	87	106 Å²	106	53%	0.534	57%	0.574	S	S	.	*			cis	-155.2	137.9	37.9	-23.7	0	0	0	0	113.2
1807	E	23.2	Very low	25.5	Very low	165 Å²	165	106.4 Å²	106.4	77%	0.771	57%	0.571	S	S	*	*			trans	71	160.6	139.1	-141.4	167.6	-143.4	0	0	121.1
1808	I	24.1	Very low	25.4	Very low	134 Å²	134	109 Å²	109	69%	0.687	60%	0.599	S	S	*	*			trans	76.6	92.5	163.4	-46.2	-175.2	0	0	0	119.2
1809	R	23.2	Very low	25.4	Very low	221 Å²	221	111.4 Å²	111.4	83%	0.834	61%	0.607	S	S	*	*			trans	73.3	112.5	137.8	-67.4	179.3	-177.9	172.9	2	122.2
1810	S	22.9	Very low	25.3	Very low	94 Å²	94	114 Å²	114	66%	0.657	62%	0.619	S	S	*	*				24.8	139.1	108.1	64.5	0	0	0	0	118.9
1811	T	23.8	Very low	25.2	Very low	119 Å²	119	118.2 Å²	118.2	73%	0.73	64%	0.643	S	S	*	*			cis	-166	165.2	19.1	0.1	0	0	0	0	111.4
1812	H	26.1	Very low	24.8	Very low	165 Å²	165	119.8 Å²	119.8	76%	0.764	65%	0.646	S	S	*	*			trans	-0.4	126.2	146.1	-71.7	-102.2	0	0	0	116.4
1813	L	23.4	Very low	24.6	Very low	158 Å²	158	125.1 Å²	125.1	83%	0.827	67%	0.674	S	S	*	*			cis	65.5	129.1	39.1	-129.5	178.6	0	0	0	112.3
1814	S	23.2	Very low	24.2	Very low	98 Å²	98	126.9 Å²	126.9	69%	0.685	68%	0.68	S	S	*	*			trans	54.3	105.5	-174	61.8	0	0	0	0	117.5
1815	D	23.1	Very low	24.1	Very low	110 Å²	110	130.6 Å²	130.6	59%	0.588	70%	0.7	S	S	*	*			trans	-173.2	158.9	135.8	-113.5	-10.7	0	0	0	114.3
1816	C	25.2	Very low	23.9	Very low	94 Å²	94	136.2 Å²	136.2	64%	0.635	73%	0.73	S	S	*	*			trans	77.7	80.7	168.9	-61.6	0	0	0	0	119.9
1817	F	22.1	Very low	23.9	Very low	120 Å²	120	140.3 Å²	140.3	53%	0.526	75%	0.746	S	S	.	*			trans	-82.7	134.4	143.1	-104.4	-100.9	0	0	0	110	D870 H872	D870-F1817 HydrophobicContact CB-CE2 3.88Å; D870-F1817 HydrophobicContact CB-CZ 3.86Å; H872-F1817 HydrophobicContact CB-CE1 4.46Å; H872-F1817 HydrophobicContact CB-CZ 4.08Å
1818	V	26.3	Very low	23.9	Very low	206 Å²	206	138.1 Å²	138.1	100%	1.248	74%	0.744	S	S	*	*			trans	-144.2	0	156.2	179.2	0	0	0	0	107.2

Retrieved 1,818 of 1,818 residues in 273.9 ms (Link to these results)

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