A0A3Q0KTG1_SCHMA Loading...

Ig-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KTG1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,036 aa.

						>A0A3Q0KTG1_SCHMA|A0A3Q0KTG1
MIVLKAKDTLPSEQNHTIVLLDLKSGNNNLSIHHYLSNIIQSMINKQDSFEQNHYIKTGSIITIDCIVFSIKNKFRNELFNLIKQPIHQQPVNRHLKRLYYTDCALINNKSDLYGIHCNYLSFKQKITNNKNELNEYNKFPYKQIDIFRYTIYQVNNSFNGRWICYSDDDNNKSSKVHNLIISDSQDSEVQSHIHTPTPSTTSVHVKCDYTLSSNVTNITELHKNNSNEHNKNLMNVKTINWELLLNPFDQLKLNAKNKRNGFVHDEGIDLFTPKINRFTDPEVSKRKIDCQITGQQQRRDKRQVDYDVYYPSKSVRLDTNLSPDYFVQVGTILEIKCTAEPGNPPPKLSLLRQRFDESKATVIQTKTKHLSQSNSFMNTHKDITQEFMVTLSEEDNGASFFCEVTSTGIKSSKARSDSVRYNVSFPPRAVYVQSYPEGLIAESSQKMFSCQTDSMGSNPPAILKWQQLDSAGAIISLETLKMSVTVDFITQSNGAVVTRSNLTVLASRALNGRRFECSVVFNDSKTLLRSEGFLEVMFSPNNIRLTAQPINGVPEAGRLELTCATSSCHPPAVIRWLEIPPDKIQEKNKNIEEHFQYNKLFSNELTDLAQLETNQGDFGGTKVLSTLIITKTYRSHQNTIYQCLVNHTGMNKPVLSEHRLQILYPPSIHIISLPNQPIARQSVILFCQAIGGNPSNDLTYAWFVAKSTQFSSLLKQDDDTQLNDDQYEEDTDNSLNLSSLKNHFISSSLVTQRPEFDSMIQLSGYHDSQLNLTNIKLSQAGWYGCEVSGIGGSSHALHHLDLYYQPVMNRRTQTHVMVQLGESVTLALYVDANPPWAEAEWFQINTFKDEAGKMHNSEQYVEPQAYFEPPQINYGYPQSYDSWPRVRRTIFNRFESHLSTSDFSGEQNLRQSIGQRKNIFASSGTGLYGNLTFFLRFTEVKSVDFGTYVCQVRHQLGVKEFTFHLIKKAGAEVITEESIEVIHHGPTTSILFSPPLKSSLMKLILRVCRRDAFLGNHKQIDKQSVSKQHFKRDIPQQKVSITSKNVSNQNDVASRLDSSQISANSRTVGCEDYQVAKPWLGKMEIHLSDAVQLYNFRFLLFQGTKLLQETSPVLWQPEISKTRGVFNKSLLALAASGGCALVIVFLITIIIIYSCYGRNKHDSLKFWNIKKSLKSSTSQQSSKNLDVPNHIGCELGFELHSDLGSVRRYQPETPYKQPPPSGSFISNGYDNSLNGIHHFNSLQNSAINGGLDGHSIDNECAALLHSRNSVASSQSAHMNMINSRIFAEAYAAAARAAASLVSGSTDIYSPSSQVTNDLSSQNNEERNRSQHSLLYSMNQEINNGFINGSKEANINTENTGGWKKYNNSNSSICLKNRDKRKANEISKYKNSLQGIRKHSRISLSGQLEPRGSHLSVQMPSKHSLNYSQWSNASGASYSSLVSPSQTDLQVAAQVAAAAAVVSVVENMNLSLAMNHASSLNNVGNYCLMPRPASRAASVTGPTTRNINKLWMENEDGESMKLGLFTPRNASTGQATPTASVDTVDPNLQISTPSPISQQQQYSNDVNNNNNRNQLSLNNQQINGSFISQFNAVPQTKLDDRYHQNYNPNRSADSQNISNLYAYQQQQMYPIHGPRGPYSTFISPTSQTNISSPSNLSGNEQNPSLMAYYRILAQNQMLNRHKLQQFHQYQLIQQQQHQRQQQQQHGKNDQSKQTFNMNRLHQQINGSKNFISDQKDQKNNLENCTQPNQEVEPKKDLKSIQINKIVSECVDKQLDPVNSNKFQDQDIQKSVNKHEENSSINQKDEHDRSLIMNPDLNEINQTINLDNAQSNIPKQVLTTEINTCHKTTDQISSNETPSLLLNDRQMINPTDINNENTPNNKNFNQPLTVTITSDPYYNSVTNHNIYYKYSEHQSPPLNNTEYNEHKFNDNNCHIHSSKQSQSSIYSQNTSQSPASPPSQPLQSTQQSKQQPRLGIHSPIRTNRYLNSTEQSAFKQVGMNQEKLSLSNDIKLSIPNDNKSADNYLSNEINIHSNSIA
					

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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	35.1	Very low	32.5	Very low	102 Å²	102	107.5 Å²	107.5	50%	0.502	59%	0.585	S	S	.	*				0	131.6	0	-173.8	178.5	-161	0	0	107.8	V3 V19 L20 L21 I39	M1-V3 HydrophobicContact CE-CG2 4.46Å; M1-V19 HydrophobicContact CE-CB 4.46Å; M1-V19 HydrophobicContact CE-CG1 3.21Å; M1-V19 HydrophobicContact CE-CG2 4.49Å; M1-L20 CarbonylContact C-O 3.35Å; M1-L20 WeakPolarHBondContact CA-O 3.25Å; M1-L21 HydrophobicContact CB-CD2 4.03Å; M1-L21 HydrophobicContact CE-CD1 4.38Å; M1-L21 HydrophobicContact CE-CD2 4.02Å; M1-L21 HydrophobicContact CE-CG 4.25Å; M1-L21 HydrophobicContact CG-CD2 3.75Å; M1-L21 HydrophobicContact CG-CG 4.27Å; M1-L21 HydrophobicContact SD-CD2 3.97Å; M1-I39 HydrophobicContact CE-CB 4.3Å; M1-I39 HydrophobicContact CE-CD1 4.01Å; M1-I39 HydrophobicContact CE-CG2 3.54Å; M1-I39 HydrophobicContact SD-CD1 3.95Å; M1-I39 HydrophobicContact SD-CG2 3.87Å
2	I	31.7	Very low	32.5	Very low	100 Å²	100	109 Å²	109	51%	0.513	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.5	121.6	174.4	-51	173.8	0	0	0	106.9	L4 L20	I2-L4 HydrophobicContact CG2-CD2 3.76Å; I2-L4 HydrophobicContact CG2-CG 3.99Å; I2-L20 HydrophobicContact CB-CB 4.12Å; I2-L20 HydrophobicContact CB-CD1 4.23Å; I2-L20 HydrophobicContact CB-CG 4.45Å; I2-L20 HydrophobicContact CD1-CD1 4.34Å; I2-L20 PolarHBondContact N-O 2.72Å; I2-L20 PolarHBondContact O-N 3.17Å
3	V	37.5	Very low	33.1	Very low	74 Å²	74	112.2 Å²	112.2	45%	0.448	62%	0.616	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.9	100.4	174.8	-176.8	0	0	0	0	107.4	M1 K5 T17 I18 M43	M1-V3 HydrophobicContact CE-CG2 4.46Å; V3-K5 PolarHBondContact O-N 3.07Å; V3-T17 HydrophobicContact CG1-CG2 3.57Å; V3-I18 CarbonylContact C-O 3.6Å; V3-M43 HydrophobicContact CG2-SD 4.45Å
4	L	33.6	Very low	33.8	Very low	86 Å²	86	110.7 Å²	110.7	45%	0.45	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.4	100.3	176.2	-66.9	-179	0	0	0	108.8	I2 A6 I18 L20	I2-L4 HydrophobicContact CG2-CD2 3.76Å; I2-L4 HydrophobicContact CG2-CG 3.99Å; L4-A6 PolarHBondContact O-N 3.44Å; L4-I18 HydrophobicContact CB-CB 4.16Å; L4-I18 PolarHBondContact N-O 2.7Å; L4-I18 PolarHBondContact O-N 3.42Å; L4-L20 HydrophobicContact CD1-CD1 3.68Å; L4-L20 HydrophobicContact CD1-CG 4.17Å; L4-L20 HydrophobicContact CG-CD1 4.26Å
5	K	36.3	Very low	34.6	Very low	94 Å²	94	106.5 Å²	106.5	41%	0.409	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.3	117.7	170.4	-173.1	169.6	-176	173	0	109.2	V3 K7 H54	V3-K5 PolarHBondContact O-N 3.07Å; K5-K7 PolarHBondContact O-N 3.5Å; K5-K7 VanDerWaalsContact O-N 3.08Å; K5-H54 PolarHBondContact NZ-CD2 3.41Å; K5-H54 PolarHBondContact NZ-NE2 2.72Å
6	A	36.4	Very low	35.5	Very low	60 Å²	60	102.5 Å²	102.5	50%	0.496	56%	0.556	S	S	.	*			trans	-74.9	99.5	177.5	0	0	0	0	0	109.6	L4 H16	L4-A6 PolarHBondContact O-N 3.44Å; A6-H16 HydrophobicContact CB-CB 4.43Å; A6-H16 PolarHBondContact N-O 3.46Å
7	K	28.1	Very low	36.2	Very low	174 Å²	174	98 Å²	98	76%	0.757	53%	0.533	S	S	*	.			trans	-81.4	150.1	158.7	-102.9	-173.6	173.4	-176.1	0	109.6	K5	K5-K7 PolarHBondContact O-N 3.5Å; K5-K7 VanDerWaalsContact O-N 3.08Å
8	D	28	Very low	36.7	Very low	132 Å²	132	95.3 Å²	95.3	71%	0.706	52%	0.517	S	S	*	.	S	Bend	trans	80.8	131.9	172.1	-50.2	-19.7	0	0	0	117.9
9	T	30	Very low	37.3	Very low	144 Å²	144	90.3 Å²	90.3	88%	0.883	49%	0.49	S	S	*	.	S	Bend	trans	71.1	54.2	168.8	62.3	0	0	0	0	119.4
10	L	29.8	Very low	37.4	Very low	109 Å²	109	87.5 Å²	87.5	57%	0.571	47%	0.474	S	S	*	.	S	Bend	trans	-141.7	155.9	153.6	-95	135.3	0	0	0	110.5
11	P	30.7	Very low	37.8	Very low	107 Å²	107	83.7 Å²	83.7	70%	0.695	45%	0.454	S	S	*	.			trans	-62.1	159.9	173	-21.9	35	0	0	0	113	E13	P11-E13 PolarHBondContact O-N 3.44Å
12	S	32.2	Very low	38.2	Very low	126 Å²	126	82 Å²	82	88%	0.881	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	23.7	-156.7	50.9	0	0	0	0	118.3
13	E	41.3	Very low	38.9	Very low	150 Å²	150	79.7 Å²	79.7	70%	0.701	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.3	-4.6	-170.7	-61.7	-173.3	150.1	0	0	115.3	P11 I61	P11-E13 PolarHBondContact O-N 3.44Å; E13-I61 PolarHBondContact O-N 2.73Å
14	Q	42.1	Very low	38.8	Very low	92 Å²	92	85 Å²	85	43%	0.43	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	115.1	-178.4	-62.9	-170.7	-1.1	0	0	112.7	H16 I61	Q14-H16 PolarHBondContact O-N 2.91Å; Q14-I61 HydrophobicContact CG-CB 4.45Å
15	N	46.3	Very low	38.9	Very low	48 Å²	48	85.5 Å²	85.5	26%	0.257	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	92.6	174.3	-88.7	-65.7	0	0	0	110.5	I61 I62 T63	N15-I61 PolarHBondContact N-O 2.77Å; N15-I62 HydrophobicContact CB-CG1 4.37Å; N15-I62 WeakPolarHBondContact O-CA 3.44Å; N15-T63 PolarHBondContact O-N 3.31Å; N15-T63 VanDerWaalsContact O-N 3.13Å
16	H	48.9	Very low	38.6	Very low	42 Å²	42	84.4 Å²	84.4	19%	0.194	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	124.7	172.6	-110.3	96.8	0	0	0	111.5	A6 Q14 T63	A6-H16 HydrophobicContact CB-CB 4.43Å; A6-H16 PolarHBondContact N-O 3.46Å; Q14-H16 PolarHBondContact O-N 2.91Å; H16-T63 WeakPolarHBondContact NE2-CG2 3.46Å
17	T	48.1	Very low	38.2	Very low	26 Å²	26	87.8 Å²	87.8	16%	0.16	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	114.5	177.8	-53.9	0	0	0	0	109.5	V3 V19 T63 I64 D65	V3-T17 HydrophobicContact CG1-CG2 3.57Å; T17-V19 HydrophobicContact CG2-CG2 4.38Å; T17-T63 PolarHBondContact N-O 2.93Å; T17-I64 VanDerWaalsContact O-CA 3.29Å; T17-I64 WeakPolarHBondContact O-CA 3.44Å; T17-D65 PolarHBondContact O-N 2.87Å
18	I	45.3	Very low	38.4	Very low	49 Å²	49	86 Å²	86	25%	0.251	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	134.5	177.5	-61.2	171.8	0	0	0	108.7	V3 L4 L20 D65 I67	V3-I18 CarbonylContact C-O 3.6Å; L4-I18 HydrophobicContact CB-CB 4.16Å; L4-I18 PolarHBondContact N-O 2.7Å; L4-I18 PolarHBondContact O-N 3.42Å; I18-L20 HydrophobicContact CG2-CD2 3.96Å; I18-D65 HydrophobicContact CG1-CB 4.24Å; I18-I67 HydrophobicContact CG2-CD1 3.93Å; I18-I67 HydrophobicContact CG2-CG1 4.36Å
19	V	46.8	Very low	38.6	Very low	1 Å²	1	87.2 Å²	87.2	1%	0.006	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	102.5	-174.8	167	0	0	0	0	109.1	M1 T17 L21 M43 I64 D65 C66 I67	M1-V19 HydrophobicContact CE-CB 4.46Å; M1-V19 HydrophobicContact CE-CG1 3.21Å; M1-V19 HydrophobicContact CE-CG2 4.49Å; T17-V19 HydrophobicContact CG2-CG2 4.38Å; V19-L21 HydrophobicContact CG1-CD1 3.82Å; V19-L21 HydrophobicContact CG1-CG 3.99Å; V19-M43 HydrophobicContact CG2-CE 4.46Å; V19-I64 HydrophobicContact CB-CG2 4.25Å; V19-I64 HydrophobicContact CG2-CG2 3.64Å; V19-D65 PolarHBondContact N-O 2.85Å; V19-C66 CarbonylContact O-C 3.57Å; V19-C66 WeakPolarHBondContact O-CA 3.39Å; V19-I67 PolarHBondContact O-N 3.06Å
20	L	40.5	Very low	38.8	Very low	33 Å²	33	86.3 Å²	86.3	17%	0.173	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	118.9	176.6	-54	-175.8	0	0	0	110.1	M1 I2 L4 I18 I67 F69	M1-L20 CarbonylContact C-O 3.35Å; M1-L20 WeakPolarHBondContact CA-O 3.25Å; I2-L20 HydrophobicContact CB-CB 4.12Å; I2-L20 HydrophobicContact CB-CD1 4.23Å; I2-L20 HydrophobicContact CB-CG 4.45Å; I2-L20 HydrophobicContact CD1-CD1 4.34Å; I2-L20 PolarHBondContact N-O 2.72Å; I2-L20 PolarHBondContact O-N 3.17Å; L4-L20 HydrophobicContact CD1-CD1 3.68Å; L4-L20 HydrophobicContact CD1-CG 4.17Å; L4-L20 HydrophobicContact CG-CD1 4.26Å; I18-L20 HydrophobicContact CG2-CD2 3.96Å; L20-I67 HydrophobicContact CD2-CB 3.87Å; L20-I67 HydrophobicContact CD2-CD1 3.86Å; L20-I67 HydrophobicContact CD2-CG1 4.21Å; L20-I67 HydrophobicContact CD2-CG2 4.39Å; L20-F69 HydrophobicContact CB-CE2 4.26Å; L20-F69 HydrophobicContact CD2-CE2 4.15Å; L20-F69 HydrophobicContact CD2-CZ 4.45Å
21	L	45.3	Very low	39.8	Very low	8 Å²	8	83.8 Å²	83.8	4%	0.042	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	98.8	180	-80	161.1	0	0	0	111.2	M1 V19 L36 I39 I67 V68 F69	M1-L21 HydrophobicContact CB-CD2 4.03Å; M1-L21 HydrophobicContact CE-CD1 4.38Å; M1-L21 HydrophobicContact CE-CD2 4.02Å; M1-L21 HydrophobicContact CE-CG 4.25Å; M1-L21 HydrophobicContact CG-CD2 3.75Å; M1-L21 HydrophobicContact CG-CG 4.27Å; M1-L21 HydrophobicContact SD-CD2 3.97Å; V19-L21 HydrophobicContact CG1-CD1 3.82Å; V19-L21 HydrophobicContact CG1-CG 3.99Å; L21-L36 HydrophobicContact CD1-CD2 3.36Å; L21-I39 HydrophobicContact CD2-CD1 4.4Å; L21-I67 PolarHBondContact N-O 2.9Å; L21-V68 HydrophobicContact CB-CG2 4.47Å; L21-F69 PolarHBondContact O-N 3.08Å; L21-F69 VanDerWaalsContact O-N 3.09Å
22	D	43.6	Very low	40.7	Very low	68 Å²	68	82.3 Å²	82.3	36%	0.364	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	111.6	161.9	174.8	32.2	0	0	0	109.1
23	L	46.3	Very low	41.4	Very low	51 Å²	51	79 Å²	79	27%	0.267	43%	0.43	S	S	.	.			trans	-104.5	92.3	-178.1	-67.8	-179.2	0	0	0	110.5	S25 I32 V68	L23-S25 PolarHBondContact O-N 2.79Å; L23-I32 HydrophobicContact CD1-CD1 3.84Å; L23-I32 HydrophobicContact CD1-CG1 4.02Å; L23-V68 HydrophobicContact CD1-CG1 3.75Å; L23-V68 HydrophobicContact CG-CG1 4.33Å
24	K	34.9	Very low	41.8	Very low	184 Å²	184	75.9 Å²	75.9	80%	0.8	42%	0.415	S	S	*	.			trans	-68.8	78.7	170.5	-74.7	-180	179.6	170.5	0	111.3	G26	K24-G26 PolarHBondContact O-N 2.9Å
25	S	36.5	Very low	42.4	Very low	98 Å²	98	77.3 Å²	77.3	69%	0.685	42%	0.417	S	S	*	.			trans	-63	126.5	178.7	-174.1	0	0	0	0	111.7	L23	L23-S25 PolarHBondContact O-N 2.79Å
26	G	29.1	Very low	42.7	Very low	70 Å²	70	75.4 Å²	75.4	72%	0.722	41%	0.407	S	S	*	.			trans	-143.8	44.5	-174	0	0	0	0	0	112.6	K24	K24-G26 PolarHBondContact O-N 2.9Å
27	N	28.5	Very low	43	Very low	132 Å²	132	75.1 Å²	75.1	71%	0.706	41%	0.41	S	S	*	.	S	Bend	trans	75.9	138.5	178.6	-70.7	25	0	0	0	118
28	N	32.3	Very low	43.2	Very low	135 Å²	135	78 Å²	78	72%	0.722	42%	0.424	S	S	*	.			trans	81.8	93.6	156.4	-59.8	8	0	0	0	120.3
29	N	32.4	Very low	43.7	Very low	158 Å²	158	77.3 Å²	77.3	85%	0.845	42%	0.421	S	S	*	.				63.2	49.2	127.5	-58.2	19.4	0	0	0	120.5
30	L	34.8	Very low	44.1	Very low	125 Å²	125	77.7 Å²	77.7	65%	0.654	42%	0.423	S	S	*	.			trans	-121.8	141.7	143.2	-98.3	88.4	0	0	0	109.7	H34	L30-H34 HydrophobicContact CD2-CB 4.32Å
31	S	49.7	Very low	44.6	Very low	57 Å²	57	78.6 Å²	78.6	40%	0.399	43%	0.426	S	S	.	.			trans	-70.5	144	175.9	63.2	0	0	0	0	111.2	H33 H34	S31-H33 PolarHBondContact O-N 2.97Å; S31-H33 VanDerWaalsContact O-N 3.14Å; S31-H34 PolarHBondContact O-N 3.08Å
32	I	49.8	Very low	44.9	Very low	75 Å²	75	81.4 Å²	81.4	39%	0.385	45%	0.447	S	S	.	.	H	α-helix	trans	-55.6	-34.2	-179.6	-76.6	174.4	0	0	0	111.4	L23 H34 Y35 L36	L23-I32 HydrophobicContact CD1-CD1 3.84Å; L23-I32 HydrophobicContact CD1-CG1 4.02Å; I32-H34 PolarHBondContact O-N 2.65Å; I32-Y35 PolarHBondContact O-N 3.47Å; I32-L36 HydrophobicContact CG2-CD1 3.71Å; I32-L36 HydrophobicContact CG2-CG 4.16Å; I32-L36 WeakPolarHBondContact O-CG 3.07Å; I32-L36 PolarHBondContact O-N 3.18Å
33	H	46.8	Very low	45.2	Very low	56 Å²	56	81.7 Å²	81.7	26%	0.259	45%	0.447	S	S	.	.	H	α-helix	trans	-60.6	-36.5	176.1	-65.8	-70.9	0	0	0	113.9	S31 L36 S37 Y150 C165	S31-H33 PolarHBondContact O-N 2.97Å; S31-H33 VanDerWaalsContact O-N 3.14Å; H33-L36 PolarHBondContact O-N 2.95Å; H33-S37 VanDerWaalsContact O-CB 3.24Å; H33-S37 WeakPolarHBondContact O-CB 3.44Å; H33-S37 PolarHBondContact O-N 3.29Å; H33-Y150 PolarHBondContact ND1-OH 3.29Å; H33-C165 HydrophobicContact CB-CB 4.2Å
34	H	50.5	Low	45.4	Very low	85 Å²	85	83.7 Å²	83.7	39%	0.394	46%	0.457	S	S	.	.	H	α-helix	trans	-70.2	-36.3	177.1	-165.4	-21.7	0	0	0	111.6	L30 S31 I32 N38	L30-H34 HydrophobicContact CD2-CB 4.32Å; S31-H34 PolarHBondContact O-N 3.08Å; I32-H34 PolarHBondContact O-N 2.65Å; H34-N38 PolarHBondContact ND1-ND2 3.28Å; H34-N38 PolarHBondContact ND1-OD1 3.31Å; H34-N38 VanDerWaalsContact O-CG 3.3Å; H34-N38 PolarHBondContact O-N 3Å; H34-N38 VanDerWaalsContact O-N 3.11Å
35	Y	53.6	Low	45.8	Very low	123 Å²	123	80.3 Å²	80.3	48%	0.482	45%	0.447	S	S	.	.	H	α-helix	trans	-69.1	-41.8	176	-151.7	-96.4	0	0	0	111.3	I32 I39	I32-Y35 PolarHBondContact O-N 3.47Å; Y35-I39 HydrophobicContact CD1-CD1 3.68Å; Y35-I39 HydrophobicContact CE1-CD1 3.76Å; Y35-I39 WeakPolarHBondContact O-CD1 3.37Å; Y35-I39 VanDerWaalsContact O-CG1 3.32Å; Y35-I39 WeakPolarHBondContact O-CG1 3.41Å; Y35-I39 PolarHBondContact O-N 3.09Å
36	L	54	Low	46.1	Very low	7 Å²	7	83.1 Å²	83.1	4%	0.037	45%	0.447	C	S	.	.	H	α-helix	trans	-62.1	-48.8	173.1	-74.6	172.2	0	0	0	112.2	L21 I32 H33 N38 I39 I40 C66 Y150	L21-L36 HydrophobicContact CD1-CD2 3.36Å; I32-L36 HydrophobicContact CG2-CD1 3.71Å; I32-L36 HydrophobicContact CG2-CG 4.16Å; I32-L36 WeakPolarHBondContact O-CG 3.07Å; I32-L36 PolarHBondContact O-N 3.18Å; H33-L36 PolarHBondContact O-N 2.95Å; L36-N38 PolarHBondContact O-N 2.84Å; L36-I39 PolarHBondContact O-N 2.89Å; L36-I39 VanDerWaalsContact O-N 3.09Å; L36-I40 WeakPolarHBondContact O-CG1 3.5Å; L36-I40 PolarHBondContact O-N 2.98Å; L36-C66 HydrophobicContact CD2-CB 4.08Å; L36-Y150 HydrophobicContact CD1-CE2 4.06Å; L36-Y150 WeakPolarHBondContact CD1-OH 3.48Å
37	S	53.7	Low	46.4	Very low	37 Å²	37	88 Å²	88	26%	0.259	45%	0.451	S	S	.	.	H	α-helix	trans	-56.7	-47.4	179	-179.5	0	0	0	0	111.9	H33 I39 I40 Q41	H33-S37 VanDerWaalsContact O-CB 3.24Å; H33-S37 WeakPolarHBondContact O-CB 3.44Å; H33-S37 PolarHBondContact O-N 3.29Å; S37-I39 VanDerWaalsContact C-N 3.27Å; S37-I39 PolarHBondContact O-N 3.13Å; S37-I40 PolarHBondContact O-N 3.09Å; S37-Q41 WeakPolarHBondContact O-CB 3.35Å; S37-Q41 PolarHBondContact O-N 2.85Å
38	N	53.3	Low	46.3	Very low	86 Å²	86	89.4 Å²	89.4	46%	0.46	46%	0.459	S	S	.	.	H	α-helix	trans	-58.8	-36	176.6	-75.6	-9.6	0	0	0	112.7	H34 L36 S42	H34-N38 PolarHBondContact ND1-ND2 3.28Å; H34-N38 PolarHBondContact ND1-OD1 3.31Å; H34-N38 VanDerWaalsContact O-CG 3.3Å; H34-N38 PolarHBondContact O-N 3Å; H34-N38 VanDerWaalsContact O-N 3.11Å; L36-N38 PolarHBondContact O-N 2.84Å; N38-S42 VanDerWaalsContact O-CB 3.3Å; N38-S42 WeakPolarHBondContact O-CB 3.07Å; N38-S42 PolarHBondContact O-N 3.44Å
39	I	55.4	Low	46.1	Very low	34 Å²	34	87.1 Å²	87.1	17%	0.174	45%	0.453	C	S	.	.	H	α-helix	trans	-82.4	-34.4	-179.4	-52.9	157.8	0	0	0	111.9	M1 L21 Y35 L36 S37 Q41 S42 M43	M1-I39 HydrophobicContact CE-CB 4.3Å; M1-I39 HydrophobicContact CE-CD1 4.01Å; M1-I39 HydrophobicContact CE-CG2 3.54Å; M1-I39 HydrophobicContact SD-CD1 3.95Å; M1-I39 HydrophobicContact SD-CG2 3.87Å; L21-I39 HydrophobicContact CD2-CD1 4.4Å; Y35-I39 HydrophobicContact CD1-CD1 3.68Å; Y35-I39 HydrophobicContact CE1-CD1 3.76Å; Y35-I39 WeakPolarHBondContact O-CD1 3.37Å; Y35-I39 VanDerWaalsContact O-CG1 3.32Å; Y35-I39 WeakPolarHBondContact O-CG1 3.41Å; Y35-I39 PolarHBondContact O-N 3.09Å; L36-I39 PolarHBondContact O-N 2.89Å; L36-I39 VanDerWaalsContact O-N 3.09Å; S37-I39 VanDerWaalsContact C-N 3.27Å; S37-I39 PolarHBondContact O-N 3.13Å; I39-Q41 VanDerWaalsContact C-N 3.32Å; I39-S42 CarbonylContact O-C 3.54Å; I39-S42 WeakPolarHBondContact O-CB 3.31Å; I39-S42 PolarHBondContact O-N 3.46Å; I39-S42 VanDerWaalsContact O-N 3.15Å; I39-M43 HydrophobicContact CG2-CG 4.43Å; I39-M43 WeakPolarHBondContact O-CG 3.27Å; I39-M43 PolarHBondContact O-N 3.36Å
40	I	54.5	Low	45.9	Very low	9 Å²	9	87.6 Å²	87.6	5%	0.046	45%	0.448	C	S	.	.	H	α-helix	trans	-60.4	-46.1	170.7	-65.7	168	0	0	0	109.4	L36 S37 S42 M43 I44 I64 I152 W163	L36-I40 WeakPolarHBondContact O-CG1 3.5Å; L36-I40 PolarHBondContact O-N 2.98Å; S37-I40 PolarHBondContact O-N 3.09Å; I40-S42 VanDerWaalsContact C-N 3.31Å; I40-S42 PolarHBondContact O-N 2.82Å; I40-M43 HydrophobicContact CG1-CE 4.26Å; I40-M43 PolarHBondContact O-N 3.22Å; I40-M43 VanDerWaalsContact O-N 3.16Å; I40-I44 HydrophobicContact CG2-CD1 4.02Å; I40-I44 WeakPolarHBondContact O-CG1 3.26Å; I40-I44 PolarHBondContact O-N 2.79Å; I40-I64 HydrophobicContact CG1-CD1 4.16Å; I40-I64 HydrophobicContact CG2-CD1 4.31Å; I40-I152 HydrophobicContact CG2-CD1 4.39Å; I40-W163 HydrophobicContact CB-CH2 4.43Å; I40-W163 HydrophobicContact CG2-CH2 3.91Å; I40-W163 HydrophobicContact CG2-CZ3 4.29Å
41	Q	51.4	Low	45.4	Very low	52 Å²	52	89.9 Å²	89.9	24%	0.243	46%	0.455	C	S	.	.	H	α-helix	trans	-61.6	-39.1	172.9	-163.8	70.3	62.6	0	0	111.9	S37 I39 M43 I44 N45	S37-Q41 WeakPolarHBondContact O-CB 3.35Å; S37-Q41 PolarHBondContact O-N 2.85Å; I39-Q41 VanDerWaalsContact C-N 3.32Å; Q41-M43 VanDerWaalsContact C-N 3.32Å; Q41-M43 PolarHBondContact O-N 2.85Å; Q41-I44 PolarHBondContact O-N 2.77Å; Q41-N45 PolarHBondContact NE2-OD1 3.23Å; Q41-N45 WeakPolarHBondContact O-CB 3.42Å; Q41-N45 VanDerWaalsContact O-CG 3.23Å; Q41-N45 PolarHBondContact O-N 3.17Å; Q41-N45 PolarHBondContact O-OD1 2.04Å; Q41-N45 VanDerWaalsContact O-OD1 3.14Å
42	S	52.2	Low	44.3	Very low	68 Å²	68	95.1 Å²	95.1	48%	0.476	47%	0.474	S	S	.	.	H	α-helix	trans	-67.6	-27.4	175.6	-176.2	0	0	0	0	113.7	N38 I39 I40 K46	N38-S42 VanDerWaalsContact O-CB 3.3Å; N38-S42 WeakPolarHBondContact O-CB 3.07Å; N38-S42 PolarHBondContact O-N 3.44Å; I39-S42 CarbonylContact O-C 3.54Å; I39-S42 WeakPolarHBondContact O-CB 3.31Å; I39-S42 PolarHBondContact O-N 3.46Å; I39-S42 VanDerWaalsContact O-N 3.15Å; I40-S42 VanDerWaalsContact C-N 3.31Å; I40-S42 PolarHBondContact O-N 2.82Å; S42-K46 WeakPolarHBondContact O-CB 3.5Å
43	M	48.8	Very low	43.2	Very low	74 Å²	74	99 Å²	99	37%	0.365	50%	0.495	S	S	.	.	H	α-helix	trans	-79.2	-30.7	174.6	-71.8	-174	-62.5	0	0	111.9	V3 V19 I39 I40 Q41 I64	V3-M43 HydrophobicContact CG2-SD 4.45Å; V19-M43 HydrophobicContact CG2-CE 4.46Å; I39-M43 HydrophobicContact CG2-CG 4.43Å; I39-M43 WeakPolarHBondContact O-CG 3.27Å; I39-M43 PolarHBondContact O-N 3.36Å; I40-M43 HydrophobicContact CG1-CE 4.26Å; I40-M43 PolarHBondContact O-N 3.22Å; I40-M43 VanDerWaalsContact O-N 3.16Å; Q41-M43 VanDerWaalsContact C-N 3.32Å; Q41-M43 PolarHBondContact O-N 2.85Å; M43-I64 HydrophobicContact CE-CD1 4.2Å
44	I	50.9	Low	42.5	Very low	93 Å²	93	102.8 Å²	102.8	48%	0.477	51%	0.513	S	S	.	.	H	α-helix	trans	-73.9	-45.1	174.2	-66.3	165	0	0	0	110.8	I40 Q41 K46	I40-I44 HydrophobicContact CG2-CD1 4.02Å; I40-I44 WeakPolarHBondContact O-CG1 3.26Å; I40-I44 PolarHBondContact O-N 2.79Å; Q41-I44 PolarHBondContact O-N 2.77Å; I44-K46 VanDerWaalsContact C-N 3.3Å; I44-K46 PolarHBondContact O-N 2.79Å
45	N	44	Very low	41.6	Very low	112 Å²	112	109.5 Å²	109.5	60%	0.599	54%	0.536	S	S	*	.	S	Bend	trans	-78.2	-2.3	-172.4	-68.5	20.6	0	0	0	115	Q41 Q47	Q41-N45 PolarHBondContact NE2-OD1 3.23Å; Q41-N45 WeakPolarHBondContact O-CB 3.42Å; Q41-N45 VanDerWaalsContact O-CG 3.23Å; Q41-N45 PolarHBondContact O-N 3.17Å; Q41-N45 PolarHBondContact O-OD1 2.04Å; Q41-N45 VanDerWaalsContact O-OD1 3.14Å; N45-Q47 VanDerWaalsContact C-N 3.26Å; N45-Q47 PolarHBondContact O-N 3.42Å
46	K	43.3	Very low	41	Very low	157 Å²	157	108.2 Å²	108.2	68%	0.683	54%	0.537	S	S	*	.			trans	-89.6	30.2	-169	-136.2	-174.5	-179.2	-164.6	0	114.9	S42 I44 D48	S42-K46 WeakPolarHBondContact O-CB 3.5Å; I44-K46 VanDerWaalsContact C-N 3.3Å; I44-K46 PolarHBondContact O-N 2.79Å; K46-D48 PolarHBondContact O-N 2.98Å
47	Q	34.6	Very low	40.2	Very low	172 Å²	172	116 Å²	116	80%	0.804	57%	0.57	S	S	*	*			trans	-78.3	-18.5	-168.4	-157.5	156.5	-24.8	0	0	113.8	N45	N45-Q47 VanDerWaalsContact C-N 3.26Å; N45-Q47 PolarHBondContact O-N 3.42Å
48	D	26.7	Very low	39.4	Very low	163 Å²	163	118.2 Å²	118.2	87%	0.872	58%	0.582	S	S	*	*			trans	-103.4	75.6	179.5	-72.3	-53.1	0	0	0	113.7	K46	K46-D48 PolarHBondContact O-N 2.98Å
49	S	28.9	Very low	38.9	Very low	86 Å²	86	115.8 Å²	115.8	60%	0.601	58%	0.577	S	S	*	*			trans	-149.7	116.8	155.4	61.9	0	0	0	0	110.5	E51	S49-E51 PolarHBondContact O-N 2.71Å
50	F	26.8	Very low	38.5	Very low	168 Å²	168	114.7 Å²	114.7	74%	0.737	57%	0.573	S	S	*	*			trans	-69	98.6	178.3	-93	-123.7	0	0	0	110.6	K1764	F50-K1764 HydrophobicContact CE2-CD 4.39Å; F50-K1764 HydrophobicContact CZ-CD 4.27Å; F50-K1764 VanDerWaalsContact CZ-NZ 3.25Å
51	E	25.1	Very low	38.2	Very low	173 Å²	173	116.2 Å²	116.2	81%	0.808	58%	0.581	S	S	*	*				-174.3	148.1	129	-104.7	171	-150.3	0	0	112.1	S49	S49-E51 PolarHBondContact O-N 2.71Å
52	Q	26.4	Very low	38.3	Very low	168 Å²	168	114.9 Å²	114.9	79%	0.785	58%	0.575	S	S	*	*	S	Bend	trans	65.6	80.8	168.1	-56.9	-173.1	14.4	0	0	119.8
53	N	25.7	Very low	38.2	Very low	156 Å²	156	112 Å²	112	83%	0.834	55%	0.554	S	S	*	*			trans	42.7	74.7	137.9	-67.9	-5.7	0	0	0	119.4
54	H	33.1	Very low	38.5	Very low	136 Å²	136	108.9 Å²	108.9	63%	0.63	54%	0.539	S	S	*	.			trans	-148.4	105.5	161.8	-89.4	116.8	0	0	0	113.7	K5	K5-H54 PolarHBondContact NZ-CD2 3.41Å; K5-H54 PolarHBondContact NZ-NE2 2.72Å
55	Y	31.3	Very low	38.6	Very low	225 Å²	225	105.1 Å²	105.1	88%	0.882	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-97.7	130.8	166	-71.4	-81.5	0	0	0	110.7
56	I	40.9	Very low	38.8	Very low	97 Å²	97	99.9 Å²	99.9	50%	0.497	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-92.8	125.5	161	-64.7	175.9	0	0	0	106.4	I62	I56-I62 HydrophobicContact CD1-CD1 4.13Å; I56-I62 HydrophobicContact CG2-CD1 4.29Å
57	K	37.4	Very low	39.2	Very low	170 Å²	170	93.9 Å²	93.9	74%	0.739	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-77	133.6	-179.4	-145.4	-179.1	-174.4	-171.3	0	109.6	S60	K57-S60 VanDerWaalsContact O-CB 3.29Å; K57-S60 WeakPolarHBondContact O-CB 3.35Å; K57-S60 PolarHBondContact O-N 2.99Å; K57-S60 VanDerWaalsContact O-N 3.17Å; K57-S60 PolarHBondContact O-OG 2.8Å
58	T	37.6	Very low	40	Very low	83 Å²	83	86 Å²	86	51%	0.509	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	142.6	171.8	38.2	0	0	0	0	110.9	S60 V155 N157	T58-S60 VanDerWaalsContact C-N 3.35Å; T58-V155 CarbonylContact C-O 3.49Å; T58-V155 WeakPolarHBondContact CA-O 3.3Å; T58-N157 WeakPolarHBondContact CG2-OD1 3.48Å
59	G	42.5	Very low	40.9	Very low	35 Å²	35	79.9 Å²	79.9	36%	0.361	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	-13	-171.6	0	0	0	0	0	115.3	V155	G59-V155 PolarHBondContact N-O 3.31Å
60	S	46.4	Very low	41.5	Very low	12 Å²	12	78.5 Å²	78.5	8%	0.084	39%	0.387	C	S	.	.			trans	-59.4	140.6	179.6	-60.2	0	0	0	0	112.5	K57 T58 V155	K57-S60 VanDerWaalsContact O-CB 3.29Å; K57-S60 WeakPolarHBondContact O-CB 3.35Å; K57-S60 PolarHBondContact O-N 2.99Å; K57-S60 VanDerWaalsContact O-N 3.17Å; K57-S60 PolarHBondContact O-OG 2.8Å; T58-S60 VanDerWaalsContact C-N 3.35Å; S60-V155 PolarHBondContact O-N 3Å
61	I	48	Very low	42.2	Very low	41 Å²	41	74.5 Å²	74.5	21%	0.21	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	129.7	162.1	-59.4	172.9	0	0	0	108	E13 Q14 N15 T151 I152 Y153	E13-I61 PolarHBondContact O-N 2.73Å; Q14-I61 HydrophobicContact CG-CB 4.45Å; N15-I61 PolarHBondContact N-O 2.77Å; I61-T151 HydrophobicContact CG2-CG2 3.78Å; I61-I152 WeakPolarHBondContact CA-O 3.07Å; I61-Y153 HydrophobicContact CD1-CD1 3.96Å; I61-Y153 HydrophobicContact CD1-CE1 4.4Å; I61-Y153 HydrophobicContact CG1-CD1 4.24Å; I61-Y153 HydrophobicContact CG2-CD1 4.21Å
62	I	52.9	Low	42.5	Very low	23 Å²	23	75.6 Å²	75.6	12%	0.118	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	119.8	172.5	-56.9	-176.5	0	0	0	108.8	N15 I56 I64 I152 V155	N15-I62 HydrophobicContact CB-CG1 4.37Å; N15-I62 WeakPolarHBondContact O-CA 3.44Å; I56-I62 HydrophobicContact CD1-CD1 4.13Å; I56-I62 HydrophobicContact CG2-CD1 4.29Å; I62-I64 HydrophobicContact CG2-CD1 4.35Å; I62-I64 HydrophobicContact CG2-CG1 3.83Å; I62-I152 HydrophobicContact CB-CB 4.37Å; I62-I152 PolarHBondContact N-O 2.78Å; I62-I152 PolarHBondContact O-N 2.82Å; I62-V155 HydrophobicContact CD1-CG2 3.72Å; I62-V155 HydrophobicContact CG1-CG2 3.94Å
63	T	50.3	Low	42.7	Very low	7 Å²	7	73.2 Å²	73.2	4%	0.043	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	117	173.5	-47.6	0	0	0	0	109.1	N15 H16 T17 R149 Y150	N15-T63 PolarHBondContact O-N 3.31Å; N15-T63 VanDerWaalsContact O-N 3.13Å; H16-T63 WeakPolarHBondContact NE2-CG2 3.46Å; T17-T63 PolarHBondContact N-O 2.93Å; T63-R149 HydrophobicContact CG2-CG 3.79Å; T63-Y150 CarbonylContact C-O 3.44Å; T63-Y150 WeakPolarHBondContact CA-O 3.4Å
64	I	55.5	Low	42.8	Very low	9 Å²	9	75 Å²	75	5%	0.046	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	106.8	-179.5	-48.6	-179.8	0	0	0	109	T17 V19 I40 M43 I62 C66 Y150 I152	T17-I64 VanDerWaalsContact O-CA 3.29Å; T17-I64 WeakPolarHBondContact O-CA 3.44Å; V19-I64 HydrophobicContact CB-CG2 4.25Å; V19-I64 HydrophobicContact CG2-CG2 3.64Å; I40-I64 HydrophobicContact CG1-CD1 4.16Å; I40-I64 HydrophobicContact CG2-CD1 4.31Å; M43-I64 HydrophobicContact CE-CD1 4.2Å; I62-I64 HydrophobicContact CG2-CD1 4.35Å; I62-I64 HydrophobicContact CG2-CG1 3.83Å; I64-C66 PolarHBondContact O-N 2.86Å; I64-Y150 PolarHBondContact N-O 3.46Å; I64-Y150 PolarHBondContact O-N 2.88Å; I64-I152 HydrophobicContact CD1-CD1 4.15Å
65	D	52.5	Low	42.6	Very low	15 Å²	15	76.5 Å²	76.5	8%	0.08	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	95.6	175.9	-87.3	-1.2	0	0	0	109.9	T17 I18 V19 I67 R149	T17-D65 PolarHBondContact O-N 2.87Å; I18-D65 HydrophobicContact CG1-CB 4.24Å; V19-D65 PolarHBondContact N-O 2.85Å; D65-I67 PolarHBondContact O-N 3.01Å; D65-R149 VanDerWaalsContact OD1-CB 3.3Å; D65-R149 WeakPolarHBondContact OD1-CB 3.4Å; D65-R149 VanDerWaalsContact OD1-CG 3.26Å; D65-R149 WeakPolarHBondContact OD1-CG 3.41Å; D65-R149 IonicContact OD1-CZ 2.72Å; D65-R149 IonicContact OD1-NE 3.45Å; D65-R149 PolarHBondContact OD1-NE 2.79Å; D65-R149 IonicContact OD1-NH2 2.89Å; D65-R149 PolarHBondContact OD1-NH2 3.05Å; D65-R149 IonicContact OD2-CZ 3.42Å; D65-R149 IonicContact OD2-NE 3.02Å; D65-R149 IonicContact OD2-NH2 3.27Å; D65-R149 PolarHBondContact OD2-NH2 3.29Å
66	C	50	Low	42.4	Very low	2 Å²	2	76 Å²	76	1%	0.014	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	103.3	177.7	-72.1	0	0	0	0	110.5	V19 L36 I64 F148 Y150	V19-C66 CarbonylContact O-C 3.57Å; V19-C66 WeakPolarHBondContact O-CA 3.39Å; L36-C66 HydrophobicContact CD2-CB 4.08Å; I64-C66 PolarHBondContact O-N 2.86Å; C66-F148 HydrophobicContact CB-CB 4.19Å; C66-F148 PolarHBondContact N-O 2.57Å; C66-F148 PolarHBondContact O-N 3.07Å; C66-Y150 HydrophobicContact CB-CD2 4.41Å; C66-Y150 HydrophobicContact CB-CE2 4.19Å
67	I	51.3	Low	41.8	Very low	30 Å²	30	78.5 Å²	78.5	15%	0.154	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	114.5	177.4	-54.3	-177.1	0	0	0	108.6	I18 V19 L20 L21 D65 F69 I145 I147	I18-I67 HydrophobicContact CG2-CD1 3.93Å; I18-I67 HydrophobicContact CG2-CG1 4.36Å; V19-I67 PolarHBondContact O-N 3.06Å; L20-I67 HydrophobicContact CD2-CB 3.87Å; L20-I67 HydrophobicContact CD2-CD1 3.86Å; L20-I67 HydrophobicContact CD2-CG1 4.21Å; L20-I67 HydrophobicContact CD2-CG2 4.39Å; L21-I67 PolarHBondContact N-O 2.9Å; D65-I67 PolarHBondContact O-N 3.01Å; I67-F69 HydrophobicContact CG2-CE1 4.27Å; I67-F69 HydrophobicContact CG2-CE2 3.93Å; I67-F69 HydrophobicContact CG2-CZ 3.73Å; I67-I145 HydrophobicContact CG2-CG2 3.53Å; I67-I147 HydrophobicContact CG1-CG1 4.23Å; I67-I147 HydrophobicContact CG1-CG2 4.28Å; I67-I147 HydrophobicContact CG2-CG1 4.4Å
68	V	51.1	Low	41.4	Very low	8 Å²	8	76.1 Å²	76.1	5%	0.048	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	125.7	-177.7	-179.3	0	0	0	0	110.2	L21 L23 D146 F148	L21-V68 HydrophobicContact CB-CG2 4.47Å; L23-V68 HydrophobicContact CD1-CG1 3.75Å; L23-V68 HydrophobicContact CG-CG1 4.33Å; V68-D146 PolarHBondContact N-O 3.37Å; V68-D146 PolarHBondContact O-N 3.02Å; V68-F148 HydrophobicContact CB-CE2 4.31Å; V68-F148 HydrophobicContact CG2-CD2 3.93Å; V68-F148 HydrophobicContact CG2-CE2 3.91Å
69	F	45.8	Very low	41	Very low	34 Å²	34	78.7 Å²	78.7	15%	0.149	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	117.7	177	-62.9	-80.6	0	0	0	110.7	L20 L21 I67 Y142 I145	L20-F69 HydrophobicContact CB-CE2 4.26Å; L20-F69 HydrophobicContact CD2-CE2 4.15Å; L20-F69 HydrophobicContact CD2-CZ 4.45Å; L21-F69 PolarHBondContact O-N 3.08Å; L21-F69 VanDerWaalsContact O-N 3.09Å; I67-F69 HydrophobicContact CG2-CE1 4.27Å; I67-F69 HydrophobicContact CG2-CE2 3.93Å; I67-F69 HydrophobicContact CG2-CZ 3.73Å; F69-Y142 HydrophobicContact CB-CD1 3.89Å; F69-Y142 HydrophobicContact CB-CE1 3.82Å; F69-Y142 AromaticContact CD1-CD1 3.7Å; F69-Y142 HydrophobicContact CD1-CD1 3.7Å; F69-Y142 HydrophobicContact CD1-CD2 4.05Å; F69-Y142 AromaticContact CD1-CE1 3.93Å; F69-Y142 HydrophobicContact CD1-CE1 3.93Å; F69-Y142 HydrophobicContact CD1-CE2 4.26Å; F69-Y142 AromaticContact CD1-CG 3.77Å; F69-Y142 HydrophobicContact CD1-CG 3.77Å; F69-Y142 HydrophobicContact CE1-CD2 4.28Å; F69-Y142 HydrophobicContact CE1-CE2 4.46Å; F69-Y142 HydrophobicContact CE1-CG 4.4Å; F69-Y142 HydrophobicContact CG-CD1 4.15Å; F69-Y142 HydrophobicContact CG-CE1 4.04Å; F69-I145 HydrophobicContact CD1-CG1 4.22Å; F69-I145 HydrophobicContact CE1-CD1 4.15Å; F69-I145 HydrophobicContact CE1-CG1 4.16Å; F69-I145 HydrophobicContact CE1-CG2 4.31Å
70	S	41.7	Very low	40.4	Very low	57 Å²	57	86.3 Å²	86.3	40%	0.399	41%	0.408	S	S	.	.			trans	-98.7	99.6	-178.7	-171	0	0	0	0	111.6
71	I	39.9	Very low	39.6	Very low	83 Å²	83	92.3 Å²	92.3	43%	0.426	44%	0.439	S	S	.	.			trans	-93.8	99.8	176.4	-53.3	178.2	0	0	0	109.7	N73 Y142	I71-N73 PolarHBondContact O-N 2.66Å; I71-Y142 HydrophobicContact CD1-CE1 4.06Å; I71-Y142 HydrophobicContact CG1-CD1 4.3Å; I71-Y142 HydrophobicContact CG1-CE1 4.04Å
72	K	32.4	Very low	38.6	Very low	197 Å²	197	95.6 Å²	95.6	86%	0.857	46%	0.457	S	S	*	.			trans	-71.8	118.6	169.8	-90.8	-175	173.5	176.6	0	110.7	K74	K72-K74 PolarHBondContact O-N 3.14Å; K72-K74 VanDerWaalsContact O-N 3.09Å
73	N	30	Very low	37.5	Very low	118 Å²	118	101.6 Å²	101.6	63%	0.631	49%	0.487	S	S	*	.	S	Bend	trans	-55.8	107.5	-179.8	-83	-55.7	0	0	0	113.2	I71	I71-N73 PolarHBondContact O-N 2.66Å
74	K	27.8	Very low	36.2	Very low	192 Å²	192	109.9 Å²	109.9	84%	0.835	52%	0.523	S	S	*	.			trans	-151.4	35.2	153	-148.2	-169.6	175.3	179.6	0	115.3	K72	K72-K74 PolarHBondContact O-N 3.14Å; K72-K74 VanDerWaalsContact O-N 3.09Å
75	F	30.2	Very low	34.8	Very low	169 Å²	169	118.2 Å²	118.2	74%	0.741	56%	0.562	S	S	*	*			trans	-153.5	88	161.4	-93.5	-69.4	0	0	0	110	E78	F75-E78 VanDerWaalsContact CE1-OE2 3.32Å; F75-E78 WeakPolarHBondContact CE1-OE2 3.25Å
76	R	25.9	Very low	33.5	Very low	215 Å²	215	123.7 Å²	123.7	81%	0.811	60%	0.598	S	S	*	*			trans	-138.7	58	176.2	-164.4	-172.2	177.1	178.2	-0.2	111.2
77	N	29.1	Very low	32.3	Very low	149 Å²	149	130.3 Å²	130.3	80%	0.797	63%	0.632	S	S	*	*	S	Bend	trans	-156.3	-27.9	163.7	-99.3	-12.8	0	0	0	113.3
78	E	29.4	Very low	31.1	Very low	119 Å²	119	133.9 Å²	133.9	56%	0.556	65%	0.648	S	S	*	*	S	Bend	trans	-87.5	-29.6	-177.1	-66.3	-178.5	162.5	0	0	114.7	F75 F80 N81 L82	F75-E78 VanDerWaalsContact CE1-OE2 3.32Å; F75-E78 WeakPolarHBondContact CE1-OE2 3.25Å; E78-F80 PolarHBondContact O-N 2.8Å; E78-N81 PolarHBondContact O-N 2.97Å; E78-N81 VanDerWaalsContact O-N 3.1Å; E78-L82 HydrophobicContact CB-CD1 4.47Å
79	L	29.3	Very low	29.9	Very low	137 Å²	137	136.7 Å²	136.7	72%	0.717	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-11.3	-173.3	-160.5	66.7	0	0	0	114.4
80	F	29	Very low	29	Very low	195 Å²	195	141 Å²	141	86%	0.855	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-12.7	177	-116.2	-87.9	0	0	0	114.3	E78	E78-F80 PolarHBondContact O-N 2.8Å
81	N	30	Very low	28.6	Very low	138 Å²	138	142 Å²	142	74%	0.738	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	-5.6	177	-76.9	-7.3	0	0	0	113.3	E78	E78-N81 PolarHBondContact O-N 2.97Å; E78-N81 VanDerWaalsContact O-N 3.1Å
82	L	27.3	Very low	27.9	Very low	110 Å²	110	143.7 Å²	143.7	58%	0.576	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	18.8	-177.3	-86.4	161.2	0	0	0	114.6	E78 I87	E78-L82 HydrophobicContact CB-CD1 4.47Å; L82-I87 HydrophobicContact CD2-CD1 4.25Å
83	I	28.9	Very low	27.6	Very low	149 Å²	149	140.4 Å²	140.4	76%	0.764	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	11.5	173.4	-60.2	177.2	0	0	0	110.9
84	K	24	Very low	27.4	Very low	182 Å²	182	143.7 Å²	143.7	79%	0.791	70%	0.695	S	S	*	*	S	Bend	trans	-129.9	133.6	167.5	-75.3	-169.5	173.6	-174.8	0	111.2
85	Q	24.9	Very low	27.3	Very low	183 Å²	183	141.7 Å²	141.7	86%	0.855	69%	0.689	S	S	*	*	S	Bend	trans	73.8	138.3	178.6	-59.1	-174.8	-18.7	0	0	116.6
86	P	25.3	Very low	27	Very low	130 Å²	130	140.7 Å²	140.7	84%	0.844	69%	0.69	S	S	*	*			trans	-84.3	161.5	-178.9	35.7	-36.1	0	0	0	112.6
87	I	25.1	Very low	26.9	Very low	142 Å²	142	139.4 Å²	139.4	73%	0.728	69%	0.691	S	S	*	*			trans	-117	137	-178	-62.5	171.7	0	0	0	109.7	L82	L82-I87 HydrophobicContact CD2-CD1 4.25Å
88	H	26.3	Very low	26.7	Very low	104 Å²	104	142.2 Å²	142.2	48%	0.481	69%	0.69	S	S	.	*			trans	-110.8	169.7	164.3	-125.6	-51.1	0	0	0	112.1	N2007 D2008	H88-N2007 PolarHBondContact NE2-OD1 3.41Å; H88-D2008 PolarHBondContact CE1-N 2.91Å; H88-D2008 IonicContact CE1-OD1 3.52Å; H88-D2008 PolarHBondContact CE1-OD1 3.12Å
89	Q	26.8	Very low	26.4	Very low	67 Å²	67	142.3 Å²	142.3	31%	0.313	69%	0.693	S	S	.	*			trans	-70.7	149	-151.1	-67	156.3	11.9	0	0	116.2	D2008 K2010	Q89-D2008 PolarHBondContact NE2-OD1 3.43Å; Q89-K2010 HydrophobicContact CB-CG 3.62Å; Q89-K2010 WeakPolarHBondContact O-CA 3.43Å
90	Q	25.9	Very low	26.1	Very low	126 Å²	126	143.9 Å²	143.9	59%	0.589	69%	0.691	S	S	*	*			cis	101.7	167.1	45.3	-134.2	-152.8	53.8	0	0	112.8	K2010 L2011	Q90-K2010 HydrophobicContact CB-CG 4.38Å; Q90-K2010 WeakPolarHBondContact O-CB 3.45Å; Q90-K2010 WeakPolarHBondContact O-CG 3.42Å; Q90-L2011 WeakPolarHBondContact O-CB 3.3Å; Q90-L2011 VanDerWaalsContact O-CD1 3.29Å; Q90-L2011 WeakPolarHBondContact O-CD1 3.46Å; Q90-L2011 WeakPolarHBondContact O-CG 3Å
91	P	33.8	Very low	25.9	Very low	77 Å²	77	143.8 Å²	143.8	50%	0.5	69%	0.686	S	S	.	*				-132.8	160.9	-83.5	41.4	-25.9	0	0	0	118.6
92	V	25.7	Very low	25.7	Very low	119 Å²	119	142.4 Å²	142.4	72%	0.721	68%	0.683	S	S	*	*			trans	-151.1	117.5	160.3	-173.4	0	0	0	0	108.8	L2011	V92-L2011 HydrophobicContact CG2-CD1 4.08Å
93	N	24.9	Very low	25.5	Very low	127 Å²	127	143.7 Å²	143.7	68%	0.679	69%	0.691	S	S	*	*				59.4	140.5	85.6	-93.1	-54.5	0	0	0	115.7
94	R	25.5	Very low	25.2	Very low	187 Å²	187	142 Å²	142	71%	0.706	69%	0.691	S	S	*	*			cis	-169.3	172.9	-0.5	-167	-178.2	-87.3	-175.5	-7.6	111.7
95	H	25.3	Very low	25.2	Very low	151 Å²	151	138.2 Å²	138.2	70%	0.699	69%	0.693	S	S	*	*			trans	83	147.2	162	-70.7	-76.4	0	0	0	118.4
96	L	25.5	Very low	25.1	Very low	148 Å²	148	137 Å²	137	78%	0.775	69%	0.692	S	S	*	*			cis	-133.2	160	-9	-81.9	119.3	0	0	0	108.9
97	K	23.5	Very low	25.1	Very low	188 Å²	188	139 Å²	139	82%	0.817	69%	0.694	S	S	*	*				66	127.2	52.1	-105.1	176.7	-177.7	176.9	0	113.3
98	R	24.3	Very low	25.1	Very low	208 Å²	208	138.9 Å²	138.9	79%	0.785	70%	0.695	S	S	*	*			cis	-159.9	152.3	35	-88.6	176.3	151.1	154.3	-7.2	114.3
99	L	23.4	Very low	25.2	Very low	120 Å²	120	142 Å²	142	63%	0.628	72%	0.715	S	S	*	*				52.5	163.6	123.4	-47.9	168.6	0	0	0	121.9
100	Y	23.6	Very low	25	Very low	171 Å²	171	147.1 Å²	147.1	67%	0.671	74%	0.736	S	S	*	*			cis	-153.4	164.4	21.7	-112.3	-59.3	0	0	0	116.1
101	Y	24.8	Very low	25.2	Very low	192 Å²	192	147 Å²	147	75%	0.753	75%	0.749	S	S	*	*			trans	-0.3	165	159.2	-68	170.8	0	0	0	124.6
102	T	24.6	Very low	24.7	Very low	109 Å²	109	149.7 Å²	149.7	67%	0.669	76%	0.759	S	S	*	*			cis	-155.4	-142.1	-14.8	32.4	0	0	0	0	109.4
103	D	23.8	Very low	24.6	Very low	137 Å²	137	151.1 Å²	151.1	73%	0.733	76%	0.762	S	S	*	*			cis	-160.9	-157.2	2.2	-138.4	-64.4	0	0	0	114.4
104	C	21.8	Very low	24.7	Very low	115 Å²	115	155.6 Å²	155.6	78%	0.777	77%	0.771	S	S	*	*			trans	-123.6	159.6	-157.4	-45.5	0	0	0	0	119.4
105	A	24.3	Very low	24.6	Very low	101 Å²	101	150.1 Å²	150.1	84%	0.835	77%	0.773	S	S	*	*			trans	-164.5	166.8	153.7	0	0	0	0	0	113.8
106	L	22.4	Very low	24.6	Very low	159 Å²	159	150.1 Å²	150.1	83%	0.832	78%	0.776	S	S	*	*			trans	-130.3	163.2	-179.9	-72.2	85.3	0	0	0	113
107	I	26.7	Very low	24.5	Very low	171 Å²	171	151.6 Å²	151.6	88%	0.877	78%	0.779	S	S	*	*			trans	-165.1	157.3	139.6	-104	155	0	0	0	111.8
108	N	23.1	Very low	24.6	Very low	140 Å²	140	148 Å²	148	75%	0.749	78%	0.776	S	S	*	*			trans	-101.3	158.5	-175	-58.4	-50.7	0	0	0	113.9
109	N	28.5	Very low	24.8	Very low	168 Å²	168	144.4 Å²	144.4	90%	0.898	77%	0.773	S	S	*	*				-164.1	166.1	121	-115.3	-27.2	0	0	0	115.1
110	K	23.8	Very low	24.9	Very low	175 Å²	175	148.3 Å²	148.3	76%	0.761	78%	0.78	S	S	*	*			trans	-96.4	155.1	-173.1	-65	-177.2	173.2	-169.9	0	114.9
111	S	28.7	Very low	24.9	Very low	124 Å²	124	146.7 Å²	146.7	87%	0.867	78%	0.782	S	S	*	*				-165.7	150.1	126.9	3.8	0	0	0	0	110.5
112	D	24.8	Very low	24.9	Very low	134 Å²	134	141.1 Å²	141.1	72%	0.717	77%	0.772	S	S	*	*			trans	-109.2	142.7	-166.1	-45.9	-93.1	0	0	0	113.2
113	L	24	Very low	24.9	Very low	148 Å²	148	144.9 Å²	144.9	78%	0.775	78%	0.779	S	S	*	*				173.4	141.9	117.6	-117.1	61.8	0	0	0	113.4
114	Y	25.3	Very low	24.9	Very low	222 Å²	222	148 Å²	148	87%	0.871	79%	0.786	S	S	*	*			trans	46.2	100	165.2	-67.7	-76.1	0	0	0	119.9
115	G	24.4	Very low	25	Very low	72 Å²	72	150.9 Å²	150.9	74%	0.742	79%	0.788	S	S	*	*			trans	-177.3	117.8	161.9	0	0	0	0	0	116.1
116	I	25.2	Very low	24.9	Very low	150 Å²	150	153.7 Å²	153.7	77%	0.769	78%	0.782	S	S	*	*			trans	37.8	115.3	150.8	-50.9	177.1	0	0	0	118.6	C118	I116-C118 PolarHBondContact O-N 3.26Å
117	H	23.5	Very low	25.2	Very low	180 Å²	180	152 Å²	152	83%	0.833	77%	0.772	S	S	*	*			trans	-71.4	103.4	168.4	-114.1	-87.8	0	0	0	112.3
118	C	26.3	Very low	25.1	Very low	111 Å²	111	148.1 Å²	148.1	75%	0.75	76%	0.757	S	S	*	*			trans	-100.1	101.8	170.2	-76.4	0	0	0	0	111.2	I116 Y120	I116-C118 PolarHBondContact O-N 3.26Å; C118-Y120 PolarHBondContact O-N 3.2Å
119	N	27.4	Very low	25.4	Very low	134 Å²	134	148.6 Å²	148.6	72%	0.717	76%	0.759	S	S	*	*			trans	-80	104	176.3	-75.8	-3	0	0	0	111.3	L121	N119-L121 PolarHBondContact O-N 3.01Å
120	Y	25.1	Very low	25.5	Very low	201 Å²	201	148 Å²	148	79%	0.788	76%	0.756	S	S	*	*			trans	-75.8	109.2	175.4	-178.4	-96.7	0	0	0	111.6	C118	C118-Y120 PolarHBondContact O-N 3.2Å
121	L	24.7	Very low	25.8	Very low	137 Å²	137	148 Å²	148	72%	0.717	76%	0.756	S	S	*	*			trans	-106	122.2	165.2	-100.1	80.4	0	0	0	110.1	N119 F123	N119-L121 PolarHBondContact O-N 3.01Å; L121-F123 HydrophobicContact CD2-CE2 4.15Å; L121-F123 HydrophobicContact CD2-CZ 4.29Å
122	S	24.7	Very low	25.8	Very low	76 Å²	76	148.3 Å²	148.3	53%	0.531	75%	0.748	S	S	.	*			trans	-116.1	126.6	167	64.5	0	0	0	0	109.8
123	F	24.7	Very low	25.9	Very low	188 Å²	188	149.5 Å²	149.5	83%	0.825	75%	0.749	S	S	*	*			trans	-89.9	123.7	177.2	-79.4	-89.7	0	0	0	110.6	L121	L121-F123 HydrophobicContact CD2-CE2 4.15Å; L121-F123 HydrophobicContact CD2-CZ 4.29Å
124	K	23.1	Very low	25.8	Very low	201 Å²	201	149.3 Å²	149.3	87%	0.874	75%	0.748	S	S	*	*			trans	-124.7	100.4	166.5	-82.8	-179.3	177.4	169.1	0	109.4
125	Q	24.4	Very low	25.8	Very low	177 Å²	177	145.4 Å²	145.4	83%	0.827	74%	0.742	S	S	*	*			trans	-83.1	134.2	170.4	-163.6	172.9	15.8	0	0	109.9	I127	Q125-I127 HydrophobicContact CG-CD1 4.28Å; Q125-I127 HydrophobicContact CG-CG1 4.32Å
126	K	22.8	Very low	26	Very low	160 Å²	160	150.6 Å²	150.6	70%	0.696	75%	0.747	S	S	*	*			trans	-135.8	107.4	179.7	179.1	-166	174.8	-163	0	107.9
127	I	28.1	Very low	26	Very low	124 Å²	124	154.3 Å²	154.3	64%	0.636	75%	0.753	S	S	*	*			trans	-122.6	132.4	177.3	-65.5	178.5	0	0	0	109.3	Q125	Q125-I127 HydrophobicContact CG-CD1 4.28Å; Q125-I127 HydrophobicContact CG-CG1 4.32Å
128	T	25.6	Very low	26.1	Very low	89 Å²	89	152.5 Å²	152.5	55%	0.546	75%	0.749	S	S	.	*			trans	-98.8	121.4	171.9	32.7	0	0	0	0	109.6	F263	T128-F263 HydrophobicContact CG2-CD1 4.39Å; T128-F263 HydrophobicContact CG2-CE1 3.84Å
129	N	27.9	Very low	26.1	Very low	150 Å²	150	157.1 Å²	157.1	80%	0.802	76%	0.757	S	S	*	*			trans	-92.2	148.5	179.8	-88.7	9.7	0	0	0	112.7
130	N	30.5	Very low	26.1	Very low	155 Å²	155	158.6 Å²	158.6	83%	0.829	76%	0.757	S	S	*	*			trans	-138.7	94.2	159.8	-131.3	-5	0	0	0	110.9
131	K	31.3	Very low	26.5	Very low	176 Å²	176	153.7 Å²	153.7	77%	0.765	75%	0.75	S	S	*	*			trans	61.6	116.2	160.6	-63.4	-171.9	177.1	-176.4	0	121.7
132	N	27.8	Very low	27	Very low	129 Å²	129	151.3 Å²	151.3	69%	0.69	73%	0.732	S	S	*	*			trans	69.5	135.4	136.2	-62.8	49.2	0	0	0	118.4
133	E	26.4	Very low	27.3	Very low	159 Å²	159	157.7 Å²	157.7	74%	0.743	75%	0.75	S	S	*	*			cis	-155.2	171.8	-3.8	-145.9	150.4	-122.9	0	0	111.8
134	L	23.7	Very low	27.8	Very low	145 Å²	145	154.1 Å²	154.1	76%	0.759	74%	0.736	S	S	*	*			trans	54.1	110.6	175.1	-104	71.9	0	0	0	119.4
135	N	24.9	Very low	28.7	Very low	140 Å²	140	148.8 Å²	148.8	75%	0.749	72%	0.716	S	S	*	*				179.5	167.5	108.8	-93.1	-13.6	0	0	0	112.9
136	E	27.2	Very low	29.4	Very low	180 Å²	180	142.7 Å²	142.7	84%	0.841	69%	0.69	S	S	*	*			trans	-62.6	137.5	-177.9	-55.2	171.4	103	0	0	113.2
137	Y	25.4	Very low	30.4	Very low	228 Å²	228	139.8 Å²	139.8	89%	0.894	68%	0.681	S	S	*	*			trans	-146.4	140	162.8	-93	-74.1	0	0	0	113.8
138	N	25.9	Very low	31.4	Very low	142 Å²	142	137.4 Å²	137.4	76%	0.759	67%	0.666	S	S	*	*			trans	-65	131.1	-174.2	-76.1	-50.1	0	0	0	113.9	F140	N138-F140 HydrophobicContact CB-CE2 4.4Å; N138-F140 PolarHBondContact O-N 2.97Å; N138-F140 VanDerWaalsContact O-N 3.14Å
139	K	26.8	Very low	32.2	Very low	208 Å²	208	140.6 Å²	140.6	90%	0.904	67%	0.668	S	S	*	*			trans	-76.6	92.7	169.3	-91.5	-178.6	174.5	171.2	0	111.1	P141	K139-P141 WeakPolarHBondContact O-CD 3.24Å
140	F	28.1	Very low	33.3	Very low	166 Å²	166	136.3 Å²	136.3	73%	0.728	64%	0.641	S	S	*	*			trans	-68	126	165.6	-82.5	-84.6	0	0	0	111.1	N138 Y142	N138-F140 HydrophobicContact CB-CE2 4.4Å; N138-F140 PolarHBondContact O-N 2.97Å; N138-F140 VanDerWaalsContact O-N 3.14Å; F140-Y142 VanDerWaalsContact C-N 3.31Å; F140-Y142 HydrophobicContact CD1-CD2 4.2Å; F140-Y142 HydrophobicContact CD1-CE2 4.26Å; F140-Y142 PolarHBondContact O-N 2.81Å
141	P	32.3	Very low	33.9	Very low	98 Å²	98	131.3 Å²	131.3	64%	0.636	62%	0.616	S	S	*	*			trans	-91.3	31.5	-173.6	37.7	-37.7	0	0	0	113.9	K139	K139-P141 WeakPolarHBondContact O-CD 3.24Å
142	Y	35.8	Very low	34.9	Very low	86 Å²	86	124.7 Å²	124.7	34%	0.337	59%	0.588	S	S	.	*			trans	-112.8	125.1	-176	-56.3	-66.3	0	0	0	111.2	F69 I71 F140	F69-Y142 HydrophobicContact CB-CD1 3.89Å; F69-Y142 HydrophobicContact CB-CE1 3.82Å; F69-Y142 AromaticContact CD1-CD1 3.7Å; F69-Y142 HydrophobicContact CD1-CD1 3.7Å; F69-Y142 HydrophobicContact CD1-CD2 4.05Å; F69-Y142 AromaticContact CD1-CE1 3.93Å; F69-Y142 HydrophobicContact CD1-CE1 3.93Å; F69-Y142 HydrophobicContact CD1-CE2 4.26Å; F69-Y142 AromaticContact CD1-CG 3.77Å; F69-Y142 HydrophobicContact CD1-CG 3.77Å; F69-Y142 HydrophobicContact CE1-CD2 4.28Å; F69-Y142 HydrophobicContact CE1-CE2 4.46Å; F69-Y142 HydrophobicContact CE1-CG 4.4Å; F69-Y142 HydrophobicContact CG-CD1 4.15Å; F69-Y142 HydrophobicContact CG-CE1 4.04Å; I71-Y142 HydrophobicContact CD1-CE1 4.06Å; I71-Y142 HydrophobicContact CG1-CD1 4.3Å; I71-Y142 HydrophobicContact CG1-CE1 4.04Å; F140-Y142 VanDerWaalsContact C-N 3.31Å; F140-Y142 HydrophobicContact CD1-CD2 4.2Å; F140-Y142 HydrophobicContact CD1-CE2 4.26Å; F140-Y142 PolarHBondContact O-N 2.81Å
143	K	30.9	Very low	35.6	Very low	211 Å²	211	126.1 Å²	126.1	92%	0.917	59%	0.585	S	S	*	*	S	Bend	trans	-102.9	-11.2	-174.8	-143.5	176.2	-173.5	-179.9	0	114
144	Q	35.1	Very low	36.4	Very low	112 Å²	112	124.3 Å²	124.3	52%	0.523	58%	0.577	S	S	.	*			trans	-155.5	141.4	173.8	-176.8	169	-16.1	0	0	107.4	D146	Q144-D146 WeakPolarHBondContact CG-OD1 3.43Å; Q144-D146 PolarHBondContact NE2-OD1 2.84Å; Q144-D146 PolarHBondContact NE2-OD2 2.88Å
145	I	40.8	Very low	37.5	Very low	89 Å²	89	119 Å²	119	46%	0.456	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-132	113.4	176.5	-59.1	175.6	0	0	0	105.6	I67 F69 I147	I67-I145 HydrophobicContact CG2-CG2 3.53Å; F69-I145 HydrophobicContact CD1-CG1 4.22Å; F69-I145 HydrophobicContact CE1-CD1 4.15Å; F69-I145 HydrophobicContact CE1-CG1 4.16Å; F69-I145 HydrophobicContact CE1-CG2 4.31Å; I145-I147 HydrophobicContact CG2-CG1 4.25Å
146	D	40.8	Very low	38.1	Very low	50 Å²	50	116 Å²	116	27%	0.267	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	125.2	-178.8	-57.9	-54.5	0	0	0	108.7	V68 Q144 F148	V68-D146 PolarHBondContact N-O 3.37Å; V68-D146 PolarHBondContact O-N 3.02Å; Q144-D146 WeakPolarHBondContact CG-OD1 3.43Å; Q144-D146 PolarHBondContact NE2-OD1 2.84Å; Q144-D146 PolarHBondContact NE2-OD2 2.88Å; D146-F148 HydrophobicContact CB-CE2 3.79Å; D146-F148 HydrophobicContact CB-CZ 4.28Å
147	I	42.8	Very low	38.6	Very low	99 Å²	99	114.9 Å²	114.9	51%	0.508	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	115.7	-174.7	-54.4	-179.2	0	0	0	109.3	I67 I145	I67-I147 HydrophobicContact CG1-CG1 4.23Å; I67-I147 HydrophobicContact CG1-CG2 4.28Å; I67-I147 HydrophobicContact CG2-CG1 4.4Å; I145-I147 HydrophobicContact CG2-CG1 4.25Å
148	F	48.5	Very low	39	Very low	73 Å²	73	108.3 Å²	108.3	32%	0.32	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	105.8	178.3	-59.4	-93	0	0	0	109.8	C66 V68 D146 Y150	C66-F148 HydrophobicContact CB-CB 4.19Å; C66-F148 PolarHBondContact N-O 2.57Å; C66-F148 PolarHBondContact O-N 3.07Å; V68-F148 HydrophobicContact CB-CE2 4.31Å; V68-F148 HydrophobicContact CG2-CD2 3.93Å; V68-F148 HydrophobicContact CG2-CE2 3.91Å; D146-F148 HydrophobicContact CB-CE2 3.79Å; D146-F148 HydrophobicContact CB-CZ 4.28Å; F148-Y150 HydrophobicContact CB-CD2 4.35Å; F148-Y150 HydrophobicContact CB-CE2 3.6Å
149	R	43.9	Very low	39.5	Very low	156 Å²	156	106.9 Å²	106.9	59%	0.589	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	113.3	176.5	177.2	164.5	-69.2	164.8	0.3	110.8	T63 D65	T63-R149 HydrophobicContact CG2-CG 3.79Å; D65-R149 VanDerWaalsContact OD1-CB 3.3Å; D65-R149 WeakPolarHBondContact OD1-CB 3.4Å; D65-R149 VanDerWaalsContact OD1-CG 3.26Å; D65-R149 WeakPolarHBondContact OD1-CG 3.41Å; D65-R149 IonicContact OD1-CZ 2.72Å; D65-R149 IonicContact OD1-NE 3.45Å; D65-R149 PolarHBondContact OD1-NE 2.79Å; D65-R149 IonicContact OD1-NH2 2.89Å; D65-R149 PolarHBondContact OD1-NH2 3.05Å; D65-R149 IonicContact OD2-CZ 3.42Å; D65-R149 IonicContact OD2-NE 3.02Å; D65-R149 IonicContact OD2-NH2 3.27Å; D65-R149 PolarHBondContact OD2-NH2 3.29Å
150	Y	49.5	Very low	39.7	Very low	61 Å²	61	101.8 Å²	101.8	24%	0.239	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	119.3	171.9	-62.7	-88.9	0	0	0	109.3	H33 L36 T63 I64 C66 F148	H33-Y150 PolarHBondContact ND1-OH 3.29Å; L36-Y150 HydrophobicContact CD1-CE2 4.06Å; L36-Y150 WeakPolarHBondContact CD1-OH 3.48Å; T63-Y150 CarbonylContact C-O 3.44Å; T63-Y150 WeakPolarHBondContact CA-O 3.4Å; I64-Y150 PolarHBondContact N-O 3.46Å; I64-Y150 PolarHBondContact O-N 2.88Å; C66-Y150 HydrophobicContact CB-CD2 4.41Å; C66-Y150 HydrophobicContact CB-CE2 4.19Å; F148-Y150 HydrophobicContact CB-CD2 4.35Å; F148-Y150 HydrophobicContact CB-CE2 3.6Å
151	T	44.4	Very low	40	Very low	50 Å²	50	96.2 Å²	96.2	31%	0.307	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	110.5	177.9	-48.9	0	0	0	0	110.2	I61 Y153	I61-T151 HydrophobicContact CG2-CG2 3.78Å; T151-Y153 HydrophobicContact CG2-CD1 4.22Å; T151-Y153 HydrophobicContact CG2-CD2 4.16Å; T151-Y153 HydrophobicContact CG2-CE1 3.72Å; T151-Y153 HydrophobicContact CG2-CE2 3.66Å; T151-Y153 HydrophobicContact CG2-CG 4.42Å; T151-Y153 VanDerWaalsContact CG2-CZ 3.42Å
152	I	51.4	Low	39.9	Very low	37 Å²	37	99.8 Å²	99.8	19%	0.19	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	104.2	174.2	-55.2	174.5	0	0	0	107.2	I40 I61 I62 I64 V155 F159	I40-I152 HydrophobicContact CG2-CD1 4.39Å; I61-I152 WeakPolarHBondContact CA-O 3.07Å; I62-I152 HydrophobicContact CB-CB 4.37Å; I62-I152 PolarHBondContact N-O 2.78Å; I62-I152 PolarHBondContact O-N 2.82Å; I64-I152 HydrophobicContact CD1-CD1 4.15Å; I152-V155 HydrophobicContact CG2-CG2 4.23Å; I152-F159 HydrophobicContact CG2-CE2 3.56Å; I152-F159 HydrophobicContact CG2-CZ 3.64Å
153	Y	42.5	Very low	40	Very low	159 Å²	159	100.9 Å²	100.9	62%	0.624	49%	0.485	S	S	*	.			trans	-78.2	127.9	176.3	-62.3	-84.8	0	0	0	110.1	I61 T151	I61-Y153 HydrophobicContact CD1-CD1 3.96Å; I61-Y153 HydrophobicContact CD1-CE1 4.4Å; I61-Y153 HydrophobicContact CG1-CD1 4.24Å; I61-Y153 HydrophobicContact CG2-CD1 4.21Å; T151-Y153 HydrophobicContact CG2-CD1 4.22Å; T151-Y153 HydrophobicContact CG2-CD2 4.16Å; T151-Y153 HydrophobicContact CG2-CE1 3.72Å; T151-Y153 HydrophobicContact CG2-CE2 3.66Å; T151-Y153 HydrophobicContact CG2-CG 4.42Å; T151-Y153 VanDerWaalsContact CG2-CZ 3.42Å
154	Q	44.1	Very low	40	Very low	121 Å²	121	94.2 Å²	94.2	57%	0.565	46%	0.458	S	S	*	.			trans	60.7	83	166.3	-160.4	175.8	9.4	0	0	116.6	N156 F159	Q154-N156 PolarHBondContact O-N 2.86Å; Q154-N156 VanDerWaalsContact O-N 3.12Å; Q154-F159 VanDerWaalsContact O-CE2 3.29Å; Q154-F159 WeakPolarHBondContact O-CE2 3.39Å
155	V	45.9	Very low	39.7	Very low	34 Å²	34	92.6 Å²	92.6	21%	0.206	46%	0.458	C	S	.	.			trans	-74.8	99.3	173.8	-178.6	0	0	0	0	111.7	T58 G59 S60 I62 I152 F159	T58-V155 CarbonylContact C-O 3.49Å; T58-V155 WeakPolarHBondContact CA-O 3.3Å; G59-V155 PolarHBondContact N-O 3.31Å; S60-V155 PolarHBondContact O-N 3Å; I62-V155 HydrophobicContact CD1-CG2 3.72Å; I62-V155 HydrophobicContact CG1-CG2 3.94Å; I152-V155 HydrophobicContact CG2-CG2 4.23Å; V155-F159 HydrophobicContact CB-CD2 4.37Å; V155-F159 HydrophobicContact CB-CE2 4.41Å; V155-F159 HydrophobicContact CG1-CD2 4.35Å; V155-F159 HydrophobicContact CG2-CD2 4.29Å; V155-F159 HydrophobicContact CG2-CE2 4.05Å
156	N	39.1	Very low	39.2	Very low	75 Å²	75	96.8 Å²	96.8	40%	0.401	47%	0.47	S	S	.	.			trans	-92	165.1	166.5	-69.7	-7.5	0	0	0	110.9	Q154 S158	Q154-N156 PolarHBondContact O-N 2.86Å; Q154-N156 VanDerWaalsContact O-N 3.12Å; N156-S158 PolarHBondContact O-N 2.98Å
157	N	36.7	Very low	38.8	Very low	158 Å²	158	97.5 Å²	97.5	85%	0.845	48%	0.479	S	S	*	.	S	Bend	trans	-64.9	0.9	177.8	-80.8	-3.3	0	0	0	114.6	T58	T58-N157 WeakPolarHBondContact CG2-OD1 3.48Å
158	S	33.7	Very low	38.2	Very low	89 Å²	89	100.6 Å²	100.6	62%	0.622	50%	0.496	S	S	*	.			trans	-138.8	58.2	-171.5	60.3	0	0	0	0	111.6	N156 N160	N156-S158 PolarHBondContact O-N 2.98Å; S158-N160 PolarHBondContact O-N 3.03Å
159	F	37.6	Very low	37.6	Very low	112 Å²	112	103.3 Å²	103.3	49%	0.491	51%	0.514	S	S	.	.			trans	-84.2	71.4	-171.4	-143.1	-43.2	0	0	0	113.8	I152 Q154 V155 G161	I152-F159 HydrophobicContact CG2-CE2 3.56Å; I152-F159 HydrophobicContact CG2-CZ 3.64Å; Q154-F159 VanDerWaalsContact O-CE2 3.29Å; Q154-F159 WeakPolarHBondContact O-CE2 3.39Å; V155-F159 HydrophobicContact CB-CD2 4.37Å; V155-F159 HydrophobicContact CB-CE2 4.41Å; V155-F159 HydrophobicContact CG1-CD2 4.35Å; V155-F159 HydrophobicContact CG2-CD2 4.29Å; V155-F159 HydrophobicContact CG2-CE2 4.05Å; F159-G161 PolarHBondContact O-N 3.26Å
160	N	30.9	Very low	37.1	Very low	102 Å²	102	103.3 Å²	103.3	55%	0.545	53%	0.526	S	S	.	.			trans	-81	88.5	170.6	-82.4	-35.8	0	0	0	111.6	S158 I182	S158-N160 PolarHBondContact O-N 3.03Å; N160-I182 PolarHBondContact ND2-O 3.46Å
161	G	33.5	Very low	36.3	Very low	48 Å²	48	107.8 Å²	107.8	50%	0.495	55%	0.554	S	S	.	*			trans	-112.2	123.8	176.3	0	0	0	0	0	113.5	F159	F159-G161 PolarHBondContact O-N 3.26Å
162	R	30.6	Very low	35.6	Very low	174 Å²	174	112.7 Å²	112.7	66%	0.657	58%	0.578	S	S	*	*			trans	-89.3	110.3	168.6	-179.7	-173.1	-77.1	158.9	-0.3	109.9	V177 N179	R162-V177 HydrophobicContact CG-CG1 4.2Å; R162-N179 VanDerWaalsContact CZ-OD1 3.26Å; R162-N179 PolarHBondContact NE-OD1 3.48Å; R162-N179 PolarHBondContact NH2-OD1 2.89Å
163	W	37.2	Very low	34.6	Very low	109 Å²	109	121.1 Å²	121.1	41%	0.413	61%	0.614	S	S	.	*			trans	-102.2	147.3	172	43.1	15.8	0	0	0	113.3	I40	I40-W163 HydrophobicContact CB-CH2 4.43Å; I40-W163 HydrophobicContact CG2-CH2 3.91Å; I40-W163 HydrophobicContact CG2-CZ3 4.29Å
164	I	30.8	Very low	33.9	Very low	71 Å²	71	118.9 Å²	118.9	36%	0.364	62%	0.621	S	S	.	*			trans	-128	122.1	176	-58.9	175.7	0	0	0	107.4	Y166	I164-Y166 HydrophobicContact CB-CE2 4.43Å; I164-Y166 HydrophobicContact CG2-CD2 4.18Å; I164-Y166 HydrophobicContact CG2-CE2 3.73Å
165	C	29.3	Very low	33.2	Very low	77 Å²	77	117.3 Å²	117.3	52%	0.52	62%	0.623	S	S	.	*			trans	-97.9	120.7	167.5	-69.5	0	0	0	0	109.4	H33	H33-C165 HydrophobicContact CB-CB 4.2Å
166	Y	29.7	Very low	32.4	Very low	177 Å²	177	123.5 Å²	123.5	69%	0.694	65%	0.648	S	S	*	*			trans	-82.3	147.6	163.5	-64.1	-88.7	0	0	0	109.1	I164	I164-Y166 HydrophobicContact CB-CE2 4.43Å; I164-Y166 HydrophobicContact CG2-CD2 4.18Å; I164-Y166 HydrophobicContact CG2-CE2 3.73Å
167	S	33.7	Very low	32.1	Very low	65 Å²	65	123.5 Å²	123.5	46%	0.455	65%	0.65	S	S	.	*			trans	-133.8	107.1	175.6	-159.4	0	0	0	0	106.8	D169	S167-D169 VanDerWaalsContact C-N 3.27Å; S167-D169 PolarHBondContact O-N 2.86Å; S167-D169 VanDerWaalsContact O-N 3.08Å; S167-D169 PolarHBondContact OG-OD2 3.04Å
168	D	30.5	Very low	32	Very low	165 Å²	165	121.3 Å²	121.3	88%	0.882	64%	0.635	S	S	*	*			trans	-83.2	76.6	175.8	-70.1	-36.3	0	0	0	109.3
169	D	34.8	Very low	31.7	Very low	129 Å²	129	121.5 Å²	121.5	69%	0.69	63%	0.628	S	S	*	*			trans	-102.9	138.9	159.8	-73.5	-69.3	0	0	0	108.4	S167	S167-D169 VanDerWaalsContact C-N 3.27Å; S167-D169 PolarHBondContact O-N 2.86Å; S167-D169 VanDerWaalsContact O-N 3.08Å; S167-D169 PolarHBondContact OG-OD2 3.04Å
170	D	33.9	Very low	31.2	Very low	157 Å²	157	122 Å²	122	84%	0.84	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	139	-167.6	-72	-61.3	0	0	0	114.6	N172	D170-N172 PolarHBondContact O-N 3.45Å
171	N	31.8	Very low	31	Very low	155 Å²	155	124 Å²	124	83%	0.829	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.4	20.2	162	-65.3	-38.4	0	0	0	119.8
172	N	31.1	Very low	30.6	Very low	153 Å²	153	128.7 Å²	128.7	82%	0.818	66%	0.657	S	S	*	*			trans	-159.5	116.4	149.9	-111.6	-41.6	0	0	0	115.4	D170 S174	D170-N172 PolarHBondContact O-N 3.45Å; N172-S174 PolarHBondContact O-N 3.39Å
173	K	28.7	Very low	30.3	Very low	214 Å²	214	124.2 Å²	124.2	93%	0.93	65%	0.652	S	S	*	*			trans	-75.8	117.2	175.3	-70.5	-176.8	177	-179	0	110.9
174	S	29	Very low	29.9	Very low	111 Å²	111	125.8 Å²	125.8	78%	0.776	67%	0.669	S	S	*	*			trans	-130.5	119.4	161	75.4	0	0	0	0	110.8	N172	N172-S174 PolarHBondContact O-N 3.39Å
175	S	29.4	Very low	29.7	Very low	88 Å²	88	126.7 Å²	126.7	62%	0.615	68%	0.681	S	S	*	*			trans	-101.7	122.5	176.5	51.3	0	0	0	0	109.5
176	K	29.2	Very low	29.6	Very low	165 Å²	165	131 Å²	131	72%	0.717	69%	0.694	S	S	*	*			trans	-104.1	110.2	171.3	-75.3	-172.3	175.8	-178.9	0	109.6
177	V	32.8	Very low	29.4	Very low	74 Å²	74	128.6 Å²	128.6	45%	0.448	69%	0.693	S	S	.	*			trans	-83.4	126.6	172.9	-179.4	0	0	0	0	108.6	R162	R162-V177 HydrophobicContact CG-CG1 4.2Å
178	H	33.6	Very low	29	Very low	113 Å²	113	129.9 Å²	129.9	52%	0.523	70%	0.702	S	S	.	*			trans	-108.4	131.5	170.3	-73.3	-91.4	0	0	0	109.7
179	N	27.6	Very low	28.8	Very low	92 Å²	92	129.5 Å²	129.5	49%	0.492	70%	0.695	S	S	.	*			trans	-111.1	140.3	174.3	-64.7	-45.2	0	0	0	109.2	R162	R162-N179 VanDerWaalsContact CZ-OD1 3.26Å; R162-N179 PolarHBondContact NE-OD1 3.48Å; R162-N179 PolarHBondContact NH2-OD1 2.89Å
180	L	27.5	Very low	28.4	Very low	124 Å²	124	129.4 Å²	129.4	65%	0.649	70%	0.699	S	S	*	*			trans	-110.1	149	151.2	-93.4	85.7	0	0	0	108.4
181	I	26.1	Very low	27.9	Very low	144 Å²	144	129.3 Å²	129.3	74%	0.738	69%	0.693	S	S	*	*			trans	-145.5	110.6	177.3	-54	175.6	0	0	0	108.5
182	I	26.5	Very low	27.7	Very low	146 Å²	146	127.2 Å²	127.2	75%	0.749	69%	0.691	S	S	*	*			trans	-139.8	148.3	148	-59.2	-173.7	0	0	0	105.7	N160	N160-I182 PolarHBondContact ND2-O 3.46Å
183	S	24.3	Very low	27.3	Very low	79 Å²	79	128.3 Å²	128.3	55%	0.552	69%	0.691	S	S	*	*			trans	-112.9	168.2	-156.4	60	0	0	0	0	115.9
184	D	27.6	Very low	27.1	Very low	142 Å²	142	126.3 Å²	126.3	76%	0.759	69%	0.688	S	S	*	*			trans	70.3	144.8	155.4	-46.6	-45.1	0	0	0	120.1
185	S	27	Very low	26.8	Very low	90 Å²	90	128.3 Å²	128.3	63%	0.629	69%	0.685	S	S	*	*			cis	-167.1	155.6	-25.9	58.1	0	0	0	0	111
186	Q	26.1	Very low	26.6	Very low	167 Å²	167	129.7 Å²	129.7	78%	0.78	69%	0.69	S	S	*	*			trans	63.5	157.8	162.9	-56.3	-165.1	-92.2	0	0	118.6
187	D	26.8	Very low	26.4	Very low	127 Å²	127	127.4 Å²	127.4	68%	0.679	69%	0.692	S	S	*	*			cis	-171.9	165.4	-26.9	-94.2	-20.7	0	0	0	108.5
188	S	25.4	Very low	26.1	Very low	92 Å²	92	130 Å²	130	64%	0.643	71%	0.708	S	S	*	*			cis	-169.1	165.8	-21	57.7	0	0	0	0	112.2
189	E	24.9	Very low	26	Very low	158 Å²	158	129.9 Å²	129.9	74%	0.738	72%	0.717	S	S	*	*			trans	72.7	173.9	142.8	-82.8	-152.2	123	0	0	126
190	V	28.4	Very low	25.9	Very low	127 Å²	127	131 Å²	131	77%	0.77	73%	0.732	S	S	*	*			trans	84.6	93.8	-172.5	-170.1	0	0	0	0	114.2
191	Q	23.5	Very low	25.9	Very low	155 Å²	155	128.6 Å²	128.6	72%	0.724	72%	0.723	S	S	*	*				72	146.9	66.2	-61.4	-174.6	9.5	0	0	114.2
192	S	25.9	Very low	26.2	Very low	110 Å²	110	127.1 Å²	127.1	77%	0.769	72%	0.721	S	S	*	*			cis	-144.7	163.2	11.8	61.9	0	0	0	0	114.5
193	H	23.6	Very low	26.5	Very low	177 Å²	177	124.3 Å²	124.3	82%	0.819	71%	0.714	S	S	*	*			trans	-78.3	168.9	165.2	-70.1	-66	0	0	0	112.8
194	I	23.6	Very low	26.9	Very low	171 Å²	171	123.5 Å²	123.5	88%	0.877	71%	0.706	S	S	*	*				170.3	163.7	121.5	-87.6	155.1	0	0	0	110.3
195	H	23.1	Very low	27.5	Very low	154 Å²	154	121.6 Å²	121.6	71%	0.713	69%	0.692	S	S	*	*				-174.1	144	-60.6	-157.3	38.6	0	0	0	108.3
196	T	25	Very low	28.3	Very low	117 Å²	117	119.6 Å²	119.6	72%	0.718	68%	0.676	S	S	*	*			trans	64.2	175.3	168.4	82.8	0	0	0	0	117.4
197	P	25.8	Very low	29.3	Very low	116 Å²	116	115.6 Å²	115.6	75%	0.753	66%	0.656	S	S	*	*			cis	-128	176.3	-17.5	37.2	-20.2	0	0	0	114.6
198	T	26.4	Very low	30.3	Very low	128 Å²	128	111 Å²	111	79%	0.785	63%	0.634	S	S	*	*			trans	-88.7	172.6	157.4	46.8	0	0	0	0	109.6
199	P	30.8	Very low	31.3	Very low	112 Å²	112	110.7 Å²	110.7	73%	0.727	63%	0.625	S	S	*	*			cis	-149.4	-154.3	25.2	46.1	-24	0	0	0	116.2
200	S	26.8	Very low	32.2	Very low	115 Å²	115	109.5 Å²	109.5	80%	0.804	61%	0.614	S	S	*	*			trans	80.9	148.9	163	76.9	0	0	0	0	118.5
201	T	27.4	Very low	32.8	Very low	74 Å²	74	110 Å²	110	45%	0.454	62%	0.617	S	S	.	*			trans	-136.9	135.2	-170.6	43.9	0	0	0	0	112.4	L246	T201-L246 WeakPolarHBondContact CB-O 3.32Å; T201-L246 HydrophobicContact CG2-CB 4.46Å; T201-L246 WeakPolarHBondContact CG2-O 3.36Å
202	T	30.9	Very low	33.5	Very low	112 Å²	112	108.5 Å²	108.5	69%	0.687	61%	0.614	S	S	*	*			trans	-144.6	134.1	171.1	50.6	0	0	0	0	109
203	S	32.8	Very low	33.9	Very low	87 Å²	87	108.3 Å²	108.3	61%	0.608	61%	0.613	S	S	*	*			trans	-80.7	146.7	175.7	48.3	0	0	0	0	111.7	L244	S203-L244 WeakPolarHBondContact CB-O 3.48Å
204	V	34.4	Very low	34.2	Very low	62 Å²	62	104.7 Å²	104.7	38%	0.376	61%	0.607	S	S	.	*			trans	-139	129.8	-178.5	-179.7	0	0	0	0	109.3	I293	V204-I293 HydrophobicContact CG1-CG2 3.56Å
205	H	39.9	Very low	34.4	Very low	102 Å²	102	103.6 Å²	103.6	47%	0.472	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.4	136.6	172.7	-85.9	-69.2	0	0	0	111.8	W242 T294	H205-W242 PolarHBondContact ND1-O 3.34Å; H205-W242 VanDerWaalsContact ND1-O 3.14Å; H205-T294 PolarHBondContact O-N 3.38Å
206	V	43	Very low	34.8	Very low	48 Å²	48	102.5 Å²	102.5	29%	0.291	61%	0.607	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.2	131.8	177.2	-177.3	0	0	0	0	108.6	I293	V206-I293 HydrophobicContact CG1-CG1 4.17Å; V206-I293 HydrophobicContact CG2-CD1 4.37Å; V206-I293 HydrophobicContact CG2-CG1 4.07Å; V206-I293 HydrophobicContact CG2-CG2 4.36Å
207	K	46.3	Very low	34.9	Very low	83 Å²	83	102.3 Å²	102.3	36%	0.361	61%	0.606	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.9	117.2	178.2	-169.3	179.2	-170.9	-68.5	0	109	D209 Q292	K207-D209 IonicContact NZ-OD1 2.64Å; K207-D209 PolarHBondContact NZ-OD1 2.67Å; K207-D209 IonicContact NZ-OD2 2.67Å; K207-D209 PolarHBondContact NZ-OD2 2.82Å; K207-Q292 PolarHBondContact N-O 3.26Å; K207-Q292 PolarHBondContact O-N 2.82Å; K207-Q292 VanDerWaalsContact O-O 3.05Å
208	C	47.8	Very low	34.9	Very low	32 Å²	32	104 Å²	104	22%	0.216	61%	0.609	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-113	117.2	173.4	-51.6	0	0	0	0	108	C291	C208-C291 HydrophobicContact CB-CB 4.09Å; C208-C291 WeakPolarHBondContact CB-SG 3.17Å; C208-C291 WeakPolarHBondContact SG-CB 3.43Å; C208-C291 CovalentContact SG-SG 2.04Å; C208-C291 PolarHBondContact SG-SG 3.02Å
209	D	46.5	Very low	35.3	Very low	85 Å²	85	106 Å²	106	46%	0.455	61%	0.613	S	S	.	*			trans	-98.4	132.2	178.1	-71.3	-45	0	0	0	109.6	K207	K207-D209 IonicContact NZ-OD1 2.64Å; K207-D209 PolarHBondContact NZ-OD1 2.67Å; K207-D209 IonicContact NZ-OD2 2.67Å; K207-D209 PolarHBondContact NZ-OD2 2.82Å
210	Y	43.8	Very low	35.1	Very low	133 Å²	133	106.6 Å²	106.6	52%	0.522	61%	0.614	S	S	.	*			trans	-109.8	124.1	179.1	68.9	-87.3	0	0	0	110.3	K238	Y210-K238 PolarHBondContact OH-O 3.41Å
211	T	42.4	Very low	35.2	Very low	136 Å²	136	109.4 Å²	109.4	83%	0.834	62%	0.615	S	S	*	*			trans	-100.4	111	178.1	49.5	0	0	0	0	110.4	S213	T211-S213 PolarHBondContact O-N 2.8Å
212	L	38.3	Very low	35.3	Very low	125 Å²	125	112.8 Å²	112.8	65%	0.654	63%	0.629	S	S	*	*			trans	-87.3	101.1	173.5	-150.3	80.7	0	0	0	109.2	S214	L212-S214 PolarHBondContact O-N 3.39Å
213	S	34.3	Very low	35.2	Very low	106 Å²	106	114.8 Å²	114.8	74%	0.741	63%	0.631	S	S	*	*			trans	-70.9	123.6	172	-174.7	0	0	0	0	109.9	T211	T211-S213 PolarHBondContact O-N 2.8Å
214	S	29.1	Very low	35	Very low	101 Å²	101	119.3 Å²	119.3	71%	0.706	64%	0.639	S	S	*	*			trans	-120.8	112.2	176.4	58	0	0	0	0	110	L212	L212-S214 PolarHBondContact O-N 3.39Å
215	N	27.3	Very low	34.8	Very low	148 Å²	148	123.7 Å²	123.7	79%	0.791	66%	0.66	S	S	*	*			trans	-160.3	159.5	169.4	-99	-26.3	0	0	0	109
216	V	31.5	Very low	34.4	Very low	130 Å²	130	126.1 Å²	126.1	79%	0.788	68%	0.677	S	S	*	*			trans	67.1	114.3	-168.8	-165.7	0	0	0	0	111.7
217	T	26.6	Very low	33.8	Very low	114 Å²	114	128.5 Å²	128.5	70%	0.699	70%	0.696	S	S	*	*			cis	83.2	96.2	13.3	83.4	0	0	0	0	118.2
218	N	26.3	Very low	33.1	Very low	151 Å²	151	131.9 Å²	131.9	81%	0.807	72%	0.718	S	S	*	*			trans	63.5	122.9	155.6	-61.5	-6.3	0	0	0	119.7
219	I	34.2	Very low	32.2	Very low	170 Å²	170	138.1 Å²	138.1	87%	0.872	74%	0.744	S	S	*	*				-160	162.3	106.2	-94.3	152.5	0	0	0	108.4
220	T	26.7	Very low	31.5	Very low	124 Å²	124	142.3 Å²	142.3	76%	0.761	76%	0.76	S	S	*	*			trans	-120.1	179.5	-164.4	41.8	0	0	0	0	114.3
221	E	29	Very low	31	Very low	175 Å²	175	143 Å²	143	82%	0.818	77%	0.773	S	S	*	*			trans	91.2	144.8	-176.8	-55.4	-172	179.7	0	0	114.4
222	L	29.3	Very low	30.2	Very low	144 Å²	144	144.8 Å²	144.8	75%	0.754	77%	0.769	S	S	*	*			cis	-143.8	143	14.2	-139.1	146.6	0	0	0	113.3
223	H	30.2	Very low	29.7	Very low	155 Å²	155	146.1 Å²	146.1	72%	0.718	78%	0.777	S	S	*	*			trans	-17.2	149.9	-179.3	-73.8	-82.9	0	0	0	126.2
224	K	28.6	Very low	29.4	Very low	182 Å²	182	149 Å²	149	79%	0.791	78%	0.783	S	S	*	*			trans	70.3	121.4	145.9	-72.5	165.4	-176.3	177	0	117.1
225	N	30.5	Very low	29.2	Very low	153 Å²	153	152.8 Å²	152.8	82%	0.818	79%	0.792	S	S	*	*			cis	-147	163.5	30.6	-94.5	-22	0	0	0	115.5
226	N	31.9	Very low	29.3	Very low	154 Å²	154	152.6 Å²	152.6	82%	0.824	79%	0.791	S	S	*	*			trans	-59.8	164.9	172.1	-70.4	-4.7	0	0	0	114.4
227	S	29.7	Very low	29.1	Very low	98 Å²	98	152.2 Å²	152.2	69%	0.685	79%	0.788	S	S	*	*			cis	-165.7	163.4	-12.8	51.9	0	0	0	0	107.8
228	N	32	Very low	29.3	Very low	154 Å²	154	154.7 Å²	154.7	82%	0.824	79%	0.79	S	S	*	*				-158.8	158.1	63.6	-83.7	-19.5	0	0	0	112
229	E	27.3	Very low	29.7	Very low	162 Å²	162	151.2 Å²	151.2	76%	0.757	77%	0.774	S	S	*	*			trans	-92.7	150.2	175.5	-57.8	178.4	101.8	0	0	113.4
230	H	33.7	Very low	29.6	Very low	174 Å²	174	147.5 Å²	147.5	81%	0.806	76%	0.755	S	S	*	*				-158	153.7	126.8	-118.4	59.6	0	0	0	114.4
231	N	32.3	Very low	29.8	Very low	147 Å²	147	147.1 Å²	147.1	79%	0.786	75%	0.748	S	S	*	*			trans	62.4	77.1	167.7	-64.5	-12.2	0	0	0	118.5
232	K	26	Very low	29.9	Very low	174 Å²	174	146.8 Å²	146.8	76%	0.757	74%	0.74	S	S	*	*			trans	-68.7	154.1	140.5	-69.9	168.6	179.5	160.1	0	110
233	N	27.3	Very low	29.9	Very low	152 Å²	152	146.8 Å²	146.8	81%	0.813	74%	0.736	S	S	*	*			trans	125.8	86.9	153.4	-65.6	-15	0	0	0	115.8
234	L	28.2	Very low	29.8	Very low	167 Å²	167	144.1 Å²	144.1	87%	0.874	73%	0.726	S	S	*	*				-164.3	89.8	120.9	-140.7	74.3	0	0	0	111.2
235	M	25.2	Very low	29.7	Very low	181 Å²	181	142 Å²	142	89%	0.892	72%	0.723	S	S	*	*			trans	-90.7	111	162.3	-82.5	-74.8	-98.3	0	0	107.9
236	N	28.2	Very low	29.5	Very low	144 Å²	144	139.2 Å²	139.2	77%	0.77	71%	0.707	S	S	*	*			trans	-154	147.7	163.6	-120.5	-27.5	0	0	0	111.5
237	V	28	Very low	29.3	Very low	121 Å²	121	138.2 Å²	138.2	73%	0.733	70%	0.702	S	S	*	*			trans	-58	134.1	-167.3	-177.4	0	0	0	0	112.3
238	K	31.2	Very low	29.2	Very low	166 Å²	166	138.3 Å²	138.3	72%	0.722	70%	0.7	S	S	*	*			trans	-128.8	89.2	169.8	-78.3	-167.2	174.2	-175.7	0	111.7	Y210 I240	Y210-K238 PolarHBondContact OH-O 3.41Å; K238-I240 PolarHBondContact O-N 2.85Å
239	T	33.6	Very low	28.9	Very low	79 Å²	79	141.1 Å²	141.1	49%	0.485	71%	0.706	S	S	.	*			trans	-58	127.9	163	-40.6	0	0	0	0	109.3
240	I	33.6	Very low	28.8	Very low	91 Å²	91	139.8 Å²	139.8	47%	0.467	70%	0.704	S	S	.	*			trans	-103.3	101.5	179.3	-52.5	-179.7	0	0	0	108.7	K238 W242	K238-I240 PolarHBondContact O-N 2.85Å; I240-W242 HydrophobicContact CG2-CD2 4.23Å; I240-W242 HydrophobicContact CG2-CZ2 3.75Å
241	N	30.7	Very low	28.4	Very low	117 Å²	117	138.7 Å²	138.7	63%	0.626	70%	0.699	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.2	136.3	168.4	-68.7	-17.5	0	0	0	109.2
242	W	30.4	Very low	28.1	Very low	168 Å²	168	139.9 Å²	139.9	64%	0.636	70%	0.704	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111.5	142.7	173.1	-59	91.4	0	0	0	110.4	H205 I240	H205-W242 PolarHBondContact ND1-O 3.34Å; H205-W242 VanDerWaalsContact ND1-O 3.14Å; I240-W242 HydrophobicContact CG2-CD2 4.23Å; I240-W242 HydrophobicContact CG2-CZ2 3.75Å
243	E	28.5	Very low	27.9	Very low	143 Å²	143	139.5 Å²	139.5	67%	0.668	70%	0.703	S	S	*	*			trans	-118.4	125.9	171.9	-175.2	174.5	-177.8	0	0	107.9
244	L	28.4	Very low	27.9	Very low	99 Å²	99	140.4 Å²	140.4	52%	0.518	71%	0.707	S	S	.	*			trans	-113.9	100.1	-173.3	-154.1	87.2	0	0	0	110.7	S203 L246	S203-L244 WeakPolarHBondContact CB-O 3.48Å; L244-L246 HydrophobicContact CD2-CD1 4.34Å; L244-L246 HydrophobicContact CD2-CD2 4.33Å; L244-L246 HydrophobicContact CD2-CG 4.23Å
245	L	26.2	Very low	27.7	Very low	137 Å²	137	140 Å²	140	72%	0.717	71%	0.705	S	S	*	*			trans	-89.4	114.3	172.4	-102.3	161.6	0	0	0	109.9
246	L	28.1	Very low	27.9	Very low	95 Å²	95	136 Å²	136	50%	0.497	70%	0.702	S	S	.	*			trans	-102.6	117.8	176.2	-70.5	168.4	0	0	0	109.8	T201 L244	T201-L246 WeakPolarHBondContact CB-O 3.32Å; T201-L246 HydrophobicContact CG2-CB 4.46Å; T201-L246 WeakPolarHBondContact CG2-O 3.36Å; L244-L246 HydrophobicContact CD2-CD1 4.34Å; L244-L246 HydrophobicContact CD2-CD2 4.33Å; L244-L246 HydrophobicContact CD2-CG 4.23Å
247	N	26.7	Very low	27.7	Very low	134 Å²	134	138.6 Å²	138.6	72%	0.717	71%	0.706	S	S	*	*			trans	-117.1	146.3	166	-83.9	-12.8	0	0	0	109.1
248	P	27.6	Very low	27.9	Very low	99 Å²	99	140.6 Å²	140.6	64%	0.643	71%	0.713	S	S	*	*			trans	-76.7	165.8	174.1	35.1	-34.2	0	0	0	111.1	D250	P248-D250 PolarHBondContact O-N 3.37Å
249	F	25.4	Very low	27.7	Very low	214 Å²	214	142.9 Å²	142.9	94%	0.939	72%	0.722	S	S	*	*	S	Bend	trans	-41.6	106.5	177.3	-75.8	-105.2	0	0	0	113.9
250	D	25.8	Very low	27.5	Very low	134 Å²	134	150.8 Å²	150.8	72%	0.717	74%	0.743	S	S	*	*				-168.1	170.7	103.1	-132.8	-35.1	0	0	0	113.4	P248	P248-D250 PolarHBondContact O-N 3.37Å
251	Q	25.1	Very low	27.2	Very low	151 Å²	151	154.4 Å²	154.4	71%	0.706	76%	0.763	S	S	*	*			trans	-5	123.8	172.7	-66.3	172.2	49.1	0	0	120
252	L	25.3	Very low	27	Very low	171 Å²	171	152.3 Å²	152.3	90%	0.895	77%	0.77	S	S	*	*			trans	-118.7	106	154.3	-96	172.4	0	0	0	112.6
253	K	23	Very low	26.7	Very low	166 Å²	166	151.5 Å²	151.5	72%	0.722	77%	0.771	S	S	*	*			trans	-73.3	140.7	156	-71.4	172.6	179.2	166.5	0	108.9
254	L	27.6	Very low	26.6	Very low	172 Å²	172	151.1 Å²	151.1	90%	0.901	78%	0.778	S	S	*	*			trans	-111.9	110.6	159	-102.4	167	0	0	0	109.9	A256	L254-A256 PolarHBondContact O-N 2.93Å
255	N	23.2	Very low	26.5	Very low	157 Å²	157	153.1 Å²	153.1	84%	0.84	79%	0.785	S	S	*	*			trans	-79.9	109.7	171.3	-85.4	-28	0	0	0	109.6
256	A	28.3	Very low	26.4	Very low	99 Å²	99	155 Å²	155	82%	0.818	80%	0.796	S	S	*	*			trans	-125.1	132.7	162.6	0	0	0	0	0	109.1	L254	L254-A256 PolarHBondContact O-N 2.93Å
257	K	25.4	Very low	26.3	Very low	198 Å²	198	158.6 Å²	158.6	86%	0.861	81%	0.81	S	S	*	*			trans	-88	166.7	-172.9	-69.5	179.5	178.7	175.2	0	112.5
258	N	31.5	Very low	26.1	Very low	163 Å²	163	155.4 Å²	155.4	87%	0.872	81%	0.809	S	S	*	*			trans	85.7	136.8	167.7	-57.6	-15.1	0	0	0	117
259	K	27.8	Very low	26.1	Very low	213 Å²	213	158.9 Å²	158.9	93%	0.926	82%	0.82	S	S	*	*			trans	-90	144.4	-165.8	-61.6	176.1	179.1	177.7	0	111.6
260	R	28.8	Very low	26.1	Very low	246 Å²	246	154.4 Å²	154.4	93%	0.928	81%	0.806	S	S	*	*			trans	-93.6	143.1	173.3	-90.7	-171.7	178.9	173.7	0.6	112.9
261	N	27	Very low	26.1	Very low	166 Å²	166	156.5 Å²	156.5	89%	0.888	82%	0.816	S	S	*	*			trans	-84.6	174.1	152.7	-75.5	-32.5	0	0	0	110.2
262	G	27.5	Very low	26.2	Very low	74 Å²	74	159.1 Å²	159.1	76%	0.763	83%	0.826	S	S	*	*			trans	110.4	139.9	147.2	0	0	0	0	0	116.5
263	F	23	Very low	26	Very low	150 Å²	150	154.3 Å²	154.3	66%	0.658	80%	0.803	S	S	*	*			trans	-85.9	133.3	166.4	-79.1	-115.1	0	0	0	109.6	T128	T128-F263 HydrophobicContact CG2-CD1 4.39Å; T128-F263 HydrophobicContact CG2-CE1 3.84Å
264	V	26.7	Very low	26.1	Very low	136 Å²	136	151.5 Å²	151.5	82%	0.824	80%	0.802	S	S	*	*			trans	-140.1	158.7	152	-176	0	0	0	0	106.8
265	H	25.6	Very low	26	Very low	140 Å²	140	151.8 Å²	151.8	65%	0.648	80%	0.796	S	S	*	*			trans	-63.1	165.3	172.3	-86.4	-137.9	0	0	0	113	E267	H265-E267 HydrophobicContact CB-CG 4.41Å; H265-E267 PolarHBondContact O-N 2.9Å
266	D	25.7	Very low	26.3	Very low	177 Å²	177	151.7 Å²	151.7	95%	0.947	79%	0.794	S	S	*	*	S	Bend	trans	-71.1	64.6	157.6	-78.7	-51.5	0	0	0	110.9
267	E	24.6	Very low	26.4	Very low	171 Å²	171	152.8 Å²	152.8	80%	0.799	79%	0.786	S	S	*	*			trans	-115.6	79.5	159.1	-71.9	-170	159.2	0	0	106.7	H265	H265-E267 HydrophobicContact CB-CG 4.41Å; H265-E267 PolarHBondContact O-N 2.9Å
268	G	24.1	Very low	26.4	Very low	67 Å²	67	154.7 Å²	154.7	69%	0.691	79%	0.788	S	S	*	*			trans	-157.7	8.9	-157.6	0	0	0	0	0	119.2
269	I	26.9	Very low	26.4	Very low	171 Å²	171	155.6 Å²	155.6	88%	0.877	78%	0.784	S	S	*	*	S	Bend	trans	-123.2	50.3	173	-42	-177.6	0	0	0	110.6
270	D	26.2	Very low	26.5	Very low	121 Å²	121	151.2 Å²	151.2	65%	0.647	78%	0.775	S	S	*	*			trans	-139.2	13.9	180	-102.8	-43.6	0	0	0	114.4	F272 T273	D270-F272 PolarHBondContact O-N 3.24Å; D270-F272 VanDerWaalsContact O-N 3.14Å; D270-T273 HydrophobicContact CB-CG2 4.37Å; D270-T273 WeakPolarHBondContact O-CG2 3.09Å; D270-T273 PolarHBondContact O-N 3.42Å; D270-T273 PolarHBondContact O-OG1 3.03Å; D270-T273 WeakPolarHBondContact OD1-CG2 3.38Å
271	L	24.5	Very low	26.8	Very low	177 Å²	177	144.8 Å²	144.8	93%	0.927	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	8	175	-92	166	0	0	0	114.6
272	F	26.8	Very low	27.6	Very low	207 Å²	207	141.3 Å²	141.3	91%	0.908	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	31.7	166.6	-86.2	-76.9	0	0	0	112.8	D270 P274	D270-F272 PolarHBondContact O-N 3.24Å; D270-F272 VanDerWaalsContact O-N 3.14Å; F272-P274 WeakPolarHBondContact O-CD 3.44Å
273	T	21.8	Very low	28.3	Very low	69 Å²	69	145.8 Å²	145.8	42%	0.423	75%	0.747	S	S	.	*			trans	-88.2	106.6	165.5	58.6	0	0	0	0	111.7	D270 K275	D270-T273 HydrophobicContact CB-CG2 4.37Å; D270-T273 WeakPolarHBondContact O-CG2 3.09Å; D270-T273 PolarHBondContact O-N 3.42Å; D270-T273 PolarHBondContact O-OG1 3.03Å; D270-T273 WeakPolarHBondContact OD1-CG2 3.38Å; T273-K275 PolarHBondContact O-N 3.5Å; T273-K275 VanDerWaalsContact O-N 3.13Å
274	P	26.1	Very low	28.9	Very low	108 Å²	108	142.6 Å²	142.6	70%	0.701	74%	0.74	S	S	*	*			trans	-63	108.2	143.3	29	-29.7	0	0	0	106.3	F272 I276	F272-P274 WeakPolarHBondContact O-CD 3.44Å; P274-I276 PolarHBondContact O-N 3.34Å
275	K	24.1	Very low	29.6	Very low	178 Å²	178	140.8 Å²	140.8	77%	0.774	73%	0.733	S	S	*	*			trans	-68	82.4	174.8	-75.7	-174.1	177	179.9	0	109.6	T273 N277	T273-K275 PolarHBondContact O-N 3.5Å; T273-K275 VanDerWaalsContact O-N 3.13Å; K275-N277 PolarHBondContact O-N 3.15Å; K275-N277 VanDerWaalsContact O-N 3.09Å
276	I	29.7	Very low	30.3	Very low	155 Å²	155	140.1 Å²	140.1	80%	0.795	73%	0.729	S	S	*	*			trans	-62.1	108.6	157.5	-61.4	177.9	0	0	0	105	P274	P274-I276 PolarHBondContact O-N 3.34Å
277	N	30	Very low	31.6	Very low	122 Å²	122	137.1 Å²	137.1	65%	0.652	70%	0.704	S	S	*	*			trans	-59.3	143	-176.7	-77.6	-32.6	0	0	0	110.3	K275 F279	K275-N277 PolarHBondContact O-N 3.15Å; K275-N277 VanDerWaalsContact O-N 3.09Å; N277-F279 HydrophobicContact CB-CD2 4.5Å; N277-F279 PolarHBondContact O-N 3.24Å
278	R	26.9	Very low	32.9	Very low	238 Å²	238	134.6 Å²	134.6	90%	0.898	69%	0.69	S	S	*	*			trans	-67.6	81.4	172.7	-71.1	179.7	176.6	167.6	-2.3	110.4
279	F	29.9	Very low	34.3	Very low	181 Å²	181	134.8 Å²	134.8	79%	0.794	68%	0.675	S	S	*	*			trans	-90.3	102.1	148.2	-82	-88.1	0	0	0	107.1	N277 D281	N277-F279 HydrophobicContact CB-CD2 4.5Å; N277-F279 PolarHBondContact O-N 3.24Å; F279-D281 PolarHBondContact O-N 3.46Å
280	T	29.8	Very low	35.7	Very low	121 Å²	121	129 Å²	129	74%	0.742	65%	0.646	S	S	*	*			trans	-78.4	78.5	170.5	46.1	0	0	0	0	108.6
281	D	36.7	Very low	36.9	Very low	111 Å²	111	124.8 Å²	124.8	59%	0.594	63%	0.625	S	S	*	*			trans	-125.3	106.2	175.3	-152.7	-30.6	0	0	0	109	F279 E283	F279-D281 PolarHBondContact O-N 3.46Å; D281-E283 VanDerWaalsContact C-N 3.31Å; D281-E283 PolarHBondContact O-N 3.37Å
282	P	43.1	Very low	38.6	Very low	93 Å²	93	119 Å²	119	60%	0.604	59%	0.594	S	S	*	*			trans	-83.2	-0.6	-170.7	33.9	-35.5	0	0	0	114	V284	P282-V284 PolarHBondContact O-N 3.38Å
283	E	42.1	Very low	39.8	Very low	169 Å²	169	113 Å²	113	79%	0.79	57%	0.57	S	S	*	*			trans	-62	-16	-168.7	-76.7	-158.3	143.2	0	0	116.3	D281	D281-E283 VanDerWaalsContact C-N 3.31Å; D281-E283 PolarHBondContact O-N 3.37Å
284	V	36.2	Very low	41.3	Very low	82 Å²	82	112.6 Å²	112.6	50%	0.497	57%	0.567	S	S	.	*			trans	-117.4	72.6	-175.6	-161.9	0	0	0	0	113.1	P282 R287	P282-V284 PolarHBondContact O-N 3.38Å; V284-R287 HydrophobicContact CG1-CG 3.68Å; V284-R287 VanDerWaalsContact CG1-NE 3.34Å
285	S	40.7	Very low	42.4	Very low	99 Å²	99	109.6 Å²	109.6	69%	0.692	56%	0.556	S	S	*	*			trans	-59.8	137.1	161.4	57.9	0	0	0	0	111.3
286	K	41.6	Very low	43.5	Very low	126 Å²	126	111.2 Å²	111.2	55%	0.548	57%	0.566	S	S	.	*			trans	55.2	84.6	177.7	-63	-171.2	-177.8	-143.9	0	115.2	D308	K286-D308 WeakPolarHBondContact CE-OD1 3.36Å; K286-D308 WeakPolarHBondContact CE-OD2 3.22Å; K286-D308 WeakPolarHBondContact CG-OD1 3.32Å; K286-D308 IonicContact NZ-OD2 2.74Å; K286-D308 PolarHBondContact NZ-OD2 3.33Å
287	R	51.7	Low	44.2	Very low	114 Å²	114	112.7 Å²	112.7	43%	0.43	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.3	141	160.6	-63.8	-169.7	-176.2	-154.6	-1.4	109.9	V284 Y307	V284-R287 HydrophobicContact CG1-CG 3.68Å; V284-R287 VanDerWaalsContact CG1-NE 3.34Å; R287-Y307 PolarHBondContact O-N 3.49Å
288	K	51.8	Low	44.9	Very low	117 Å²	117	115.6 Å²	115.6	51%	0.509	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.8	135.4	176.4	-54.9	-163.5	171.5	-98.1	0	109.9	Q304 V305 D306	K288-Q304 HydrophobicContact CB-CG 3.89Å; K288-Q304 HydrophobicContact CD-CG 4.09Å; K288-Q304 VanDerWaalsContact CD-OE1 3.23Å; K288-V305 CarbonylContact C-O 3.57Å; K288-V305 WeakPolarHBondContact CA-O 3.33Å; K288-D306 WeakPolarHBondContact CD-OD1 3.39Å; K288-D306 WeakPolarHBondContact CE-OD1 3.28Å; K288-D306 VanDerWaalsContact CG-OD1 3.31Å; K288-D306 WeakPolarHBondContact CG-OD1 3.29Å; K288-D306 IonicContact NZ-OD1 2.68Å; K288-D306 PolarHBondContact NZ-OD1 3.35Å; K288-D306 IonicContact NZ-OD2 3.03Å; K288-D306 PolarHBondContact NZ-OD2 3.31Å
289	I	54.3	Low	45.5	Very low	71 Å²	71	114.1 Å²	114.1	36%	0.364	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.2	121.1	179.2	-57.4	176.2	0	0	0	109	Q304 V305	I289-Q304 CarbonylContact O-C 3.59Å; I289-Q304 WeakPolarHBondContact O-CA 3.4Å; I289-V305 PolarHBondContact N-O 2.83Å; I289-V305 PolarHBondContact O-N 3.38Å
290	D	56.6	Low	46.1	Very low	51 Å²	51	114.4 Å²	114.4	27%	0.273	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.1	109.8	174.1	-92	27.6	0	0	0	110	K302 Q304	D290-K302 IonicContact OD2-NZ 2.8Å; D290-K302 PolarHBondContact OD2-NZ 3.18Å; D290-Q304 PolarHBondContact OD1-NE2 3.32Å
291	C	51.4	Low	47	Very low	31 Å²	31	114 Å²	114	21%	0.209	56%	0.563	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.8	136.8	169.1	-78	0	0	0	0	110.8	C208 K302 R303	C208-C291 HydrophobicContact CB-CB 4.09Å; C208-C291 WeakPolarHBondContact CB-SG 3.17Å; C208-C291 WeakPolarHBondContact SG-CB 3.43Å; C208-C291 CovalentContact SG-SG 2.04Å; C208-C291 PolarHBondContact SG-SG 3.02Å; C291-K302 WeakPolarHBondContact O-CA 3.3Å; C291-R303 PolarHBondContact N-O 3.22Å; C291-R303 PolarHBondContact O-N 3.23Å
292	Q	59.4	Low	47.7	Very low	57 Å²	57	115.1 Å²	115.1	27%	0.266	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.8	133.5	176.8	-164.6	-174.9	-78.2	0	0	110.8	K207 D301 K302	K207-Q292 PolarHBondContact N-O 3.26Å; K207-Q292 PolarHBondContact O-N 2.82Å; K207-Q292 VanDerWaalsContact O-O 3.05Å; Q292-D301 WeakPolarHBondContact CA-O 3.32Å; Q292-K302 HydrophobicContact CB-CG 4.44Å; Q292-K302 HydrophobicContact CG-CG 4.24Å
293	I	51.3	Low	48.2	Very low	81 Å²	81	120.4 Å²	120.4	42%	0.415	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.1	139	175.7	-52.7	-174.9	0	0	0	108.8	V204 V206 D301	V204-I293 HydrophobicContact CG1-CG2 3.56Å; V206-I293 HydrophobicContact CG1-CG1 4.17Å; V206-I293 HydrophobicContact CG2-CD1 4.37Å; V206-I293 HydrophobicContact CG2-CG1 4.07Å; V206-I293 HydrophobicContact CG2-CG2 4.36Å; I293-D301 PolarHBondContact N-O 2.99Å; I293-D301 VanDerWaalsContact N-O 3.15Å
294	T	53.8	Low	48.9	Very low	60 Å²	60	117.5 Å²	117.5	37%	0.368	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-138.1	106.1	177.9	47.6	0	0	0	0	111.1	H205 R300	H205-T294 PolarHBondContact O-N 3.38Å; T294-R300 HydrophobicContact CG2-CG 4.12Å
295	G	49.3	Very low	49.7	Very low	45 Å²	45	117.2 Å²	117.2	46%	0.464	56%	0.555	S	S	.	*			trans	-86.5	169.4	167	0	0	0	0	0	112.2	Q297 Q298	G295-Q297 PolarHBondContact O-N 2.94Å; G295-Q297 VanDerWaalsContact O-N 3.12Å; G295-Q298 PolarHBondContact O-N 3.07Å
296	Q	47.7	Very low	50.7	Low	211 Å²	211	116.5 Å²	116.5	99%	0.986	54%	0.544	S	S	*	.	S	Bend	trans	-64.5	-15.9	-176.8	-70.7	-175.2	-15.2	0	0	114.5
297	Q	45	Very low	51.5	Low	186 Å²	186	117 Å²	117	87%	0.869	54%	0.543	S	S	*	.	S	Bend	trans	-101.2	53.3	173.2	-70	-172.6	-15.9	0	0	113.2	G295 R299	G295-Q297 PolarHBondContact O-N 2.94Å; G295-Q297 VanDerWaalsContact O-N 3.12Å; Q297-R299 PolarHBondContact O-N 3.12Å
298	Q	42.9	Very low	52.2	Low	184 Å²	184	114.7 Å²	114.7	86%	0.86	54%	0.539	S	S	*	.			trans	47.7	-2.2	158.3	-122	-177.1	23.1	0	0	122	G295	G295-Q298 PolarHBondContact O-N 3.07Å
299	R	39.8	Very low	53	Low	207 Å²	207	113 Å²	113	78%	0.781	54%	0.538	S	S	*	.			trans	-68	136.3	169.1	-93.3	-170.5	172.6	-171	-1.2	110.4	Q297	Q297-R299 PolarHBondContact O-N 3.12Å
300	R	42.3	Very low	54	Low	187 Å²	187	116.5 Å²	116.5	71%	0.706	55%	0.548	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.6	105.4	175.2	-74.7	-175.9	-79.3	-179	-6.2	108.8	T294	T294-R300 HydrophobicContact CG2-CG 4.12Å
301	D	48.8	Very low	55	Low	113 Å²	113	119.2 Å²	119.2	60%	0.604	56%	0.555	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.2	134.6	165.1	-84.1	-60.1	0	0	0	109.7	Q292 I293	Q292-D301 WeakPolarHBondContact CA-O 3.32Å; I293-D301 PolarHBondContact N-O 2.99Å; I293-D301 VanDerWaalsContact N-O 3.15Å
302	K	52.8	Low	56.3	Low	133 Å²	133	120.2 Å²	120.2	58%	0.578	56%	0.561	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-108	135.8	170.9	-85.5	-171.2	159.6	-149	0	109	D290 C291 Q292	D290-K302 IonicContact OD2-NZ 2.8Å; D290-K302 PolarHBondContact OD2-NZ 3.18Å; C291-K302 WeakPolarHBondContact O-CA 3.3Å; Q292-K302 HydrophobicContact CB-CG 4.44Å; Q292-K302 HydrophobicContact CG-CG 4.24Å
303	R	52	Low	57.2	Low	204 Å²	204	117.8 Å²	117.8	77%	0.77	55%	0.551	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-128.2	125.6	169.8	-159.1	173	-172.2	174.3	2.6	110	C291	C291-R303 PolarHBondContact N-O 3.22Å; C291-R303 PolarHBondContact O-N 3.23Å
304	Q	56.8	Low	58.3	Low	108 Å²	108	121 Å²	121	51%	0.505	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.9	135.2	179.7	-172.2	163.4	87.4	0	0	109.8	K288 I289 D290	K288-Q304 HydrophobicContact CB-CG 3.89Å; K288-Q304 HydrophobicContact CD-CG 4.09Å; K288-Q304 VanDerWaalsContact CD-OE1 3.23Å; I289-Q304 CarbonylContact O-C 3.59Å; I289-Q304 WeakPolarHBondContact O-CA 3.4Å; D290-Q304 PolarHBondContact OD1-NE2 3.32Å
305	V	52.9	Low	59.6	Low	76 Å²	76	120.3 Å²	120.3	46%	0.461	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.4	122.4	-177	-176.4	0	0	0	0	109.5	K288 I289	K288-V305 CarbonylContact C-O 3.57Å; K288-V305 WeakPolarHBondContact CA-O 3.33Å; I289-V305 PolarHBondContact N-O 2.83Å; I289-V305 PolarHBondContact O-N 3.38Å
306	D	61.6	Low	61.4	Low	85 Å²	85	118.7 Å²	118.7	46%	0.455	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	133.2	175.4	-71.1	-3.3	0	0	0	110.2	K288	K288-D306 WeakPolarHBondContact CD-OD1 3.39Å; K288-D306 WeakPolarHBondContact CE-OD1 3.28Å; K288-D306 VanDerWaalsContact CG-OD1 3.31Å; K288-D306 WeakPolarHBondContact CG-OD1 3.29Å; K288-D306 IonicContact NZ-OD1 2.68Å; K288-D306 PolarHBondContact NZ-OD1 3.35Å; K288-D306 IonicContact NZ-OD2 3.03Å; K288-D306 PolarHBondContact NZ-OD2 3.31Å
307	Y	58.7	Low	63.3	Low	137 Å²	137	117 Å²	117	54%	0.537	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	115.8	-178.3	-179.4	-104.1	0	0	0	111.5	R287 V309	R287-Y307 PolarHBondContact O-N 3.49Å; Y307-V309 HydrophobicContact CD1-CG2 4.07Å; Y307-V309 HydrophobicContact CE1-CG2 3.47Å; Y307-V309 VanDerWaalsContact CE1-CG2 3.47Å
308	D	66.7	Low	65.4	Low	64 Å²	64	109.3 Å²	109.3	34%	0.342	49%	0.49	S	S	.	.			trans	-105.4	136.3	174.8	-86.8	-47.6	0	0	0	110.7	K286	K286-D308 WeakPolarHBondContact CE-OD1 3.36Å; K286-D308 WeakPolarHBondContact CE-OD2 3.22Å; K286-D308 WeakPolarHBondContact CG-OD1 3.32Å; K286-D308 IonicContact NZ-OD2 2.74Å; K286-D308 PolarHBondContact NZ-OD2 3.33Å
309	V	68.8	Low	67.5	Low	81 Å²	81	104.3 Å²	104.3	49%	0.491	47%	0.469	S	S	.	.			trans	-100.8	110.8	-176.6	178.7	0	0	0	0	110.9	Y307 N344	Y307-V309 HydrophobicContact CD1-CG2 4.07Å; Y307-V309 HydrophobicContact CE1-CG2 3.47Å; Y307-V309 VanDerWaalsContact CE1-CG2 3.47Å; V309-N344 PolarHBondContact O-ND2 2.8Å
310	Y	75.3	Confident	69.7	Low	145 Å²	145	96.7 Å²	96.7	57%	0.569	45%	0.446	S	S	*	.			trans	-85.1	136.8	170.2	-59.7	-53.8	0	0	0	111.5	N344	Y310-N344 CarbonylContact C-O 3.56Å; Y310-N344 WeakPolarHBondContact CA-O 3.47Å; Y310-N344 WeakPolarHBondContact CB-O 3.43Å
311	Y	76.6	Confident	71.5	Confident	109 Å²	109	91.7 Å²	91.7	43%	0.427	43%	0.433	S	S	.	.	B	Isolated β-bridge	trans	-144.2	137.1	177	59.6	-92.4	0	0	0	110.8	N344	Y311-N344 HydrophobicContact CD1-CB 3.76Å; Y311-N344 HydrophobicContact CE1-CB 3.46Å; Y311-N344 VanDerWaalsContact CE1-CB 3.46Å; Y311-N344 HydrophobicContact CE2-CB 4.44Å; Y311-N344 HydrophobicContact CG-CB 4.37Å; Y311-N344 PolarHBondContact N-O 3.01Å; Y311-N344 PolarHBondContact O-N 2.8Å; Y311-N344 VanDerWaalsContact O-O 3.12Å
312	P	78.7	Confident	73.1	Confident	51 Å²	51	89 Å²	89	33%	0.331	42%	0.418	S	S	.	.			trans	-80.4	156.4	-178.7	34.5	-34.9	0	0	0	111.7	S407 I410	P312-S407 WeakPolarHBondContact CA-OG 3.34Å; P312-I410 HydrophobicContact CB-CD1 4.16Å; P312-I410 HydrophobicContact CG-CD1 4.49Å
313	S	80.2	Confident	74.2	Confident	6 Å²	6	85.2 Å²	85.2	4%	0.042	41%	0.409	C	S	.	.			trans	-62.9	139.4	163.1	-174.8	0	0	0	0	110.3	S315 E341 S407	S313-S315 PolarHBondContact OG-O 3.37Å; S313-E341 VanDerWaalsContact CB-O 3.24Å; S313-E341 WeakPolarHBondContact CB-O 3.01Å; S313-E341 PolarHBondContact OG-O 3.06Å; S313-S407 PolarHBondContact N-OG 2.96Å
314	K	74.4	Confident	75.1	Confident	149 Å²	149	78 Å²	78	65%	0.648	39%	0.388	S	S	*	.			trans	-100.2	-29.4	-173.2	-59.4	171.4	-170.5	154.3	0	114.1
315	S	80.8	Confident	75.9	Confident	45 Å²	45	79.4 Å²	79.4	32%	0.315	40%	0.399	S	S	.	.			trans	-137	151.7	-178.2	75.1	0	0	0	0	112	S313 A340 E341	S313-S315 PolarHBondContact OG-O 3.37Å; S315-A340 WeakPolarHBondContact O-CA 3.43Å; S315-A340 WeakPolarHBondContact O-CB 3.5Å; S315-E341 VanDerWaalsContact CB-OE1 3.3Å; S315-E341 WeakPolarHBondContact CB-OE1 3.4Å; S315-E341 PolarHBondContact O-N 2.81Å; S315-E341 PolarHBondContact OG-OE1 3.37Å
316	V	87.1	Confident	77.1	Confident	12 Å²	12	84 Å²	84	7%	0.073	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	132.2	173.3	56.3	0	0	0	0	108.9	T339 A340 L349 C403 V405 S417	V316-T339 CarbonylContact C-O 3.56Å; V316-T339 VanDerWaalsContact CA-O 3.25Å; V316-T339 WeakPolarHBondContact CA-O 3.29Å; V316-T339 WeakPolarHBondContact CG2-O 3.42Å; V316-A340 HydrophobicContact CB-CB 3.96Å; V316-A340 HydrophobicContact CG2-CB 4.07Å; V316-L349 HydrophobicContact CG2-CD2 3.7Å; V316-C403 HydrophobicContact CG2-CB 3.6Å; V316-V405 HydrophobicContact CB-CB 4.2Å; V316-V405 HydrophobicContact CB-CG1 3.95Å; V316-V405 HydrophobicContact CG1-CB 4.32Å; V316-V405 HydrophobicContact CG1-CG1 3.84Å; V316-S417 WeakPolarHBondContact O-CA 3.49Å; V316-S417 WeakPolarHBondContact O-CB 3.44Å
317	R	87.1	Confident	78	Confident	174 Å²	174	85.4 Å²	85.4	66%	0.657	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	160.3	176.3	-58.5	177.6	-177.5	159.7	2.8	110.1	C338 T339	R317-C338 WeakPolarHBondContact O-CA 3.42Å; R317-T339 PolarHBondContact N-O 2.9Å; R317-T339 PolarHBondContact O-N 2.89Å
318	L	90	Very high	79.3	Confident	25 Å²	25	79.6 Å²	79.6	13%	0.131	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	115.2	177.4	-175.5	164.7	0	0	0	108.1	T320 I336 K337 L351 F402 V420	L318-T320 HydrophobicContact CD2-CG2 3.41Å; L318-T320 VanDerWaalsContact CD2-CG2 3.41Å; L318-I336 HydrophobicContact CD1-CG2 3.94Å; L318-I336 HydrophobicContact CD2-CG2 3.76Å; L318-I336 HydrophobicContact CG-CG2 3.59Å; L318-K337 WeakPolarHBondContact CA-O 3.49Å; L318-L351 HydrophobicContact CD1-CD1 4.39Å; L318-F402 VanDerWaalsContact CD1-CA 3.45Å; L318-V420 HydrophobicContact CD2-CG2 3.81Å
319	D	87	Confident	80.2	Confident	80 Å²	80	83.2 Å²	83.2	43%	0.428	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	149.1	172.5	-43.5	-62.1	0	0	0	109.3	K337	D319-K337 HydrophobicContact CB-CB 4.27Å; D319-K337 PolarHBondContact N-O 3.19Å; D319-K337 PolarHBondContact O-N 3.11Å
320	T	84.2	Confident	81	Confident	47 Å²	47	81.5 Å²	81.5	29%	0.288	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	156	179.8	58.5	0	0	0	0	112.1	L318 L322 L334 E335 I336 Y422	L318-T320 HydrophobicContact CD2-CG2 3.41Å; L318-T320 VanDerWaalsContact CD2-CG2 3.41Å; T320-L322 VanDerWaalsContact C-N 3.33Å; T320-L322 PolarHBondContact OG1-O 2.97Å; T320-L334 HydrophobicContact CG2-CD1 4.4Å; T320-E335 WeakPolarHBondContact CA-O 3.49Å; T320-I336 HydrophobicContact CG2-CG1 4.17Å; T320-I336 HydrophobicContact CG2-CG2 4.41Å; T320-Y422 VanDerWaalsContact CB-OH 3.32Å; T320-Y422 WeakPolarHBondContact CB-OH 3.16Å; T320-Y422 WeakPolarHBondContact CG2-OH 3.34Å; T320-Y422 PolarHBondContact OG1-OH 2.9Å
321	N	82.1	Confident	81.5	Confident	82 Å²	82	76.7 Å²	76.7	44%	0.439	39%	0.389	S	S	.	.	S	Bend	trans	-81.3	-4	176	70.1	-26.6	0	0	0	114.8	E335	N321-E335 HydrophobicContact CB-CB 4.15Å; N321-E335 PolarHBondContact N-O 3.06Å; N321-E335 PolarHBondContact OD1-N 3.48Å; N321-E335 PolarHBondContact OD1-O 2.97Å
322	L	80.5	Confident	82	Confident	55 Å²	55	73.7 Å²	73.7	29%	0.288	38%	0.382	S	S	.	.	S	Bend	trans	-136	130.5	-174.8	-68.4	171.5	0	0	0	110.9	T320 V328 T332 L334 Y422	T320-L322 VanDerWaalsContact C-N 3.33Å; T320-L322 PolarHBondContact OG1-O 2.97Å; L322-V328 HydrophobicContact CD1-CG1 4.29Å; L322-T332 HydrophobicContact CD1-CG2 3.68Å; L322-L334 HydrophobicContact CB-CD1 4.11Å; L322-L334 HydrophobicContact CD1-CD1 4.1Å; L322-L334 HydrophobicContact CG-CD1 4.43Å; L322-Y422 HydrophobicContact CB-CE1 4.19Å; L322-Y422 PolarHBondContact O-OH 3.11Å
323	S	76.2	Confident	82.4	Confident	55 Å²	55	75.6 Å²	75.6	39%	0.385	39%	0.388	S	S	.	.			trans	-65.2	138.4	173.3	176.6	0	0	0	0	111.2	D325	S323-D325 PolarHBondContact O-N 3.06Å; S323-D325 PolarHBondContact OG-N 3.07Å; S323-D325 PolarHBondContact OG-OD2 3.32Å
324	P	72	Confident	82.7	Confident	53 Å²	53	75.3 Å²	75.3	34%	0.344	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-11.8	174.3	30.9	-37.5	0	0	0	114.6	Y326 V420 R421 Y422	P324-Y326 PolarHBondContact O-N 2.96Å; P324-V420 HydrophobicContact CB-CG1 3.89Å; P324-V420 HydrophobicContact CG-CG1 4.13Å; P324-R421 WeakPolarHBondContact CB-O 3.35Å; P324-Y422 HydrophobicContact CB-CE1 4.39Å
325	D	73.3	Confident	83.3	Confident	136 Å²	136	70.9 Å²	70.9	73%	0.727	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-12.6	-171.8	-57.3	-46.2	0	0	0	114.3	S323	S323-D325 PolarHBondContact O-N 3.06Å; S323-D325 PolarHBondContact OG-N 3.07Å; S323-D325 PolarHBondContact OG-OD2 3.32Å
326	Y	77.3	Confident	83.7	Confident	173 Å²	173	68.8 Å²	68.8	68%	0.678	35%	0.353	S	S	*	.	S	Bend	trans	-116.8	153.3	-174.8	-62.9	-80	0	0	0	112.4	P324 V328	P324-Y326 PolarHBondContact O-N 2.96Å; Y326-V328 PolarHBondContact O-N 3.48Å
327	F	80.8	Confident	83.7	Confident	115 Å²	115	71.6 Å²	71.6	50%	0.504	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	121.1	169.7	-76	-92.3	0	0	0	110.3	N423	F327-N423 WeakPolarHBondContact CA-O 3.48Å; F327-N423 WeakPolarHBondContact CD1-ND2 3.42Å; F327-N423 WeakPolarHBondContact CE1-ND2 3.46Å; F327-N423 WeakPolarHBondContact CE1-OD1 3.23Å; F327-N423 VanDerWaalsContact CZ-ND2 3.33Å; F327-N423 WeakPolarHBondContact CZ-ND2 3.34Å
328	V	86.2	Confident	83.8	Confident	14 Å²	14	63.3 Å²	63.3	9%	0.085	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	128.7	178.2	-177.8	0	0	0	0	109.4	L322 Y326 T332 L392 Y422 N423 V424 S425	L322-V328 HydrophobicContact CD1-CG1 4.29Å; Y326-V328 PolarHBondContact O-N 3.48Å; V328-T332 HydrophobicContact CG1-CG2 3.7Å; V328-L392 HydrophobicContact CB-CD1 4.27Å; V328-L392 HydrophobicContact CG1-CD1 3.74Å; V328-Y422 HydrophobicContact CG2-CD1 3.91Å; V328-Y422 HydrophobicContact CG2-CE1 4.45Å; V328-N423 PolarHBondContact N-O 2.97Å; V328-V424 CarbonylContact O-C 3.48Å; V328-V424 VanDerWaalsContact O-CA 3.3Å; V328-V424 WeakPolarHBondContact O-CA 3.31Å; V328-S425 PolarHBondContact O-N 2.88Å
329	Q	85.6	Confident	83.8	Confident	140 Å²	140	63.2 Å²	63.2	65%	0.654	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	140.3	-178	-171.7	175.3	-8.1	0	0	111.7	T332	Q329-T332 VanDerWaalsContact O-CB 3.24Å; Q329-T332 WeakPolarHBondContact O-CB 3.39Å; Q329-T332 PolarHBondContact O-N 2.87Å; Q329-T332 VanDerWaalsContact O-N 3.12Å; Q329-T332 PolarHBondContact O-OG1 2.8Å
330	V	86.8	Confident	83.7	Confident	46 Å²	46	59.5 Å²	59.5	28%	0.279	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	139.4	171.1	63.2	0	0	0	0	111.9	T332 E394 V424 S425 F426	V330-T332 VanDerWaalsContact C-N 3.31Å; V330-E394 HydrophobicContact CG2-CG 3.98Å; V330-V424 HydrophobicContact CB-CG1 4.1Å; V330-S425 PolarHBondContact N-O 2.97Å; V330-F426 HydrophobicContact CB-CB 4.12Å; V330-F426 HydrophobicContact CG1-CB 3.87Å
331	G	85.1	Confident	83.6	Confident	43 Å²	43	60.4 Å²	60.4	44%	0.443	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	-8.3	-174.7	0	0	0	0	0	114.8	I333 L392	G331-I333 PolarHBondContact O-N 2.9Å; G331-L392 PolarHBondContact N-O 2.77Å
332	T	87.2	Confident	83.3	Confident	46 Å²	46	58.9 Å²	58.9	28%	0.282	31%	0.31	S	S	.	.			trans	-60.5	137.5	172.7	-57.9	0	0	0	0	110.7	L322 V328 Q329 V330 L392	L322-T332 HydrophobicContact CD1-CG2 3.68Å; V328-T332 HydrophobicContact CG1-CG2 3.7Å; Q329-T332 VanDerWaalsContact O-CB 3.24Å; Q329-T332 WeakPolarHBondContact O-CB 3.39Å; Q329-T332 PolarHBondContact O-N 2.87Å; Q329-T332 VanDerWaalsContact O-N 3.12Å; Q329-T332 PolarHBondContact O-OG1 2.8Å; V330-T332 VanDerWaalsContact C-N 3.31Å; T332-L392 PolarHBondContact O-N 2.77Å
333	I	86.9	Confident	83	Confident	91 Å²	91	56.7 Å²	56.7	47%	0.467	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	109.7	176.8	-51.7	178.3	0	0	0	108.9	G331 M389	G331-I333 PolarHBondContact O-N 2.9Å; I333-M389 HydrophobicContact CG2-CB 4.21Å; I333-M389 HydrophobicContact CG2-CE 3.86Å
334	L	85.7	Confident	83	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	128.4	173.8	-179.2	65.4	0	0	0	109.4	T320 L322 I336 V390 L392 Y422	T320-L334 HydrophobicContact CG2-CD1 4.4Å; L322-L334 HydrophobicContact CB-CD1 4.11Å; L322-L334 HydrophobicContact CD1-CD1 4.1Å; L322-L334 HydrophobicContact CG-CD1 4.43Å; L334-I336 HydrophobicContact CD2-CD1 3.65Å; L334-I336 HydrophobicContact CD2-CG1 3.94Å; L334-I336 HydrophobicContact CG-CD1 4.06Å; L334-I336 HydrophobicContact CG-CG1 3.75Å; L334-V390 PolarHBondContact N-O 2.8Å; L334-V390 PolarHBondContact O-N 3.14Å; L334-L392 HydrophobicContact CB-CD1 4.46Å; L334-L392 HydrophobicContact CB-CG 4.35Å; L334-L392 HydrophobicContact CD2-CD2 4.21Å; L334-Y422 HydrophobicContact CD1-CE1 4.2Å; L334-Y422 HydrophobicContact CD1-CE2 3.89Å; L334-Y422 WeakPolarHBondContact CD1-OH 3.27Å; L334-Y422 HydrophobicContact CD2-CD2 3.74Å; L334-Y422 HydrophobicContact CD2-CE2 3.4Å; L334-Y422 HydrophobicContact CG-CE2 4.31Å
335	E	87.7	Confident	82.9	Confident	57 Å²	57	55.4 Å²	55.4	27%	0.266	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	115.4	175.1	-175.4	161.3	-134.1	0	0	108.4	T320 N321 K369 M389	T320-E335 WeakPolarHBondContact CA-O 3.49Å; N321-E335 HydrophobicContact CB-CB 4.15Å; N321-E335 PolarHBondContact N-O 3.06Å; N321-E335 PolarHBondContact OD1-N 3.48Å; N321-E335 PolarHBondContact OD1-O 2.97Å; E335-K369 IonicContact OE1-NZ 2.73Å; E335-K369 PolarHBondContact OE1-NZ 2.79Å; E335-M389 HydrophobicContact CB-CE 3.91Å; E335-M389 HydrophobicContact CB-SD 4.08Å; E335-M389 HydrophobicContact CG-CE 4.04Å; E335-M389 HydrophobicContact CG-SD 3.69Å
336	I	88.1	Confident	83	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	124.6	-175.3	-52.3	-169.3	0	0	0	109.5	L318 T320 L334 L351 E387 F388 F401	L318-I336 HydrophobicContact CD1-CG2 3.94Å; L318-I336 HydrophobicContact CD2-CG2 3.76Å; L318-I336 HydrophobicContact CG-CG2 3.59Å; T320-I336 HydrophobicContact CG2-CG1 4.17Å; T320-I336 HydrophobicContact CG2-CG2 4.41Å; L334-I336 HydrophobicContact CD2-CD1 3.65Å; L334-I336 HydrophobicContact CD2-CG1 3.94Å; L334-I336 HydrophobicContact CG-CD1 4.06Å; L334-I336 HydrophobicContact CG-CG1 3.75Å; I336-L351 HydrophobicContact CB-CD2 4.27Å; I336-L351 HydrophobicContact CD1-CD1 4.11Å; I336-L351 HydrophobicContact CD1-CD2 3.91Å; I336-L351 HydrophobicContact CG1-CD2 4.49Å; I336-L351 HydrophobicContact CG2-CD1 4.08Å; I336-E387 WeakPolarHBondContact O-CA 3.06Å; I336-F388 PolarHBondContact N-O 2.95Å; I336-F388 PolarHBondContact O-N 3.05Å; I336-F401 HydrophobicContact CD1-CB 4.11Å; I336-F401 HydrophobicContact CD1-CD1 4.17Å; I336-F401 HydrophobicContact CD1-CG 4.21Å
337	K	88.9	Confident	83	Confident	72 Å²	72	45.9 Å²	45.9	31%	0.313	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	110.5	177.8	-166.4	-166.5	-161.7	83.5	0	109.1	L318 D319 T339 E387	L318-K337 WeakPolarHBondContact CA-O 3.49Å; D319-K337 HydrophobicContact CB-CB 4.27Å; D319-K337 PolarHBondContact N-O 3.19Å; D319-K337 PolarHBondContact O-N 3.11Å; K337-T339 HydrophobicContact CD-CG2 4.02Å; K337-T339 HydrophobicContact CG-CG2 4Å; K337-E387 HydrophobicContact CB-CG 4.28Å; K337-E387 HydrophobicContact CG-CG 3.93Å; K337-E387 IonicContact NZ-OE1 2.79Å; K337-E387 PolarHBondContact NZ-OE1 2.89Å
338	C	89.3	Confident	83.1	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	131.9	168.9	-64.4	0	0	0	0	109.3	R317 L349 T385 Q386 F388 C403	R317-C338 WeakPolarHBondContact O-CA 3.42Å; C338-L349 HydrophobicContact CB-CD1 4Å; C338-L349 HydrophobicContact CB-CD2 4.1Å; C338-T385 CarbonylContact O-C 3.48Å; C338-T385 WeakPolarHBondContact O-CA 3.47Å; C338-Q386 PolarHBondContact N-O 3.14Å; C338-Q386 PolarHBondContact O-N 3.49Å; C338-F388 HydrophobicContact CB-CE2 4.17Å; C338-C403 WeakPolarHBondContact CA-SG 3.37Å; C338-C403 HydrophobicContact CB-CB 3.81Å; C338-C403 WeakPolarHBondContact CB-SG 3.5Å; C338-C403 WeakPolarHBondContact SG-CB 3.29Å; C338-C403 CovalentContact SG-SG 2.03Å; C338-C403 PolarHBondContact SG-SG 2.83Å
339	T	88.2	Confident	83.2	Confident	22 Å²	22	46.2 Å²	46.2	14%	0.135	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	133.8	177.1	66.2	0	0	0	0	110.6	V316 R317 K337 I384 T385	V316-T339 CarbonylContact C-O 3.56Å; V316-T339 VanDerWaalsContact CA-O 3.25Å; V316-T339 WeakPolarHBondContact CA-O 3.29Å; V316-T339 WeakPolarHBondContact CG2-O 3.42Å; R317-T339 PolarHBondContact N-O 2.9Å; R317-T339 PolarHBondContact O-N 2.89Å; K337-T339 HydrophobicContact CD-CG2 4.02Å; K337-T339 HydrophobicContact CG-CG2 4Å; T339-I384 CarbonylContact C-O 3.53Å; T339-I384 WeakPolarHBondContact CA-O 3.46Å; T339-T385 HydrophobicContact CG2-CG2 3.57Å
340	A	85.6	Confident	83.3	Confident	3 Å²	3	40.3 Å²	40.3	3%	0.025	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	151.4	-175.4	0	0	0	0	0	113.7	S315 V316 L349 I384 V405	S315-A340 WeakPolarHBondContact O-CA 3.43Å; S315-A340 WeakPolarHBondContact O-CB 3.5Å; V316-A340 HydrophobicContact CB-CB 3.96Å; V316-A340 HydrophobicContact CG2-CB 4.07Å; A340-L349 HydrophobicContact CB-CD2 3.92Å; A340-I384 PolarHBondContact N-O 3.01Å; A340-I384 PolarHBondContact O-N 2.85Å; A340-V405 HydrophobicContact CB-CB 4.47Å; A340-V405 HydrophobicContact CB-CG2 4.12Å
341	E	82.5	Confident	83.4	Confident	65 Å²	65	38.1 Å²	38.1	30%	0.304	22%	0.216	S	C	.	.			trans	-59.2	145.1	175.2	-74.9	169.6	-133.9	0	0	111.5	S313 S315	S313-E341 VanDerWaalsContact CB-O 3.24Å; S313-E341 WeakPolarHBondContact CB-O 3.01Å; S313-E341 PolarHBondContact OG-O 3.06Å; S315-E341 VanDerWaalsContact CB-OE1 3.3Å; S315-E341 WeakPolarHBondContact CB-OE1 3.4Å; S315-E341 PolarHBondContact O-N 2.81Å; S315-E341 PolarHBondContact OG-OE1 3.37Å
342	P	76.3	Confident	83.6	Confident	50 Å²	50	36.5 Å²	36.5	33%	0.325	20%	0.197	S	C	.	.			trans	-63.3	142.4	174.4	26.8	-34.3	0	0	0	112.1
343	G	74.5	Confident	83.8	Confident	10 Å²	10	36.9 Å²	36.9	10%	0.103	19%	0.194	C	C	.	.			trans	-134	163.2	176.9	0	0	0	0	0	111.8	P345	G343-P345 CarbonylContact C-O 3.6Å; G343-P345 CarbonylContact O-C 3.57Å
344	N	75.9	Confident	83.8	Confident	52 Å²	52	35.5 Å²	35.5	28%	0.278	19%	0.185	S	C	.	.	B	Isolated β-bridge	trans	-123	118.7	176.4	-173	31.3	0	0	0	110.8	V309 Y310 Y311	V309-N344 PolarHBondContact O-ND2 2.8Å; Y310-N344 CarbonylContact C-O 3.56Å; Y310-N344 WeakPolarHBondContact CA-O 3.47Å; Y310-N344 WeakPolarHBondContact CB-O 3.43Å; Y311-N344 HydrophobicContact CD1-CB 3.76Å; Y311-N344 HydrophobicContact CE1-CB 3.46Å; Y311-N344 VanDerWaalsContact CE1-CB 3.46Å; Y311-N344 HydrophobicContact CE2-CB 4.44Å; Y311-N344 HydrophobicContact CG-CB 4.37Å; Y311-N344 PolarHBondContact N-O 3.01Å; Y311-N344 PolarHBondContact O-N 2.8Å; Y311-N344 VanDerWaalsContact O-O 3.12Å
345	P	68.7	Low	83.8	Confident	28 Å²	28	37.6 Å²	37.6	18%	0.182	19%	0.193	C	C	.	.	S	Bend	cis	-67.8	165.8	-3.7	33.4	-37.4	0	0	0	111.7	G343 T408	G343-P345 CarbonylContact C-O 3.6Å; G343-P345 CarbonylContact O-C 3.57Å; P345-T408 VanDerWaalsContact CD-O 3.31Å; P345-T408 WeakPolarHBondContact CD-O 3.15Å; P345-T408 WeakPolarHBondContact CG-O 3.38Å; P345-T408 WeakPolarHBondContact CG-OG1 3.23Å
346	P	75.1	Confident	82.9	Confident	100 Å²	100	40.7 Å²	40.7	65%	0.649	21%	0.206	S	C	*	.	P	Polyproline II helix	trans	-50.8	120.6	-177.5	-30.5	36.8	0	0	0	112.8
347	P	77.7	Confident	81.9	Confident	10 Å²	10	47.5 Å²	47.5	7%	0.065	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-72.2	147.2	-176.3	30.3	-38.8	0	0	0	112.2	I384 V405 T406	P347-I384 VanDerWaalsContact CD-CD1 3.49Å; P347-I384 HydrophobicContact CG-CD1 3.59Å; P347-V405 HydrophobicContact CB-CG2 3.64Å; P347-V405 HydrophobicContact CG-CG2 4.19Å; P347-T406 CarbonylContact C-O 3.39Å; P347-T406 WeakPolarHBondContact CA-O 3.3Å
348	K	83.6	Confident	81.4	Confident	131 Å²	131	46.9 Å²	46.9	57%	0.57	24%	0.24	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.6	121.5	173.4	174.7	176.8	177.6	178.9	0	110.2	T406	K348-T406 PolarHBondContact N-O 2.84Å; K348-T406 PolarHBondContact O-N 2.94Å; K348-T406 PolarHBondContact O-OG1 2.93Å
349	L	87	Confident	80.4	Confident	4 Å²	4	52.4 Å²	52.4	2%	0.021	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	150.2	166.2	-74.7	170.3	0	0	0	110.9	V316 C338 A340 I384 Q386 E404 V405	V316-L349 HydrophobicContact CG2-CD2 3.7Å; C338-L349 HydrophobicContact CB-CD1 4Å; C338-L349 HydrophobicContact CB-CD2 4.1Å; A340-L349 HydrophobicContact CB-CD2 3.92Å; L349-I384 HydrophobicContact CD1-CG2 4.07Å; L349-Q386 HydrophobicContact CB-CB 4.39Å; L349-Q386 HydrophobicContact CD1-CB 3.76Å; L349-E404 CarbonylContact C-O 3.57Å; L349-V405 HydrophobicContact CD2-CB 3.96Å; L349-V405 HydrophobicContact CD2-CG2 4.12Å
350	S	87.9	Confident	79.9	Confident	16 Å²	16	59.5 Å²	59.5	11%	0.112	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	124.5	173.5	-71.5	0	0	0	0	110.2	E404	S350-E404 PolarHBondContact N-O 2.66Å; S350-E404 PolarHBondContact O-N 3.05Å
351	L	89.5	Confident	79.8	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	131.7	173.6	179	61.7	0	0	0	110.1	L318 I336 I364 F388 V390	L318-L351 HydrophobicContact CD1-CD1 4.39Å; I336-L351 HydrophobicContact CB-CD2 4.27Å; I336-L351 HydrophobicContact CD1-CD1 4.11Å; I336-L351 HydrophobicContact CD1-CD2 3.91Å; I336-L351 HydrophobicContact CG1-CD2 4.49Å; I336-L351 HydrophobicContact CG2-CD1 4.08Å; L351-I364 HydrophobicContact CD2-CD1 3.69Å; L351-I364 HydrophobicContact CD2-CG1 4.47Å; L351-I364 HydrophobicContact CG-CD1 3.76Å; L351-I364 HydrophobicContact CG-CG1 4.23Å; L351-I364 PolarHBondContact O-N 2.6Å; L351-F388 HydrophobicContact CB-CD1 3.76Å; L351-F388 HydrophobicContact CB-CD2 3.96Å; L351-F388 HydrophobicContact CB-CE1 3.79Å; L351-F388 HydrophobicContact CB-CE2 3.99Å; L351-F388 HydrophobicContact CB-CG 3.85Å; L351-F388 HydrophobicContact CB-CZ 3.89Å; L351-F388 HydrophobicContact CD2-CB 3.56Å; L351-F388 HydrophobicContact CD2-CD1 4.18Å; L351-F388 HydrophobicContact CD2-CD2 4.3Å; L351-F388 HydrophobicContact CD2-CG 3.79Å; L351-F388 HydrophobicContact CG-CG 4.49Å; L351-V390 HydrophobicContact CD2-CG2 3.77Å
352	L	90	Very high	79.8	Confident	9 Å²	9	60.1 Å²	60.1	5%	0.047	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	143.1	177.2	-70.7	166.7	0	0	0	110.5	A361 T362 V363 F401 F402 E404	L352-A361 HydrophobicContact CB-CB 4.1Å; L352-A361 HydrophobicContact CD1-CB 4.47Å; L352-A361 HydrophobicContact CD2-CB 4.16Å; L352-T362 CarbonylContact C-O 3.5Å; L352-T362 VanDerWaalsContact CA-O 3.32Å; L352-T362 WeakPolarHBondContact CA-O 3.2Å; L352-V363 HydrophobicContact CD2-CB 4.27Å; L352-V363 HydrophobicContact CD2-CG2 3.5Å; L352-V363 VanDerWaalsContact CD2-CG2 3.5Å; L352-F401 WeakPolarHBondContact O-CA 3.45Å; L352-F402 HydrophobicContact CB-CD2 3.56Å; L352-F402 HydrophobicContact CB-CE2 3.26Å; L352-F402 HydrophobicContact CB-CZ 4.21Å; L352-F402 HydrophobicContact CD1-CD2 3.92Å; L352-F402 HydrophobicContact CD1-CE2 3.72Å; L352-F402 HydrophobicContact CG-CD2 4.37Å; L352-F402 HydrophobicContact CG-CE2 4.12Å; L352-F402 PolarHBondContact N-O 2.85Å; L352-F402 PolarHBondContact O-N 2.82Å; L352-F402 VanDerWaalsContact O-N 3.15Å; L352-E404 HydrophobicContact CD1-CB 3.65Å; L352-E404 HydrophobicContact CD1-CG 4.43Å; L352-E404 HydrophobicContact CG-CB 4.4Å
353	R	89.6	Confident	80.1	Confident	54 Å²	54	61.5 Å²	61.5	20%	0.204	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	138	170.5	179.4	179.2	64.7	-179	-2.2	109.7	R355 A361 T362 I364 D396 A399 F401	R353-R355 HydrophobicContact CG-CG 4.36Å; R353-A361 CarbonylContact O-C 3.55Å; R353-A361 VanDerWaalsContact O-CA 3.26Å; R353-A361 WeakPolarHBondContact O-CA 3.37Å; R353-T362 PolarHBondContact N-O 3.36Å; R353-T362 PolarHBondContact O-N 2.92Å; R353-T362 PolarHBondContact O-OG1 2.99Å; R353-I364 HydrophobicContact CB-CD1 3.85Å; R353-I364 HydrophobicContact CB-CG1 3.93Å; R353-D396 VanDerWaalsContact CD-OD1 3.24Å; R353-D396 WeakPolarHBondContact CD-OD1 3.18Å; R353-D396 IonicContact CZ-OD1 3.54Å; R353-D396 IonicContact NE-OD1 3.55Å; R353-D396 IonicContact NH1-OD1 3.41Å; R353-D396 PolarHBondContact NH1-OD1 2.79Å; R353-D396 IonicContact NH1-OD2 3.56Å; R353-A399 HydrophobicContact CG-CB 4.43Å; R353-F401 HydrophobicContact CB-CD1 4.13Å; R353-F401 HydrophobicContact CB-CE1 3.95Å; R353-F401 HydrophobicContact CG-CD1 4.26Å; R353-F401 HydrophobicContact CG-CE1 3.73Å; R353-F401 HydrophobicContact CG-CZ 4.08Å
354	Q	88.4	Confident	80.4	Confident	62 Å²	62	62.2 Å²	62.2	29%	0.29	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	112.2	168.8	179	174.4	3.6	0	0	108.8	E358 A361 A399 S400 F402	Q354-E358 HydrophobicContact CG-CB 4.28Å; Q354-E358 WeakPolarHBondContact CG-O 3.36Å; Q354-E358 PolarHBondContact NE2-O 3.05Å; Q354-A361 HydrophobicContact CB-CB 4.08Å; Q354-A399 CarbonylContact O-C 3.47Å; Q354-A399 VanDerWaalsContact O-CA 3.3Å; Q354-A399 WeakPolarHBondContact O-CA 3.44Å; Q354-S400 PolarHBondContact N-O 3.46Å; Q354-S400 PolarHBondContact O-N 2.81Å; Q354-F402 HydrophobicContact CB-CE1 4.02Å; Q354-F402 HydrophobicContact CB-CZ 3.77Å
355	R	84.2	Confident	79.9	Confident	44 Å²	44	68.8 Å²	68.8	17%	0.166	36%	0.357	C	S	.	.			trans	-76.9	168.8	177.6	-61.7	169.6	163.8	-177	-15.9	111.1	R353 E358 S393 E395 D396 A399	R353-R355 HydrophobicContact CG-CG 4.36Å; R355-E358 HydrophobicContact CB-CB 4.45Å; R355-E358 HydrophobicContact CB-CG 3.92Å; R355-E358 WeakPolarHBondContact CB-OE2 3.38Å; R355-E358 PolarHBondContact N-OE2 2.98Å; R355-E358 WeakPolarHBondContact O-CB 3.44Å; R355-E358 PolarHBondContact O-N 2.8Å; R355-E358 VanDerWaalsContact O-N 3.16Å; R355-S393 PolarHBondContact NH2-OG 3.12Å; R355-E395 VanDerWaalsContact CD-O 3.28Å; R355-E395 WeakPolarHBondContact CD-O 3.15Å; R355-E395 WeakPolarHBondContact CG-O 3.32Å; R355-E395 IonicContact CZ-OE2 2.95Å; R355-E395 PolarHBondContact NE-O 3.16Å; R355-E395 IonicContact NH1-OE2 3.29Å; R355-E395 PolarHBondContact NH1-OE2 2.66Å; R355-E395 VanDerWaalsContact NH2-CB 3.28Å; R355-E395 IonicContact NH2-OE2 2.72Å; R355-E395 PolarHBondContact NH2-OE2 3.35Å; R355-D396 IonicContact CZ-OD1 2.8Å; R355-D396 VanDerWaalsContact CZ-OD1 3.29Å; R355-D396 IonicContact NE-OD1 3.24Å; R355-D396 PolarHBondContact NE-OD1 2.84Å; R355-D396 IonicContact NH2-OD1 2.64Å; R355-D396 PolarHBondContact NH2-OD1 2.69Å; R355-D396 IonicContact NH2-OD2 3.38Å; R355-A399 HydrophobicContact CB-CB 4.44Å; R355-A399 HydrophobicContact CG-CB 4.14Å
356	F	68.8	Low	79.7	Confident	123 Å²	123	69.8 Å²	69.8	54%	0.539	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	139	171.4	-147	-79.4	0	0	0	109.6	E358 S493	F356-E358 PolarHBondContact O-N 2.92Å; F356-E358 VanDerWaalsContact O-N 3.13Å; F356-S493 WeakPolarHBondContact CB-O 3.42Å; F356-S493 WeakPolarHBondContact CD1-O 3.34Å
357	D	68.9	Low	78.8	Confident	143 Å²	143	74.1 Å²	74.1	77%	0.765	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	0.5	-171.5	-147.3	26	0	0	0	116.8	S359	D357-S359 PolarHBondContact O-N 2.98Å
358	E	76.7	Confident	78	Confident	58 Å²	58	76.5 Å²	76.5	27%	0.271	39%	0.385	S	S	.	.			trans	-78.7	112.4	172	-77.5	-176.2	161.5	0	0	112.1	Q354 R355 F356 K360	Q354-E358 HydrophobicContact CG-CB 4.28Å; Q354-E358 WeakPolarHBondContact CG-O 3.36Å; Q354-E358 PolarHBondContact NE2-O 3.05Å; R355-E358 HydrophobicContact CB-CB 4.45Å; R355-E358 HydrophobicContact CB-CG 3.92Å; R355-E358 WeakPolarHBondContact CB-OE2 3.38Å; R355-E358 PolarHBondContact N-OE2 2.98Å; R355-E358 WeakPolarHBondContact O-CB 3.44Å; R355-E358 PolarHBondContact O-N 2.8Å; R355-E358 VanDerWaalsContact O-N 3.16Å; F356-E358 PolarHBondContact O-N 2.92Å; F356-E358 VanDerWaalsContact O-N 3.13Å; E358-K360 PolarHBondContact O-N 3.47Å
359	S	69.6	Low	76.7	Confident	117 Å²	117	75.1 Å²	75.1	82%	0.818	38%	0.379	S	S	*	.	S	Bend	trans	-71.9	-9.8	176.5	63.3	0	0	0	0	115.4	D357	D357-S359 PolarHBondContact O-N 2.98Å
360	K	77.9	Confident	74.9	Confident	171 Å²	171	82.3 Å²	82.3	74%	0.743	41%	0.413	S	S	*	.	S	Bend	trans	-140.5	139.7	178	-69.4	-176.6	-179.9	178.7	0	110	E358	E358-K360 PolarHBondContact O-N 3.47Å
361	A	82.6	Confident	73.1	Confident	30 Å²	30	86.3 Å²	86.3	25%	0.248	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-77.7	140.3	175.2	0	0	0	0	0	111.9	L352 R353 Q354 F402	L352-A361 HydrophobicContact CB-CB 4.1Å; L352-A361 HydrophobicContact CD1-CB 4.47Å; L352-A361 HydrophobicContact CD2-CB 4.16Å; R353-A361 CarbonylContact O-C 3.55Å; R353-A361 VanDerWaalsContact O-CA 3.26Å; R353-A361 WeakPolarHBondContact O-CA 3.37Å; Q354-A361 HydrophobicContact CB-CB 4.08Å; A361-F402 HydrophobicContact CB-CE2 3.63Å; A361-F402 HydrophobicContact CB-CZ 3.57Å
362	T	83.8	Confident	70.7	Confident	51 Å²	51	91.1 Å²	91.1	31%	0.313	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	139.3	176.5	51.1	0	0	0	0	110.8	L352 R353	L352-T362 CarbonylContact C-O 3.5Å; L352-T362 VanDerWaalsContact CA-O 3.32Å; L352-T362 WeakPolarHBondContact CA-O 3.2Å; R353-T362 PolarHBondContact N-O 3.36Å; R353-T362 PolarHBondContact O-N 2.92Å; R353-T362 PolarHBondContact O-OG1 2.99Å
363	V	82.3	Confident	68.3	Low	78 Å²	78	99.1 Å²	99.1	47%	0.473	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	124.1	174.9	178.8	0	0	0	0	109.2	L352 Q365	L352-V363 HydrophobicContact CD2-CB 4.27Å; L352-V363 HydrophobicContact CD2-CG2 3.5Å; L352-V363 VanDerWaalsContact CD2-CG2 3.5Å; V363-Q365 PolarHBondContact O-N 2.69Å
364	I	81	Confident	65.7	Low	25 Å²	25	99.6 Å²	99.6	13%	0.128	52%	0.515	C	S	.	.	P	Polyproline II helix	trans	-77.5	121.4	179.6	-49.5	-172.3	0	0	0	109.7	L351 R353 T366 V390 F401	L351-I364 HydrophobicContact CD2-CD1 3.69Å; L351-I364 HydrophobicContact CD2-CG1 4.47Å; L351-I364 HydrophobicContact CG-CD1 3.76Å; L351-I364 HydrophobicContact CG-CG1 4.23Å; L351-I364 PolarHBondContact O-N 2.6Å; R353-I364 HydrophobicContact CB-CD1 3.85Å; R353-I364 HydrophobicContact CB-CG1 3.93Å; I364-T366 HydrophobicContact CG2-CG2 3.52Å; I364-T366 PolarHBondContact O-N 3.05Å; I364-V390 HydrophobicContact CD1-CG1 4.34Å; I364-V390 HydrophobicContact CD1-CG2 3.9Å; I364-V390 HydrophobicContact CG2-CG2 4.38Å; I364-F401 HydrophobicContact CD1-CD1 3.92Å; I364-F401 HydrophobicContact CD1-CE1 3.82Å
365	Q	65.4	Low	63	Low	190 Å²	190	104.9 Å²	104.9	89%	0.888	55%	0.545	S	S	*	.			trans	-98.1	55.3	177.2	-59.9	-175.2	11	0	0	111.4	V363	V363-Q365 PolarHBondContact O-N 2.69Å
366	T	62.9	Low	60.6	Low	49 Å²	49	106.9 Å²	106.9	30%	0.301	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-90.7	163.5	177.1	46.4	0	0	0	0	112.5	I364 T368 M389	I364-T366 HydrophobicContact CG2-CG2 3.52Å; I364-T366 PolarHBondContact O-N 3.05Å; T366-T368 PolarHBondContact O-N 3.22Å; T366-M389 WeakPolarHBondContact CB-O 3.28Å; T366-M389 VanDerWaalsContact CG2-O 3.24Å; T366-M389 WeakPolarHBondContact CG2-O 3.32Å; T366-M389 PolarHBondContact OG1-O 3.05Å; T366-M389 VanDerWaalsContact OG1-O 3.12Å
367	K	57.5	Low	58.9	Low	192 Å²	192	111.1 Å²	111.1	84%	0.835	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-63.7	117.7	174	-67.9	-177.8	179.5	179.6	0	109.4
368	T	60.6	Low	57.2	Low	59 Å²	59	112.8 Å²	112.8	36%	0.362	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91	136.2	178.2	48.5	0	0	0	0	110.5	T366 H370 Q386 E387 F388	T366-T368 PolarHBondContact O-N 3.22Å; T368-H370 PolarHBondContact O-N 2.86Å; T368-Q386 HydrophobicContact CG2-CG 4.4Å; T368-Q386 VanDerWaalsContact CG2-NE2 3.3Å; T368-E387 WeakPolarHBondContact CA-O 3.38Å; T368-F388 HydrophobicContact CG2-CD1 3.65Å; T368-F388 HydrophobicContact CG2-CE1 3.63Å; T368-F388 HydrophobicContact CG2-CG 4.39Å; T368-F388 HydrophobicContact CG2-CZ 4.35Å
369	K	56.1	Low	55.2	Low	102 Å²	102	117.7 Å²	117.7	44%	0.443	62%	0.617	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.6	107	163.5	-69.2	174.7	-175.2	167	0	106.9	E335 L371 E387	E335-K369 IonicContact OE1-NZ 2.73Å; E335-K369 PolarHBondContact OE1-NZ 2.79Å; K369-L371 PolarHBondContact O-N 3.02Å; K369-E387 HydrophobicContact CB-CB 4.19Å; K369-E387 PolarHBondContact N-O 2.86Å; K369-E387 VanDerWaalsContact N-O 3.12Å
370	H	49.9	Very low	53.9	Low	156 Å²	156	117.7 Å²	117.7	72%	0.722	61%	0.613	S	S	*	*			trans	-79.2	89.7	175.1	-143.2	-51.8	0	0	0	108.6	T368 S372	T368-H370 PolarHBondContact O-N 2.86Å; H370-S372 PolarHBondContact O-N 3.15Å
371	L	48.6	Very low	52.5	Low	99 Å²	99	117.1 Å²	117.1	52%	0.518	61%	0.613	S	S	.	*			trans	-61.1	129.7	176.1	-151	71.7	0	0	0	108.5	K369	K369-L371 PolarHBondContact O-N 3.02Å
372	S	39.3	Very low	51.4	Low	101 Å²	101	123.5 Å²	123.5	71%	0.706	63%	0.634	S	S	*	*			trans	-69.5	135.1	-160.1	54.2	0	0	0	0	113.3	H370 S374	H370-S372 PolarHBondContact O-N 3.15Å; S372-S374 PolarHBondContact O-N 2.94Å
373	Q	41.3	Very low	50.7	Low	178 Å²	178	125.8 Å²	125.8	83%	0.832	65%	0.645	S	S	*	*			trans	-59.5	109.5	157.2	-72	175.7	-31.2	0	0	108.4	N375	Q373-N375 PolarHBondContact O-N 3.37Å
374	S	33.8	Very low	50.4	Low	64 Å²	64	124.6 Å²	124.6	45%	0.448	64%	0.635	S	S	.	*			trans	-74.1	115.7	176.3	55.4	0	0	0	0	109.6	S372 S376	S372-S374 PolarHBondContact O-N 2.94Å; S374-S376 PolarHBondContact O-N 2.84Å
375	N	31.9	Very low	50.4	Low	173 Å²	173	125.8 Å²	125.8	93%	0.925	64%	0.644	S	S	*	*			trans	-65.3	90.2	175.3	-77.2	-20	0	0	0	111	Q373	Q373-N375 PolarHBondContact O-N 3.37Å
376	S	32.9	Very low	51.3	Low	85 Å²	85	118.7 Å²	118.7	59%	0.594	61%	0.611	S	S	*	*			trans	-134.4	121.5	172.2	57	0	0	0	0	110.1	S374 M378	S374-S376 PolarHBondContact O-N 2.84Å; S376-M378 VanDerWaalsContact C-N 3.31Å; S376-M378 PolarHBondContact O-N 2.87Å
377	F	33.2	Very low	52.4	Low	213 Å²	213	117.7 Å²	117.7	93%	0.934	60%	0.603	S	S	*	*	S	Bend	trans	-81.7	64.8	-167.7	-157.6	-92.6	0	0	0	112.6
378	M	33	Very low	53.8	Low	177 Å²	177	108.8 Å²	108.8	87%	0.872	56%	0.564	S	S	*	*			trans	-158.9	126.3	164.9	-95.8	-57	-175.5	0	0	109.4	S376	S376-M378 VanDerWaalsContact C-N 3.31Å; S376-M378 PolarHBondContact O-N 2.87Å
379	N	36.8	Very low	54.9	Low	161 Å²	161	108.9 Å²	108.9	86%	0.861	56%	0.561	S	S	*	*			trans	-96.5	119.4	179.9	-95.3	-20.7	0	0	0	111.6
380	T	41.9	Very low	56.4	Low	118 Å²	118	104.3 Å²	104.3	72%	0.724	54%	0.542	S	S	*	.	S	Bend	trans	-170.2	140.9	139.2	11.1	0	0	0	0	110
381	H	48.1	Very low	58.3	Low	159 Å²	159	101 Å²	101	74%	0.736	53%	0.533	S	S	*	.			trans	44.5	90.1	168.6	-54.2	-68.1	0	0	0	118.3
382	K	58.5	Low	60.2	Low	163 Å²	163	96.4 Å²	96.4	71%	0.709	51%	0.508	S	S	*	.			trans	-139.4	126.5	156.8	-141.7	170.6	-172.8	174.5	0	109.1
383	D	69.7	Low	62.5	Low	100 Å²	100	93.4 Å²	93.4	54%	0.535	49%	0.487	S	S	.	.			trans	-68.2	147.7	-175.9	-67.3	-36.5	0	0	0	111.9	T385	D383-T385 HydrophobicContact CB-CG2 4.5Å; D383-T385 PolarHBondContact O-N 3.36Å
384	I	76.9	Confident	64.6	Low	52 Å²	52	86.3 Å²	86.3	27%	0.267	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	117.5	178.6	-65.5	170.3	0	0	0	107.3	T339 A340 P347 L349	T339-I384 CarbonylContact C-O 3.53Å; T339-I384 WeakPolarHBondContact CA-O 3.46Å; A340-I384 PolarHBondContact N-O 3.01Å; A340-I384 PolarHBondContact O-N 2.85Å; P347-I384 VanDerWaalsContact CD-CD1 3.49Å; P347-I384 HydrophobicContact CG-CD1 3.59Å; L349-I384 HydrophobicContact CD1-CG2 4.07Å
385	T	81.1	Confident	67	Low	51 Å²	51	88.5 Å²	88.5	31%	0.313	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	140.7	-175.5	64.6	0	0	0	0	110.8	C338 T339 D383	C338-T385 CarbonylContact O-C 3.48Å; C338-T385 WeakPolarHBondContact O-CA 3.47Å; T339-T385 HydrophobicContact CG2-CG2 3.57Å; D383-T385 HydrophobicContact CB-CG2 4.5Å; D383-T385 PolarHBondContact O-N 3.36Å
386	Q	84	Confident	69.6	Low	40 Å²	40	80.3 Å²	80.3	19%	0.187	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	130.5	-177.5	-173.8	172.9	-24.4	0	0	110.9	C338 L349 T368 F388	C338-Q386 PolarHBondContact N-O 3.14Å; C338-Q386 PolarHBondContact O-N 3.49Å; L349-Q386 HydrophobicContact CB-CB 4.39Å; L349-Q386 HydrophobicContact CD1-CB 3.76Å; T368-Q386 HydrophobicContact CG2-CG 4.4Å; T368-Q386 VanDerWaalsContact CG2-NE2 3.3Å; Q386-F388 HydrophobicContact CB-CE2 4.09Å; Q386-F388 HydrophobicContact CG-CD2 4.38Å; Q386-F388 HydrophobicContact CG-CE2 3.72Å; Q386-F388 HydrophobicContact CG-CZ 3.9Å
387	E	85	Confident	72.2	Confident	28 Å²	28	76.6 Å²	76.6	13%	0.131	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.5	-175.9	-74.3	165.3	-173.2	0	0	111.2	I336 K337 T368 K369	I336-E387 WeakPolarHBondContact O-CA 3.06Å; K337-E387 HydrophobicContact CB-CG 4.28Å; K337-E387 HydrophobicContact CG-CG 3.93Å; K337-E387 IonicContact NZ-OE1 2.79Å; K337-E387 PolarHBondContact NZ-OE1 2.89Å; T368-E387 WeakPolarHBondContact CA-O 3.38Å; K369-E387 HydrophobicContact CB-CB 4.19Å; K369-E387 PolarHBondContact N-O 2.86Å; K369-E387 VanDerWaalsContact N-O 3.12Å
388	F	87	Confident	74.6	Confident	6 Å²	6	67.2 Å²	67.2	3%	0.026	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	129.3	-177.4	-61.7	-98.3	0	0	0	109.7	I336 C338 L351 T368 Q386	I336-F388 PolarHBondContact N-O 2.95Å; I336-F388 PolarHBondContact O-N 3.05Å; C338-F388 HydrophobicContact CB-CE2 4.17Å; L351-F388 HydrophobicContact CB-CD1 3.76Å; L351-F388 HydrophobicContact CB-CD2 3.96Å; L351-F388 HydrophobicContact CB-CE1 3.79Å; L351-F388 HydrophobicContact CB-CE2 3.99Å; L351-F388 HydrophobicContact CB-CG 3.85Å; L351-F388 HydrophobicContact CB-CZ 3.89Å; L351-F388 HydrophobicContact CD2-CB 3.56Å; L351-F388 HydrophobicContact CD2-CD1 4.18Å; L351-F388 HydrophobicContact CD2-CD2 4.3Å; L351-F388 HydrophobicContact CD2-CG 3.79Å; L351-F388 HydrophobicContact CG-CG 4.49Å; T368-F388 HydrophobicContact CG2-CD1 3.65Å; T368-F388 HydrophobicContact CG2-CE1 3.63Å; T368-F388 HydrophobicContact CG2-CG 4.39Å; T368-F388 HydrophobicContact CG2-CZ 4.35Å; Q386-F388 HydrophobicContact CB-CE2 4.09Å; Q386-F388 HydrophobicContact CG-CD2 4.38Å; Q386-F388 HydrophobicContact CG-CE2 3.72Å; Q386-F388 HydrophobicContact CG-CZ 3.9Å
389	M	85	Confident	77.1	Confident	60 Å²	60	58.8 Å²	58.8	30%	0.296	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	133.4	169.5	-47.5	-55.2	-68.7	0	0	109.3	I333 E335 T366	I333-M389 HydrophobicContact CG2-CB 4.21Å; I333-M389 HydrophobicContact CG2-CE 3.86Å; E335-M389 HydrophobicContact CB-CE 3.91Å; E335-M389 HydrophobicContact CB-SD 4.08Å; E335-M389 HydrophobicContact CG-CE 4.04Å; E335-M389 HydrophobicContact CG-SD 3.69Å; T366-M389 WeakPolarHBondContact CB-O 3.28Å; T366-M389 VanDerWaalsContact CG2-O 3.24Å; T366-M389 WeakPolarHBondContact CG2-O 3.32Å; T366-M389 PolarHBondContact OG1-O 3.05Å; T366-M389 VanDerWaalsContact OG1-O 3.12Å
390	V	86.8	Confident	79.6	Confident	6 Å²	6	51.7 Å²	51.7	4%	0.036	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	119.8	178.6	-175	0	0	0	0	110	L334 L351 I364 F401	L334-V390 PolarHBondContact N-O 2.8Å; L334-V390 PolarHBondContact O-N 3.14Å; L351-V390 HydrophobicContact CD2-CG2 3.77Å; I364-V390 HydrophobicContact CD1-CG1 4.34Å; I364-V390 HydrophobicContact CD1-CG2 3.9Å; I364-V390 HydrophobicContact CG2-CG2 4.38Å; V390-F401 HydrophobicContact CG1-CE1 4.12Å
391	T	89.1	Confident	82	Confident	87 Å²	87	46 Å²	46	53%	0.534	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	122.9	170.4	-53.3	0	0	0	0	109.6
392	L	88.9	Confident	84	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.01	20%	0.203	C	C	.	.			trans	-78.1	131.1	-179	-64.5	174.3	0	0	0	111.8	V328 G331 T332 L334 F401 V424	V328-L392 HydrophobicContact CB-CD1 4.27Å; V328-L392 HydrophobicContact CG1-CD1 3.74Å; G331-L392 PolarHBondContact N-O 2.77Å; T332-L392 PolarHBondContact O-N 2.77Å; L334-L392 HydrophobicContact CB-CD1 4.46Å; L334-L392 HydrophobicContact CB-CG 4.35Å; L334-L392 HydrophobicContact CD2-CD2 4.21Å; L392-F401 HydrophobicContact CD2-CE2 4.02Å; L392-F401 HydrophobicContact CD2-CZ 3.82Å; L392-V424 HydrophobicContact CB-CG2 4.39Å
393	S	88.1	Confident	85.6	Confident	38 Å²	38	30.9 Å²	30.9	27%	0.266	17%	0.169	S	C	.	.			trans	-111	167	177.1	69.8	0	0	0	0	112.9	R355 E395 D396	R355-S393 PolarHBondContact NH2-OG 3.12Å; S393-E395 PolarHBondContact O-N 3.11Å; S393-D396 WeakPolarHBondContact CB-OD2 2.96Å; S393-D396 PolarHBondContact N-OD2 2.81Å; S393-D396 WeakPolarHBondContact O-CA 3.16Å; S393-D396 WeakPolarHBondContact O-CB 3.43Å; S393-D396 PolarHBondContact O-N 2.91Å; S393-D396 PolarHBondContact OG-OD2 2.83Å
394	E	85.3	Confident	86.6	Confident	29 Å²	29	27.4 Å²	27.4	14%	0.136	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-57.8	-28	175.2	-56.8	167	-149.8	0	0	112.9	V330 D396 F426 R429 N494	V330-E394 HydrophobicContact CG2-CG 3.98Å; E394-D396 VanDerWaalsContact C-N 3.29Å; E394-F426 HydrophobicContact CB-CD1 4.29Å; E394-F426 HydrophobicContact CB-CD2 4.19Å; E394-F426 HydrophobicContact CB-CE1 4.33Å; E394-F426 HydrophobicContact CB-CE2 4.22Å; E394-F426 HydrophobicContact CB-CG 4.22Å; E394-F426 HydrophobicContact CB-CZ 4.28Å; E394-F426 HydrophobicContact CG-CB 3.97Å; E394-F426 HydrophobicContact CG-CD1 4.21Å; E394-F426 HydrophobicContact CG-CD2 3.87Å; E394-F426 HydrophobicContact CG-CE2 4.4Å; E394-F426 HydrophobicContact CG-CG 3.77Å; E394-R429 IonicContact OE1-CZ 2.77Å; E394-R429 VanDerWaalsContact OE1-CZ 3.25Å; E394-R429 IonicContact OE1-NE 3.54Å; E394-R429 PolarHBondContact OE1-NE 3.2Å; E394-R429 IonicContact OE1-NH2 3.96Å; E394-R429 PolarHBondContact OE1-NH2 3.36Å; E394-R429 IonicContact OE2-CZ 3.1Å; E394-R429 IonicContact OE2-NE 3.17Å; E394-R429 PolarHBondContact OE2-NE 3.03Å; E394-R429 IonicContact OE2-NH2 2.78Å; E394-R429 PolarHBondContact OE2-NH2 3.33Å; E394-N494 PolarHBondContact O-ND2 3.21Å; E394-N494 VanDerWaalsContact O-ND2 3.08Å
395	E	83.4	Confident	87.1	Confident	110 Å²	110	25 Å²	25	51%	0.514	14%	0.137	S	C	.	.	G	3₁₀ helix	trans	-76.9	-15.3	175.5	-59.3	179.4	161	0	0	112.8	R355 S393 N397	R355-E395 VanDerWaalsContact CD-O 3.28Å; R355-E395 WeakPolarHBondContact CD-O 3.15Å; R355-E395 WeakPolarHBondContact CG-O 3.32Å; R355-E395 IonicContact CZ-OE2 2.95Å; R355-E395 PolarHBondContact NE-O 3.16Å; R355-E395 IonicContact NH1-OE2 3.29Å; R355-E395 PolarHBondContact NH1-OE2 2.66Å; R355-E395 VanDerWaalsContact NH2-CB 3.28Å; R355-E395 IonicContact NH2-OE2 2.72Å; R355-E395 PolarHBondContact NH2-OE2 3.35Å; S393-E395 PolarHBondContact O-N 3.11Å; E395-N397 VanDerWaalsContact C-N 3.33Å
396	D	86.5	Confident	87.2	Confident	1 Å²	1	24 Å²	24	1%	0.005	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-93.9	8.8	178.5	-52.4	-47.2	0	0	0	112.3	R353 R355 S393 E394 G398 A399	R353-D396 VanDerWaalsContact CD-OD1 3.24Å; R353-D396 WeakPolarHBondContact CD-OD1 3.18Å; R353-D396 IonicContact CZ-OD1 3.54Å; R353-D396 IonicContact NE-OD1 3.55Å; R353-D396 IonicContact NH1-OD1 3.41Å; R353-D396 PolarHBondContact NH1-OD1 2.79Å; R353-D396 IonicContact NH1-OD2 3.56Å; R355-D396 IonicContact CZ-OD1 2.8Å; R355-D396 VanDerWaalsContact CZ-OD1 3.29Å; R355-D396 IonicContact NE-OD1 3.24Å; R355-D396 PolarHBondContact NE-OD1 2.84Å; R355-D396 IonicContact NH2-OD1 2.64Å; R355-D396 PolarHBondContact NH2-OD1 2.69Å; R355-D396 IonicContact NH2-OD2 3.38Å; S393-D396 WeakPolarHBondContact CB-OD2 2.96Å; S393-D396 PolarHBondContact N-OD2 2.81Å; S393-D396 WeakPolarHBondContact O-CA 3.16Å; S393-D396 WeakPolarHBondContact O-CB 3.43Å; S393-D396 PolarHBondContact O-N 2.91Å; S393-D396 PolarHBondContact OG-OD2 2.83Å; E394-D396 VanDerWaalsContact C-N 3.29Å; D396-G398 PolarHBondContact O-N 2.87Å; D396-A399 HydrophobicContact CB-CB 4.18Å; D396-A399 WeakPolarHBondContact O-CB 3.49Å; D396-A399 PolarHBondContact O-N 3.13Å
397	N	87.3	Confident	87	Confident	8 Å²	8	22.2 Å²	22.2	4%	0.043	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	127.3	174.9	-171.3	41.8	0	0	0	111.6	E395 A399 N423 V424 F426 N459 N494	E395-N397 VanDerWaalsContact C-N 3.33Å; N397-A399 PolarHBondContact O-N 3.08Å; N397-N423 PolarHBondContact OD1-OD1 2.9Å; N397-V424 HydrophobicContact CB-CB 4.18Å; N397-V424 PolarHBondContact OD1-N 2.67Å; N397-V424 PolarHBondContact OD1-O 2.77Å; N397-F426 HydrophobicContact CB-CE1 3.99Å; N397-N459 PolarHBondContact ND2-ND2 3.25Å; N397-N459 PolarHBondContact OD1-ND2 2.94Å; N397-N459 VanDerWaalsContact OD1-ND2 3.09Å; N397-N494 WeakPolarHBondContact CB-O 3.43Å; N397-N494 PolarHBondContact ND2-O 2.83Å
398	G	83.8	Confident	86.4	Confident	15 Å²	15	25 Å²	25	16%	0.155	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.4	6.2	-173.8	0	0	0	0	0	114.3	D396 R421 Y422	D396-G398 PolarHBondContact O-N 2.87Å; G398-R421 WeakPolarHBondContact O-CD 3.42Å; G398-R421 WeakPolarHBondContact O-CG 3.31Å; G398-R421 PolarHBondContact O-NE 2.79Å; G398-Y422 WeakPolarHBondContact CA-O 3.37Å; G398-Y422 PolarHBondContact N-O 2.95Å
399	A	87	Confident	85.4	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	18%	0.181	C	C	.	.			trans	-69.3	142.5	179.3	0	0	0	0	0	111.6	R353 Q354 R355 D396 N397 F401 R421 Y422	R353-A399 HydrophobicContact CG-CB 4.43Å; Q354-A399 CarbonylContact O-C 3.47Å; Q354-A399 VanDerWaalsContact O-CA 3.3Å; Q354-A399 WeakPolarHBondContact O-CA 3.44Å; R355-A399 HydrophobicContact CB-CB 4.44Å; R355-A399 HydrophobicContact CG-CB 4.14Å; D396-A399 HydrophobicContact CB-CB 4.18Å; D396-A399 WeakPolarHBondContact O-CB 3.49Å; D396-A399 PolarHBondContact O-N 3.13Å; N397-A399 PolarHBondContact O-N 3.08Å; A399-F401 HydrophobicContact CB-CE2 4.16Å; A399-F401 HydrophobicContact CB-CZ 4.5Å; A399-R421 WeakPolarHBondContact O-CA 3.36Å; A399-Y422 PolarHBondContact O-N 3.43Å
400	S	89.1	Confident	84.7	Confident	12 Å²	12	27.9 Å²	27.9	8%	0.084	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	131.9	176.5	-72.5	0	0	0	0	110.9	Q354 F402 V420 R421	Q354-S400 PolarHBondContact N-O 3.46Å; Q354-S400 PolarHBondContact O-N 2.81Å; S400-F402 WeakPolarHBondContact O-CE1 3.29Å; S400-V420 CarbonylContact C-O 3.6Å; S400-V420 WeakPolarHBondContact CA-O 3.37Å; S400-R421 PolarHBondContact OG-NE 2.8Å
401	F	90.9	Very high	83.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	138.4	179.1	-63.1	-92.6	0	0	0	110.2	I336 L352 R353 I364 V390 L392 A399 S419 V420 Y422	I336-F401 HydrophobicContact CD1-CB 4.11Å; I336-F401 HydrophobicContact CD1-CD1 4.17Å; I336-F401 HydrophobicContact CD1-CG 4.21Å; L352-F401 WeakPolarHBondContact O-CA 3.45Å; R353-F401 HydrophobicContact CB-CD1 4.13Å; R353-F401 HydrophobicContact CB-CE1 3.95Å; R353-F401 HydrophobicContact CG-CD1 4.26Å; R353-F401 HydrophobicContact CG-CE1 3.73Å; R353-F401 HydrophobicContact CG-CZ 4.08Å; I364-F401 HydrophobicContact CD1-CD1 3.92Å; I364-F401 HydrophobicContact CD1-CE1 3.82Å; V390-F401 HydrophobicContact CG1-CE1 4.12Å; L392-F401 HydrophobicContact CD2-CE2 4.02Å; L392-F401 HydrophobicContact CD2-CZ 3.82Å; A399-F401 HydrophobicContact CB-CE2 4.16Å; A399-F401 HydrophobicContact CB-CZ 4.5Å; F401-S419 WeakPolarHBondContact O-CA 3.3Å; F401-V420 PolarHBondContact N-O 2.94Å; F401-V420 PolarHBondContact O-N 3Å; F401-Y422 HydrophobicContact CD2-CD2 4.01Å; F401-Y422 HydrophobicContact CE2-CD2 4.19Å
402	F	91.8	Very high	82.1	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.018	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	148.2	-179.4	35	-92	0	0	0	110.5	L318 L352 Q354 A361 S400 R416 S417	L318-F402 VanDerWaalsContact CD1-CA 3.45Å; L352-F402 HydrophobicContact CB-CD2 3.56Å; L352-F402 HydrophobicContact CB-CE2 3.26Å; L352-F402 HydrophobicContact CB-CZ 4.21Å; L352-F402 HydrophobicContact CD1-CD2 3.92Å; L352-F402 HydrophobicContact CD1-CE2 3.72Å; L352-F402 HydrophobicContact CG-CD2 4.37Å; L352-F402 HydrophobicContact CG-CE2 4.12Å; L352-F402 PolarHBondContact N-O 2.85Å; L352-F402 PolarHBondContact O-N 2.82Å; L352-F402 VanDerWaalsContact O-N 3.15Å; Q354-F402 HydrophobicContact CB-CE1 4.02Å; Q354-F402 HydrophobicContact CB-CZ 3.77Å; A361-F402 HydrophobicContact CB-CE2 3.63Å; A361-F402 HydrophobicContact CB-CZ 3.57Å; S400-F402 WeakPolarHBondContact O-CE1 3.29Å; F402-R416 HydrophobicContact CD2-CG 4.25Å; F402-R416 VanDerWaalsContact CD2-CZ 3.41Å; F402-R416 VanDerWaalsContact CD2-NE 3.28Å; F402-S417 WeakPolarHBondContact CA-OG 3.34Å
403	C	91.5	Very high	81.2	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	136.7	175.9	-58	0	0	0	0	109.7	V316 C338 R416 S417	V316-C403 HydrophobicContact CG2-CB 3.6Å; C338-C403 WeakPolarHBondContact CA-SG 3.37Å; C338-C403 HydrophobicContact CB-CB 3.81Å; C338-C403 WeakPolarHBondContact CB-SG 3.5Å; C338-C403 WeakPolarHBondContact SG-CB 3.29Å; C338-C403 CovalentContact SG-SG 2.03Å; C338-C403 PolarHBondContact SG-SG 2.83Å; C403-R416 CarbonylContact O-C 3.52Å; C403-R416 VanDerWaalsContact O-CA 3.27Å; C403-R416 WeakPolarHBondContact O-CA 3.36Å; C403-S417 PolarHBondContact N-OG 2.94Å; C403-S417 PolarHBondContact O-N 3.33Å
404	E	90.3	Very high	80.7	Confident	27 Å²	27	44.7 Å²	44.7	13%	0.126	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	135.1	164.8	-171.2	-175.7	83.1	0	0	109.3	L349 S350 L352 T406 K414 A415	L349-E404 CarbonylContact C-O 3.57Å; S350-E404 PolarHBondContact N-O 2.66Å; S350-E404 PolarHBondContact O-N 3.05Å; L352-E404 HydrophobicContact CD1-CB 3.65Å; L352-E404 HydrophobicContact CD1-CG 4.43Å; L352-E404 HydrophobicContact CG-CB 4.4Å; E404-T406 HydrophobicContact CG-CG2 4.1Å; E404-T406 WeakPolarHBondContact OE1-CG2 3.27Å; E404-K414 IonicContact OE1-NZ 3.5Å; E404-K414 PolarHBondContact OE1-NZ 2.96Å; E404-K414 WeakPolarHBondContact OE2-CD 3.43Å; E404-K414 IonicContact OE2-NZ 2.71Å; E404-K414 PolarHBondContact OE2-NZ 2.88Å; E404-A415 WeakPolarHBondContact CA-O 3.39Å
405	V	87.8	Confident	80.6	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.5	172.8	66.5	0	0	0	0	109.4	V316 A340 P347 L349 K414 A415	V316-V405 HydrophobicContact CB-CB 4.2Å; V316-V405 HydrophobicContact CB-CG1 3.95Å; V316-V405 HydrophobicContact CG1-CB 4.32Å; V316-V405 HydrophobicContact CG1-CG1 3.84Å; A340-V405 HydrophobicContact CB-CB 4.47Å; A340-V405 HydrophobicContact CB-CG2 4.12Å; P347-V405 HydrophobicContact CB-CG2 3.64Å; P347-V405 HydrophobicContact CG-CG2 4.19Å; L349-V405 HydrophobicContact CD2-CB 3.96Å; L349-V405 HydrophobicContact CD2-CG2 4.12Å; V405-K414 WeakPolarHBondContact O-CA 3.48Å; V405-A415 HydrophobicContact CG1-CB 3.68Å; V405-A415 PolarHBondContact N-O 2.87Å; V405-A415 PolarHBondContact O-N 2.9Å; V405-A415 VanDerWaalsContact O-N 3.14Å
406	T	83.8	Confident	80.8	Confident	31 Å²	31	45.1 Å²	45.1	19%	0.19	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	120.7	-173.3	59.8	0	0	0	0	110.7	P347 K348 E404 K414	P347-T406 CarbonylContact C-O 3.39Å; P347-T406 WeakPolarHBondContact CA-O 3.3Å; K348-T406 PolarHBondContact N-O 2.84Å; K348-T406 PolarHBondContact O-N 2.94Å; K348-T406 PolarHBondContact O-OG1 2.93Å; E404-T406 HydrophobicContact CG-CG2 4.1Å; E404-T406 WeakPolarHBondContact OE1-CG2 3.27Å; T406-K414 HydrophobicContact CG2-CG 4.26Å
407	S	79.6	Confident	80.9	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.021	26%	0.262	C	S	.	.			trans	-101	114	-179.6	-40	0	0	0	0	110.2	P312 S313 S413	P312-S407 WeakPolarHBondContact CA-OG 3.34Å; S313-S407 PolarHBondContact N-OG 2.96Å; S407-S413 PolarHBondContact N-O 2.9Å; S407-S413 PolarHBondContact N-OG 3.33Å; S407-S413 WeakPolarHBondContact O-CB 3.41Å; S407-S413 PolarHBondContact O-OG 3.19Å
408	T	70.8	Confident	80.9	Confident	85 Å²	85	52.5 Å²	52.5	52%	0.521	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	152.5	-175.2	48.1	0	0	0	0	112	P345 I410	P345-T408 VanDerWaalsContact CD-O 3.31Å; P345-T408 WeakPolarHBondContact CD-O 3.15Å; P345-T408 WeakPolarHBondContact CG-O 3.38Å; P345-T408 WeakPolarHBondContact CG-OG1 3.23Å; T408-I410 PolarHBondContact O-N 3.41Å; T408-I410 VanDerWaalsContact O-N 3.15Å
409	G	67.3	Low	81.1	Confident	83 Å²	83	55.3 Å²	55.3	86%	0.856	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	-19.9	-179.6	0	0	0	0	0	116.3
410	I	69.8	Low	81.2	Confident	44 Å²	44	56.7 Å²	56.7	23%	0.226	32%	0.324	C	S	.	.	S	Bend	trans	-99.2	127.5	-179.6	-56.4	176.1	0	0	0	110.2	P312 T408 S412 S413	P312-I410 HydrophobicContact CB-CD1 4.16Å; P312-I410 HydrophobicContact CG-CD1 4.49Å; T408-I410 PolarHBondContact O-N 3.41Å; T408-I410 VanDerWaalsContact O-N 3.15Å; I410-S412 PolarHBondContact O-N 3.41Å; I410-S413 PolarHBondContact O-OG 3.25Å; I410-S413 VanDerWaalsContact O-OG 3.13Å
411	K	60.7	Low	81.1	Confident	204 Å²	204	63.2 Å²	63.2	89%	0.887	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	128.3	172.6	-70.1	-178.2	179.1	177.1	0	109.8
412	S	61.4	Low	80.9	Confident	127 Å²	127	63.3 Å²	63.3	89%	0.888	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	43.4	-179.1	-162	0	0	0	0	116.1	I410	I410-S412 PolarHBondContact O-N 3.41Å
413	S	69.8	Low	80.8	Confident	16 Å²	16	65.8 Å²	65.8	11%	0.112	36%	0.36	C	S	.	.			trans	-97.6	32.9	-179.3	59.9	0	0	0	0	115.5	S407 I410	S407-S413 PolarHBondContact N-O 2.9Å; S407-S413 PolarHBondContact N-OG 3.33Å; S407-S413 WeakPolarHBondContact O-CB 3.41Å; S407-S413 PolarHBondContact O-OG 3.19Å; I410-S413 PolarHBondContact O-OG 3.25Å; I410-S413 VanDerWaalsContact O-OG 3.13Å
414	K	77.5	Confident	80.6	Confident	139 Å²	139	65.8 Å²	65.8	60%	0.604	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	126.8	179.5	-70.2	-165.9	166.6	-130.3	0	111.3	E404 V405 T406	E404-K414 IonicContact OE1-NZ 3.5Å; E404-K414 PolarHBondContact OE1-NZ 2.96Å; E404-K414 WeakPolarHBondContact OE2-CD 3.43Å; E404-K414 IonicContact OE2-NZ 2.71Å; E404-K414 PolarHBondContact OE2-NZ 2.88Å; V405-K414 WeakPolarHBondContact O-CA 3.48Å; T406-K414 HydrophobicContact CG2-CG 4.26Å
415	A	83	Confident	80.6	Confident	24 Å²	24	65.5 Å²	65.5	20%	0.198	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	159.8	162.7	0	0	0	0	0	110	E404 V405	E404-A415 WeakPolarHBondContact CA-O 3.39Å; V405-A415 HydrophobicContact CG1-CB 3.68Å; V405-A415 PolarHBondContact N-O 2.87Å; V405-A415 PolarHBondContact O-N 2.9Å; V405-A415 VanDerWaalsContact O-N 3.14Å
416	R	86.7	Confident	80.7	Confident	125 Å²	125	65.5 Å²	65.5	47%	0.472	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	143.4	-168	-173.8	-179.6	177.5	136.7	-24	110.1	F402 C403	F402-R416 HydrophobicContact CD2-CG 4.25Å; F402-R416 VanDerWaalsContact CD2-CZ 3.41Å; F402-R416 VanDerWaalsContact CD2-NE 3.28Å; C403-R416 CarbonylContact O-C 3.52Å; C403-R416 VanDerWaalsContact O-CA 3.27Å; C403-R416 WeakPolarHBondContact O-CA 3.36Å
417	S	90.1	Very high	80.9	Confident	14 Å²	14	66.6 Å²	66.6	10%	0.098	37%	0.369	C	S	.	.			trans	-78.1	168.2	177.9	72.5	0	0	0	0	111.8	V316 F402 C403	V316-S417 WeakPolarHBondContact O-CA 3.49Å; V316-S417 WeakPolarHBondContact O-CB 3.44Å; F402-S417 WeakPolarHBondContact CA-OG 3.34Å; C403-S417 PolarHBondContact N-OG 2.94Å; C403-S417 PolarHBondContact O-N 3.33Å
418	D	86.4	Confident	81.3	Confident	150 Å²	150	66.8 Å²	66.8	80%	0.802	37%	0.37	S	S	*	.			trans	-56.3	158	157.9	-60.9	-59.6	0	0	0	111.2
419	S	87.4	Confident	82.1	Confident	73 Å²	73	69.7 Å²	69.7	51%	0.51	37%	0.371	S	S	.	.			trans	-106.2	121.3	-173.4	63.2	0	0	0	0	112.9	F401	F401-S419 WeakPolarHBondContact O-CA 3.3Å
420	V	89.1	Confident	83.2	Confident	30 Å²	30	66.9 Å²	66.9	18%	0.182	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	134.6	171.2	-175.9	0	0	0	0	109	L318 P324 S400 F401 Y422	L318-V420 HydrophobicContact CD2-CG2 3.81Å; P324-V420 HydrophobicContact CB-CG1 3.89Å; P324-V420 HydrophobicContact CG-CG1 4.13Å; S400-V420 CarbonylContact C-O 3.6Å; S400-V420 WeakPolarHBondContact CA-O 3.37Å; F401-V420 PolarHBondContact N-O 2.94Å; F401-V420 PolarHBondContact O-N 3Å; V420-Y422 HydrophobicContact CB-CE2 4.36Å; V420-Y422 HydrophobicContact CG1-CD2 4.29Å; V420-Y422 HydrophobicContact CG1-CE2 3.53Å
421	R	87.8	Confident	84.2	Confident	149 Å²	149	65.5 Å²	65.5	56%	0.562	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.1	136.9	177.5	-179.7	178.3	-66.9	140.6	5.2	110.1	P324 G398 A399 S400	P324-R421 WeakPolarHBondContact CB-O 3.35Å; G398-R421 WeakPolarHBondContact O-CD 3.42Å; G398-R421 WeakPolarHBondContact O-CG 3.31Å; G398-R421 PolarHBondContact O-NE 2.79Å; A399-R421 WeakPolarHBondContact O-CA 3.36Å; S400-R421 PolarHBondContact OG-NE 2.8Å
422	Y	87.3	Confident	85.7	Confident	1 Å²	1	62 Å²	62	0%	0.004	32%	0.315	C	S	.	.			trans	-111.3	142.6	174.4	-72.2	-80.4	0	0	0	112.4	T320 L322 P324 V328 L334 G398 A399 F401 V420	T320-Y422 VanDerWaalsContact CB-OH 3.32Å; T320-Y422 WeakPolarHBondContact CB-OH 3.16Å; T320-Y422 WeakPolarHBondContact CG2-OH 3.34Å; T320-Y422 PolarHBondContact OG1-OH 2.9Å; L322-Y422 HydrophobicContact CB-CE1 4.19Å; L322-Y422 PolarHBondContact O-OH 3.11Å; P324-Y422 HydrophobicContact CB-CE1 4.39Å; V328-Y422 HydrophobicContact CG2-CD1 3.91Å; V328-Y422 HydrophobicContact CG2-CE1 4.45Å; L334-Y422 HydrophobicContact CD1-CE1 4.2Å; L334-Y422 HydrophobicContact CD1-CE2 3.89Å; L334-Y422 WeakPolarHBondContact CD1-OH 3.27Å; L334-Y422 HydrophobicContact CD2-CD2 3.74Å; L334-Y422 HydrophobicContact CD2-CE2 3.4Å; L334-Y422 HydrophobicContact CG-CE2 4.31Å; G398-Y422 WeakPolarHBondContact CA-O 3.37Å; G398-Y422 PolarHBondContact N-O 2.95Å; A399-Y422 PolarHBondContact O-N 3.43Å; F401-Y422 HydrophobicContact CD2-CD2 4.01Å; F401-Y422 HydrophobicContact CE2-CD2 4.19Å; V420-Y422 HydrophobicContact CB-CE2 4.36Å; V420-Y422 HydrophobicContact CG1-CD2 4.29Å; V420-Y422 HydrophobicContact CG1-CE2 3.53Å
423	N	87.8	Confident	87.3	Confident	57 Å²	57	57 Å²	57	31%	0.305	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	109.4	174.2	-172.8	4.5	0	0	0	107.8	F327 V328 N397 N459	F327-N423 WeakPolarHBondContact CA-O 3.48Å; F327-N423 WeakPolarHBondContact CD1-ND2 3.42Å; F327-N423 WeakPolarHBondContact CE1-ND2 3.46Å; F327-N423 WeakPolarHBondContact CE1-OD1 3.23Å; F327-N423 VanDerWaalsContact CZ-ND2 3.33Å; F327-N423 WeakPolarHBondContact CZ-ND2 3.34Å; V328-N423 PolarHBondContact N-O 2.97Å; N397-N423 PolarHBondContact OD1-OD1 2.9Å; N423-N459 PolarHBondContact OD1-ND2 2.85Å
424	V	89.3	Confident	88.3	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	122.3	-169.3	-175.7	0	0	0	0	109.5	V328 V330 L392 N397 F426 N459	V328-V424 CarbonylContact O-C 3.48Å; V328-V424 VanDerWaalsContact O-CA 3.3Å; V328-V424 WeakPolarHBondContact O-CA 3.31Å; V330-V424 HydrophobicContact CB-CG1 4.1Å; L392-V424 HydrophobicContact CB-CG2 4.39Å; N397-V424 HydrophobicContact CB-CB 4.18Å; N397-V424 PolarHBondContact OD1-N 2.67Å; N397-V424 PolarHBondContact OD1-O 2.77Å; V424-F426 HydrophobicContact CG1-CD1 4.24Å; V424-F426 WeakPolarHBondContact O-CD1 3.44Å; V424-F426 VanDerWaalsContact O-CE1 3.3Å; V424-F426 WeakPolarHBondContact O-CE1 3.45Å; V424-N459 PolarHBondContact O-ND2 2.8Å
425	S	89.3	Confident	88.9	Confident	20 Å²	20	55.6 Å²	55.6	14%	0.14	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	128.6	177.7	175.9	0	0	0	0	111.5	V328 V330 N459	V328-S425 PolarHBondContact O-N 2.88Å; V330-S425 PolarHBondContact N-O 2.97Å; S425-N459 CarbonylContact C-O 3.56Å; S425-N459 VanDerWaalsContact CA-O 3.24Å; S425-N459 WeakPolarHBondContact CA-O 3.23Å; S425-N459 PolarHBondContact OG-O 2.89Å
426	F	89.4	Confident	89.3	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-154.2	138.9	179.3	53.2	-83.9	0	0	0	112.5	V330 E394 N397 V424 N459 A496 F522	V330-F426 HydrophobicContact CB-CB 4.12Å; V330-F426 HydrophobicContact CG1-CB 3.87Å; E394-F426 HydrophobicContact CB-CD1 4.29Å; E394-F426 HydrophobicContact CB-CD2 4.19Å; E394-F426 HydrophobicContact CB-CE1 4.33Å; E394-F426 HydrophobicContact CB-CE2 4.22Å; E394-F426 HydrophobicContact CB-CG 4.22Å; E394-F426 HydrophobicContact CB-CZ 4.28Å; E394-F426 HydrophobicContact CG-CB 3.97Å; E394-F426 HydrophobicContact CG-CD1 4.21Å; E394-F426 HydrophobicContact CG-CD2 3.87Å; E394-F426 HydrophobicContact CG-CE2 4.4Å; E394-F426 HydrophobicContact CG-CG 3.77Å; N397-F426 HydrophobicContact CB-CE1 3.99Å; V424-F426 HydrophobicContact CG1-CD1 4.24Å; V424-F426 WeakPolarHBondContact O-CD1 3.44Å; V424-F426 VanDerWaalsContact O-CE1 3.3Å; V424-F426 WeakPolarHBondContact O-CE1 3.45Å; F426-N459 HydrophobicContact CD1-CB 4.13Å; F426-N459 HydrophobicContact CE1-CB 3.7Å; F426-N459 HydrophobicContact CZ-CB 3.99Å; F426-N459 PolarHBondContact N-O 3.25Å; F426-N459 PolarHBondContact O-N 3.21Å; F426-A496 HydrophobicContact CE2-CB 4Å; F426-A496 HydrophobicContact CZ-CB 3.69Å; F426-F522 WeakPolarHBondContact O-CE2 3.35Å; F426-F522 WeakPolarHBondContact O-CZ 3.23Å
427	P	88.2	Confident	89.3	Confident	54 Å²	54	56.8 Å²	56.8	35%	0.351	29%	0.286	S	S	.	.			trans	-72.7	160.1	171.8	33	-35.7	0	0	0	111.3	F522	P427-F522 HydrophobicContact CB-CB 4.4Å; P427-F522 HydrophobicContact CB-CD1 3.79Å; P427-F522 HydrophobicContact CB-CD2 4.27Å; P427-F522 HydrophobicContact CB-CE1 4.07Å; P427-F522 HydrophobicContact CB-CG 3.9Å; P427-F522 HydrophobicContact CB-CZ 4.42Å
428	P	88.9	Confident	89.2	Confident	7 Å²	7	63.5 Å²	63.5	5%	0.045	32%	0.316	C	S	.	.			trans	-68.2	154.7	167.8	31.6	-32.2	0	0	0	110.1	T453 G457 A462 V520 L529	P428-T453 HydrophobicContact CB-CG2 3.79Å; P428-T453 HydrophobicContact CG-CG2 3.98Å; P428-G457 WeakPolarHBondContact CA-O 3.41Å; P428-A462 HydrophobicContact CG-CB 3.84Å; P428-V520 HydrophobicContact CG-CG1 3.85Å; P428-L529 HydrophobicContact CG-CD1 4.38Å; P428-L529 WeakPolarHBondContact O-CD1 3.31Å
429	R	88.1	Confident	89.1	Confident	147 Å²	147	58.4 Å²	58.4	56%	0.555	30%	0.298	S	S	*	.	S	Bend	trans	-93.1	-33	-175.1	-63.2	173.9	173.6	179.7	-4.4	112.7	E394 D454	E394-R429 IonicContact OE1-CZ 2.77Å; E394-R429 VanDerWaalsContact OE1-CZ 3.25Å; E394-R429 IonicContact OE1-NE 3.54Å; E394-R429 PolarHBondContact OE1-NE 3.2Å; E394-R429 IonicContact OE1-NH2 3.96Å; E394-R429 PolarHBondContact OE1-NH2 3.36Å; E394-R429 IonicContact OE2-CZ 3.1Å; E394-R429 IonicContact OE2-NE 3.17Å; E394-R429 PolarHBondContact OE2-NE 3.03Å; E394-R429 IonicContact OE2-NH2 2.78Å; E394-R429 PolarHBondContact OE2-NH2 3.33Å; R429-D454 WeakPolarHBondContact CA-OD1 3.4Å; R429-D454 PolarHBondContact N-OD1 2.84Å
430	A	88.8	Confident	89.1	Confident	24 Å²	24	58.9 Å²	58.9	20%	0.198	29%	0.294	C	S	.	.			trans	-147.8	163.9	178.8	0	0	0	0	0	112.6	Y432 D454	A430-Y432 HydrophobicContact CB-CE1 4.49Å; A430-Y432 HydrophobicContact CB-CE2 3.94Å; A430-Y432 WeakPolarHBondContact CB-OH 3.39Å; A430-D454 HydrophobicContact CB-CB 4.21Å; A430-D454 PolarHBondContact N-OD1 2.94Å; A430-D454 PolarHBondContact O-N 2.89Å; A430-D454 VanDerWaalsContact O-N 3.07Å
431	V	92.2	Very high	89.2	Confident	14 Å²	14	57.9 Å²	57.9	9%	0.085	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	141	175.2	70.2	0	0	0	0	109.6	C451 Q452 L464 V520 L529	V431-C451 WeakPolarHBondContact CG2-SG 3.29Å; V431-Q452 WeakPolarHBondContact CA-O 3.49Å; V431-L464 HydrophobicContact CG2-CD2 4.3Å; V431-V520 HydrophobicContact CB-CG2 3.66Å; V431-V520 HydrophobicContact CG1-CG2 3.93Å; V431-V520 HydrophobicContact CG2-CG2 3.73Å; V431-L529 HydrophobicContact CG1-CB 3.99Å
432	Y	92.1	Very high	89.2	Confident	130 Å²	130	52.5 Å²	52.5	51%	0.51	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	128.6	-175.3	-52	-83	0	0	0	110.3	A430 C451 Q452 D454	A430-Y432 HydrophobicContact CB-CE1 4.49Å; A430-Y432 HydrophobicContact CB-CE2 3.94Å; A430-Y432 WeakPolarHBondContact CB-OH 3.39Å; Y432-C451 CarbonylContact O-C 3.6Å; Y432-C451 WeakPolarHBondContact O-CA 3.43Å; Y432-Q452 PolarHBondContact N-O 3.28Å; Y432-Q452 PolarHBondContact O-N 3.33Å; Y432-D454 HydrophobicContact CE2-CB 3.94Å
433	V	93.3	Very high	89.2	Confident	24 Å²	24	55.1 Å²	55.1	15%	0.145	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	124.4	167.1	172.9	0	0	0	0	109.9	F449 S450 C451 W466 C518 S531	V433-F449 HydrophobicContact CG1-CB 4.21Å; V433-F449 HydrophobicContact CG1-CD1 4.1Å; V433-S450 WeakPolarHBondContact CA-O 3.33Å; V433-C451 HydrophobicContact CG2-CB 4.04Å; V433-W466 HydrophobicContact CG1-CH2 4.03Å; V433-W466 HydrophobicContact CG1-CZ3 4.38Å; V433-W466 HydrophobicContact CG2-CH2 3.81Å; V433-W466 HydrophobicContact CG2-CZ3 4.02Å; V433-C518 HydrophobicContact CG2-CB 3.56Å; V433-S531 WeakPolarHBondContact CG2-O 3.4Å; V433-S531 PolarHBondContact N-OG 3.28Å
434	Q	91.8	Very high	89.2	Confident	102 Å²	102	57 Å²	57	48%	0.477	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	149.2	172	-67.5	176.3	-28.8	0	0	109	Y436 F449 S450	Q434-Y436 HydrophobicContact CB-CE2 3.91Å; Q434-Y436 PolarHBondContact OE1-OH 2.75Å; Q434-Y436 VanDerWaalsContact OE1-OH 3.04Å; Q434-F449 CarbonylContact O-C 3.54Å; Q434-F449 WeakPolarHBondContact O-CA 3.09Å; Q434-S450 PolarHBondContact N-O 2.74Å; Q434-S450 PolarHBondContact O-N 2.69Å
435	S	90.7	Very high	89.2	Confident	22 Å²	22	59.6 Å²	59.6	15%	0.154	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.6	-176.5	84.8	0	0	0	0	112.5	P437 E438 K447 M448	S435-P437 CarbonylContact C-O 3.59Å; S435-P437 CarbonylContact O-C 3.54Å; S435-P437 VanDerWaalsContact O-C 3.25Å; S435-E438 VanDerWaalsContact O-CG 3.26Å; S435-E438 WeakPolarHBondContact O-CG 3.5Å; S435-E438 PolarHBondContact O-N 2.81Å; S435-K447 VanDerWaalsContact CB-CE 3.45Å; S435-K447 WeakPolarHBondContact OG-CE 3.45Å; S435-K447 PolarHBondContact OG-NZ 3.27Å; S435-M448 CarbonylContact C-O 3.59Å; S435-M448 WeakPolarHBondContact CA-O 3.33Å
436	Y	90.3	Very high	89.2	Confident	100 Å²	100	65.3 Å²	65.3	39%	0.392	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	121.6	-174.9	-60.7	-75.8	0	0	0	110.8	Q434 M448	Q434-Y436 HydrophobicContact CB-CE2 3.91Å; Q434-Y436 PolarHBondContact OE1-OH 2.75Å; Q434-Y436 VanDerWaalsContact OE1-OH 3.04Å; Y436-M448 HydrophobicContact CD2-CE 3.92Å; Y436-M448 HydrophobicContact CG-CE 4.39Å; Y436-M448 PolarHBondContact N-O 3.11Å; Y436-M448 PolarHBondContact O-N 2.73Å
437	P	87.9	Confident	89.2	Confident	74 Å²	74	65.6 Å²	65.6	48%	0.481	35%	0.349	S	S	.	.	S	Bend	cis	-64.1	160.3	-11.7	30.8	-36.5	0	0	0	112.3	S435 K447	S435-P437 CarbonylContact C-O 3.59Å; S435-P437 CarbonylContact O-C 3.54Å; S435-P437 VanDerWaalsContact O-C 3.25Å; P437-K447 VanDerWaalsContact O-CE 3.25Å; P437-K447 WeakPolarHBondContact O-CE 3.24Å
438	E	86.4	Confident	89.4	Confident	156 Å²	156	66.2 Å²	66.2	73%	0.729	35%	0.348	S	S	*	.			trans	-73.8	151.7	172	-68.5	-177.4	170.9	0	0	111.3	S435	S435-E438 VanDerWaalsContact O-CG 3.26Å; S435-E438 WeakPolarHBondContact O-CG 3.5Å; S435-E438 PolarHBondContact O-N 2.81Å
439	G	85	Confident	89.6	Confident	42 Å²	42	65.9 Å²	65.9	43%	0.433	35%	0.346	S	S	.	.	S	Bend	trans	76.1	-151.5	179.6	0	0	0	0	0	115.2	K447	G439-K447 PolarHBondContact O-NZ 3.5Å
440	L	86.9	Confident	89.8	Confident	83 Å²	83	59.3 Å²	59.3	44%	0.435	32%	0.323	S	S	.	.			trans	-62.3	136.7	179.9	-77.9	145.2	0	0	0	112.2	E536 M538	L440-E536 HydrophobicContact CD2-CB 4.4Å; L440-E536 VanDerWaalsContact CD2-CD 3.48Å; L440-E536 HydrophobicContact CD2-CG 3.67Å; L440-E536 HydrophobicContact CG-CG 4.25Å; L440-M538 HydrophobicContact CD2-CB 4.26Å
441	I	91.1	Very high	90	Very high	10 Å²	10	58.2 Å²	58.2	5%	0.051	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	140.4	171.3	-172.7	168.3	0	0	0	111.7	Q446 K447 A507 L535 E536 V537 M538	I441-Q446 WeakPolarHBondContact CD1-O 3.35Å; I441-K447 HydrophobicContact CB-CD 4.44Å; I441-K447 HydrophobicContact CD1-CB 3.68Å; I441-K447 HydrophobicContact CD1-CG 4.48Å; I441-K447 HydrophobicContact CG2-CB 4.28Å; I441-K447 HydrophobicContact CG2-CD 4.04Å; I441-A507 HydrophobicContact CG1-CB 4.47Å; I441-A507 HydrophobicContact CG2-CB 3.71Å; I441-L535 HydrophobicContact CG2-CD1 3.75Å; I441-E536 PolarHBondContact N-O 2.77Å; I441-E536 VanDerWaalsContact N-O 3.12Å; I441-V537 CarbonylContact O-C 3.51Å; I441-V537 WeakPolarHBondContact O-CA 3.43Å; I441-M538 PolarHBondContact O-N 3.06Å
442	A	89.1	Confident	90	Very high	36 Å²	36	60 Å²	60	30%	0.298	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	142.9	175.4	0	0	0	0	0	112.4	S445 M538	A442-S445 VanDerWaalsContact O-CB 3.25Å; A442-S445 WeakPolarHBondContact O-CB 3.34Å; A442-S445 PolarHBondContact O-N 2.73Å; A442-S445 VanDerWaalsContact O-N 3.08Å; A442-S445 PolarHBondContact O-OG 3.1Å; A442-M538 HydrophobicContact CB-CE 3.87Å
443	E	87.4	Confident	90	Very high	56 Å²	56	53.8 Å²	53.8	26%	0.262	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	142	170.9	-176.3	157.5	-124	0	0	112	S445 R509 V537 M538 F539	E443-S445 PolarHBondContact O-N 3.35Å; E443-R509 WeakPolarHBondContact OE1-CB 3.36Å; E443-R509 VanDerWaalsContact OE1-CG 3.28Å; E443-R509 WeakPolarHBondContact OE1-CG 3.47Å; E443-R509 PolarHBondContact OE1-N 2.82Å; E443-R509 IonicContact OE1-NE 3.94Å; E443-R509 PolarHBondContact OE1-NE 2.94Å; E443-R509 VanDerWaalsContact OE1-NE 3.07Å; E443-R509 IonicContact OE2-CZ 2.89Å; E443-R509 IonicContact OE2-NE 3.99Å; E443-R509 PolarHBondContact OE2-NE 3.36Å; E443-R509 VanDerWaalsContact OE2-NE 3.15Å; E443-R509 IonicContact OE2-NH2 2.94Å; E443-R509 PolarHBondContact OE2-NH2 3.17Å; E443-V537 HydrophobicContact CB-CG1 4.13Å; E443-M538 PolarHBondContact N-O 3.17Å; E443-F539 HydrophobicContact CB-CB 4.19Å; E443-F539 WeakPolarHBondContact OE2-CB 3.42Å
444	S	86.5	Confident	89.8	Confident	95 Å²	95	53.3 Å²	53.3	66%	0.664	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	5.6	-171.6	-50.6	0	0	0	0	116.8	L506 A507	S444-L506 WeakPolarHBondContact O-CD1 3.5Å; S444-A507 WeakPolarHBondContact CA-O 3.31Å; S444-A507 PolarHBondContact N-O 2.94Å
445	S	89	Confident	89.5	Confident	55 Å²	55	52.6 Å²	52.6	39%	0.385	30%	0.299	S	S	.	.			trans	-92.3	160.8	169.8	-56.2	0	0	0	0	111.8	A442 E443 A507	A442-S445 VanDerWaalsContact O-CB 3.25Å; A442-S445 WeakPolarHBondContact O-CB 3.34Å; A442-S445 PolarHBondContact O-N 2.73Å; A442-S445 VanDerWaalsContact O-N 3.08Å; A442-S445 PolarHBondContact O-OG 3.1Å; E443-S445 PolarHBondContact O-N 3.35Å; S445-A507 WeakPolarHBondContact O-CB 3.37Å; S445-A507 PolarHBondContact O-N 3.11Å
446	Q	89.4	Confident	89.1	Confident	141 Å²	141	54.6 Å²	54.6	66%	0.659	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.9	128.6	-179.2	-68.1	176.5	-13.2	0	0	111.9	I441 V505 L506	I441-Q446 WeakPolarHBondContact CD1-O 3.35Å; Q446-V505 WeakPolarHBondContact CA-O 3.41Å; Q446-L506 HydrophobicContact CG-CD1 4.14Å
447	K	90.4	Very high	88.9	Confident	6 Å²	6	49.9 Å²	49.9	3%	0.026	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	134.8	170.4	-165.6	165.4	176.5	173.9	0	109.1	S435 P437 G439 I441 F449 V505 F534 L535	S435-K447 VanDerWaalsContact CB-CE 3.45Å; S435-K447 WeakPolarHBondContact OG-CE 3.45Å; S435-K447 PolarHBondContact OG-NZ 3.27Å; P437-K447 VanDerWaalsContact O-CE 3.25Å; P437-K447 WeakPolarHBondContact O-CE 3.24Å; G439-K447 PolarHBondContact O-NZ 3.5Å; I441-K447 HydrophobicContact CB-CD 4.44Å; I441-K447 HydrophobicContact CD1-CB 3.68Å; I441-K447 HydrophobicContact CD1-CG 4.48Å; I441-K447 HydrophobicContact CG2-CB 4.28Å; I441-K447 HydrophobicContact CG2-CD 4.04Å; K447-F449 HydrophobicContact CD-CE2 4.47Å; K447-F449 HydrophobicContact CD-CZ 4.02Å; K447-F449 HydrophobicContact CG-CE2 4.33Å; K447-F449 HydrophobicContact CG-CZ 4.32Å; K447-V505 PolarHBondContact N-O 3.28Å; K447-V505 PolarHBondContact O-N 3.3Å; K447-F534 PolarHBondContact NZ-O 2.7Å; K447-L535 HydrophobicContact CB-CD1 4.31Å; K447-L535 HydrophobicContact CD-CD1 3.89Å
448	M	91.2	Very high	89	Confident	66 Å²	66	46.3 Å²	46.3	33%	0.325	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	119.7	178.6	-177.3	179.2	72.9	0	0	110.3	S435 Y436 N502 L503 T504	S435-M448 CarbonylContact C-O 3.59Å; S435-M448 WeakPolarHBondContact CA-O 3.33Å; Y436-M448 HydrophobicContact CD2-CE 3.92Å; Y436-M448 HydrophobicContact CG-CE 4.39Å; Y436-M448 PolarHBondContact N-O 3.11Å; Y436-M448 PolarHBondContact O-N 2.73Å; M448-N502 HydrophobicContact CG-CB 4.14Å; M448-N502 HydrophobicContact SD-CB 3.96Å; M448-L503 CarbonylContact C-O 3.47Å; M448-L503 WeakPolarHBondContact CA-O 3.39Å; M448-T504 HydrophobicContact CB-CG2 4.39Å; M448-T504 HydrophobicContact CG-CG2 4.18Å
449	F	93.4	Very high	89.1	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	116.5	169.6	-61.2	-86.6	0	0	0	108.7	V433 Q434 K447 W466 N502 L503 V505 F516 L535	V433-F449 HydrophobicContact CG1-CB 4.21Å; V433-F449 HydrophobicContact CG1-CD1 4.1Å; Q434-F449 CarbonylContact O-C 3.54Å; Q434-F449 WeakPolarHBondContact O-CA 3.09Å; K447-F449 HydrophobicContact CD-CE2 4.47Å; K447-F449 HydrophobicContact CD-CZ 4.02Å; K447-F449 HydrophobicContact CG-CE2 4.33Å; K447-F449 HydrophobicContact CG-CZ 4.32Å; F449-W466 HydrophobicContact CB-CH2 3.57Å; F449-W466 HydrophobicContact CB-CZ2 4.23Å; F449-W466 HydrophobicContact CB-CZ3 4.13Å; F449-W466 WeakPolarHBondContact O-CZ2 3.42Å; F449-N502 CarbonylContact O-C 3.59Å; F449-N502 WeakPolarHBondContact O-CA 3.37Å; F449-L503 HydrophobicContact CB-CB 4.48Å; F449-L503 PolarHBondContact N-O 3.31Å; F449-L503 PolarHBondContact O-N 2.86Å; F449-V505 HydrophobicContact CD2-CG2 4.07Å; F449-V505 HydrophobicContact CE2-CG2 4.09Å; F449-F516 HydrophobicContact CD2-CD2 4.13Å; F449-F516 HydrophobicContact CD2-CG 4.46Å; F449-F516 AromaticContact CE2-CD2 3.6Å; F449-F516 HydrophobicContact CE2-CD2 3.6Å; F449-F516 HydrophobicContact CE2-CE2 4.07Å; F449-F516 HydrophobicContact CE2-CG 4.36Å; F449-F516 AromaticContact CZ-CD2 3.9Å; F449-F516 HydrophobicContact CZ-CD2 3.9Å; F449-L535 HydrophobicContact CZ-CB 4.08Å
450	S	93.3	Very high	89.1	Confident	10 Å²	10	39.5 Å²	39.5	7%	0.07	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	114.7	174.4	-166.3	0	0	0	0	108.9	V433 Q434 N502	V433-S450 WeakPolarHBondContact CA-O 3.33Å; Q434-S450 PolarHBondContact N-O 2.74Å; Q434-S450 PolarHBondContact O-N 2.69Å; S450-N502 WeakPolarHBondContact CB-OD1 3.43Å; S450-N502 PolarHBondContact OG-OD1 3.21Å
451	C	93.4	Very high	89.2	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	131.8	171.8	178.9	0	0	0	0	109.4	V431 Y432 V433 L464 W466 R500 S501 C518	V431-C451 WeakPolarHBondContact CG2-SG 3.29Å; Y432-C451 CarbonylContact O-C 3.6Å; Y432-C451 WeakPolarHBondContact O-CA 3.43Å; V433-C451 HydrophobicContact CG2-CB 4.04Å; C451-L464 HydrophobicContact CB-CD1 4.37Å; C451-W466 HydrophobicContact CB-CH2 3.7Å; C451-W466 HydrophobicContact CB-CZ2 3.33Å; C451-R500 CarbonylContact O-C 3.58Å; C451-R500 VanDerWaalsContact O-CA 3.27Å; C451-R500 WeakPolarHBondContact O-CA 3.3Å; C451-R500 WeakPolarHBondContact O-CG 3.4Å; C451-S501 PolarHBondContact N-O 3.16Å; C451-S501 PolarHBondContact O-N 2.79Å; C451-C518 HydrophobicContact CB-CB 3.58Å; C451-C518 WeakPolarHBondContact CB-SG 3.45Å; C451-C518 WeakPolarHBondContact SG-CB 3.14Å; C451-C518 CovalentContact SG-SG 2.02Å; C451-C518 PolarHBondContact SG-SG 2.81Å
452	Q	92.5	Very high	89	Confident	51 Å²	51	37.9 Å²	37.9	24%	0.238	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	141.9	177.5	-155.9	-163.9	-87.8	0	0	111.9	V431 Y432 V498 R500	V431-Q452 WeakPolarHBondContact CA-O 3.49Å; Y432-Q452 PolarHBondContact N-O 3.28Å; Y432-Q452 PolarHBondContact O-N 3.33Å; Q452-V498 HydrophobicContact CG-CG1 3.73Å; Q452-R500 HydrophobicContact CB-CG 4.45Å; Q452-R500 HydrophobicContact CG-CB 4.06Å; Q452-R500 HydrophobicContact CG-CG 4.29Å
453	T	91.2	Very high	89	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	159.8	162.7	45.2	0	0	0	0	111.7	P428 L464 V498 T499	P428-T453 HydrophobicContact CB-CG2 3.79Å; P428-T453 HydrophobicContact CG-CG2 3.98Å; T453-L464 HydrophobicContact CG2-CD2 4.32Å; T453-V498 WeakPolarHBondContact OG1-CA 3.29Å; T453-T499 PolarHBondContact N-O 2.97Å; T453-T499 VanDerWaalsContact N-O 3.07Å; T453-T499 PolarHBondContact OG1-N 2.78Å; T453-T499 PolarHBondContact OG1-O 2.7Å
454	D	88.9	Confident	89.1	Confident	14 Å²	14	38.7 Å²	38.7	8%	0.075	22%	0.221	C	C	.	.			trans	-67.3	167.1	177.1	74.8	-87.7	0	0	0	113.3	R429 A430 Y432 M456 G457 V498	R429-D454 WeakPolarHBondContact CA-OD1 3.4Å; R429-D454 PolarHBondContact N-OD1 2.84Å; A430-D454 HydrophobicContact CB-CB 4.21Å; A430-D454 PolarHBondContact N-OD1 2.94Å; A430-D454 PolarHBondContact O-N 2.89Å; A430-D454 VanDerWaalsContact O-N 3.07Å; Y432-D454 HydrophobicContact CE2-CB 3.94Å; D454-M456 PolarHBondContact O-N 3.08Å; D454-M456 VanDerWaalsContact O-N 3.1Å; D454-M456 WeakPolarHBondContact OD2-CB 3.23Å; D454-M456 WeakPolarHBondContact OD2-CG 3.46Å; D454-M456 PolarHBondContact OD2-N 3.32Å; D454-G457 PolarHBondContact O-N 2.64Å; D454-V498 WeakPolarHBondContact O-CG2 3.45Å
455	S	84.8	Confident	89.2	Confident	87 Å²	87	39.3 Å²	39.3	61%	0.608	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-11.1	-171.3	51.4	0	0	0	0	115.6	G457	S455-G457 VanDerWaalsContact C-N 3.29Å
456	M	82.5	Confident	89.2	Confident	65 Å²	65	37.8 Å²	37.8	32%	0.32	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-19.4	171.4	-50.9	-75.8	65.6	0	0	112	D454 A496	D454-M456 PolarHBondContact O-N 3.08Å; D454-M456 VanDerWaalsContact O-N 3.1Å; D454-M456 WeakPolarHBondContact OD2-CB 3.23Å; D454-M456 WeakPolarHBondContact OD2-CG 3.46Å; D454-M456 PolarHBondContact OD2-N 3.32Å; M456-A496 WeakPolarHBondContact O-CB 3.4Å
457	G	86.1	Confident	89.2	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.182	C	C	.	.			trans	65.7	-152.4	-176	0	0	0	0	0	112.5	P428 D454 S455 V497	P428-G457 WeakPolarHBondContact CA-O 3.41Å; D454-G457 PolarHBondContact O-N 2.64Å; S455-G457 VanDerWaalsContact C-N 3.29Å; G457-V497 CarbonylContact C-O 3.59Å; G457-V497 WeakPolarHBondContact CA-O 3.41Å
458	S	89.5	Confident	89.1	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-151.1	155.6	-179.6	52	0	0	0	0	110.9	P460 A462 V497	S458-P460 CarbonylContact C-O 3.52Å; S458-P460 PolarHBondContact OG-O 2.97Å; S458-A462 PolarHBondContact OG-N 3.37Å; S458-V497 PolarHBondContact N-O 2.86Å; S458-V497 PolarHBondContact O-N 2.89Å; S458-V497 PolarHBondContact OG-O 2.93Å
459	N	89.1	Confident	88.9	Confident	18 Å²	18	31.8 Å²	31.8	10%	0.096	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-142.5	116.7	172.8	-172.3	25.5	0	0	0	109.5	N397 N423 V424 S425 F426 F522	N397-N459 PolarHBondContact ND2-ND2 3.25Å; N397-N459 PolarHBondContact OD1-ND2 2.94Å; N397-N459 VanDerWaalsContact OD1-ND2 3.09Å; N423-N459 PolarHBondContact OD1-ND2 2.85Å; V424-N459 PolarHBondContact O-ND2 2.8Å; S425-N459 CarbonylContact C-O 3.56Å; S425-N459 VanDerWaalsContact CA-O 3.24Å; S425-N459 WeakPolarHBondContact CA-O 3.23Å; S425-N459 PolarHBondContact OG-O 2.89Å; F426-N459 HydrophobicContact CD1-CB 4.13Å; F426-N459 HydrophobicContact CE1-CB 3.7Å; F426-N459 HydrophobicContact CZ-CB 3.99Å; F426-N459 PolarHBondContact N-O 3.25Å; F426-N459 PolarHBondContact O-N 3.21Å; N459-F522 WeakPolarHBondContact O-CZ 3.5Å
460	P	86.1	Confident	88.3	Confident	36 Å²	36	33.7 Å²	33.7	23%	0.234	18%	0.18	C	C	.	.	S	Bend	cis	-62	168	-7.1	29.1	-37.5	0	0	0	113.2	S458 A462 F522	S458-P460 CarbonylContact C-O 3.52Å; S458-P460 PolarHBondContact OG-O 2.97Å; P460-A462 PolarHBondContact O-N 3.01Å; P460-F522 HydrophobicContact CG-CE2 4.24Å; P460-F522 WeakPolarHBondContact O-CE2 3.41Å
461	P	87.4	Confident	87.3	Confident	59 Å²	59	36.7 Å²	36.7	38%	0.383	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-59	123	-179.5	-21.2	32	0	0	0	112.2	F489 V497	P461-F489 HydrophobicContact CB-CD1 4.29Å; P461-F489 HydrophobicContact CB-CE1 4.19Å; P461-V497 HydrophobicContact CB-CB 3.91Å; P461-V497 HydrophobicContact CB-CG1 3.92Å; P461-V497 HydrophobicContact CB-CG2 4.48Å; P461-V497 HydrophobicContact CG-CB 3.8Å; P461-V497 HydrophobicContact CG-CG1 4.12Å; P461-V497 HydrophobicContact CG-CG2 3.83Å
462	A	87.8	Confident	86.5	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.008	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-69.9	143.4	178.4	0	0	0	0	0	112	P428 S458 P460 T499 V520 F522	P428-A462 HydrophobicContact CG-CB 3.84Å; S458-A462 PolarHBondContact OG-N 3.37Å; P460-A462 PolarHBondContact O-N 3.01Å; A462-T499 VanDerWaalsContact O-CB 3.31Å; A462-T499 WeakPolarHBondContact O-CB 3.47Å; A462-T499 WeakPolarHBondContact O-CG2 3.3Å; A462-T499 PolarHBondContact O-OG1 3.04Å; A462-V520 HydrophobicContact CB-CG1 3.7Å; A462-F522 HydrophobicContact CB-CD2 4.41Å
463	I	88.3	Confident	85.7	Confident	92 Å²	92	40.6 Å²	40.6	47%	0.472	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	129.8	-178.9	-59.1	173.1	0	0	0	109	K465 V521	I463-K465 HydrophobicContact CG2-CG 4.24Å; I463-V521 HydrophobicContact CB-CB 4.47Å; I463-V521 PolarHBondContact N-O 2.92Å; I463-V521 PolarHBondContact O-N 2.79Å
464	L	90.4	Very high	85.2	Confident	16 Å²	16	43.1 Å²	43.1	8%	0.084	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	132.4	174	-60	179.3	0	0	0	110.2	V431 C451 T453 T499 V520	V431-L464 HydrophobicContact CG2-CD2 4.3Å; C451-L464 HydrophobicContact CB-CD1 4.37Å; T453-L464 HydrophobicContact CG2-CD2 4.32Å; L464-T499 HydrophobicContact CD1-CG2 3.89Å; L464-T499 HydrophobicContact CG-CG2 3.9Å; L464-V520 HydrophobicContact CD2-CB 4.47Å; L464-V520 HydrophobicContact CD2-CG1 4.43Å; L464-V520 HydrophobicContact CD2-CG2 3.85Å
465	K	88.3	Confident	84.8	Confident	109 Å²	109	47.8 Å²	47.8	47%	0.474	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	123.7	178.8	-63.2	-176.5	-176.7	179.3	0	110.3	I463 S519 V521	I463-K465 HydrophobicContact CG2-CG 4.24Å; K465-S519 PolarHBondContact N-O 2.84Å; K465-S519 PolarHBondContact O-N 3.47Å; K465-S519 PolarHBondContact O-OG 2.87Å; K465-V521 HydrophobicContact CD-CG2 3.91Å; K465-V521 HydrophobicContact CG-CG2 4.48Å
466	W	89.9	Confident	84.5	Confident	23 Å²	23	46 Å²	46	9%	0.087	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	139.7	175.7	-71.4	101.6	0	0	0	111.8	V433 F449 C451 L478 S501 L503 F516 E517 C518	V433-W466 HydrophobicContact CG1-CH2 4.03Å; V433-W466 HydrophobicContact CG1-CZ3 4.38Å; V433-W466 HydrophobicContact CG2-CH2 3.81Å; V433-W466 HydrophobicContact CG2-CZ3 4.02Å; F449-W466 HydrophobicContact CB-CH2 3.57Å; F449-W466 HydrophobicContact CB-CZ2 4.23Å; F449-W466 HydrophobicContact CB-CZ3 4.13Å; F449-W466 WeakPolarHBondContact O-CZ2 3.42Å; C451-W466 HydrophobicContact CB-CH2 3.7Å; C451-W466 HydrophobicContact CB-CZ2 3.33Å; W466-L478 HydrophobicContact CB-CD2 4.25Å; W466-S501 PolarHBondContact NE1-OG 2.98Å; W466-S501 VanDerWaalsContact NE1-OG 3.08Å; W466-L503 HydrophobicContact CB-CD2 4.4Å; W466-L503 HydrophobicContact CD2-CB 3.84Å; W466-L503 HydrophobicContact CD2-CD2 3.83Å; W466-L503 HydrophobicContact CD2-CG 4.39Å; W466-L503 HydrophobicContact CE3-CB 4.4Å; W466-L503 HydrophobicContact CE3-CD2 3.79Å; W466-L503 HydrophobicContact CG-CB 4.17Å; W466-L503 HydrophobicContact CG-CD2 4.13Å; W466-L503 HydrophobicContact CH2-CB 4.39Å; W466-L503 HydrophobicContact CZ2-CB 3.82Å; W466-L503 HydrophobicContact CZ3-CD2 4.3Å; W466-F516 HydrophobicContact CE3-CB 4.23Å; W466-F516 HydrophobicContact CZ3-CB 4.07Å; W466-E517 CarbonylContact C-O 3.2Å; W466-E517 WeakPolarHBondContact CA-O 3.01Å; W466-C518 HydrophobicContact CD2-CB 4.27Å; W466-C518 HydrophobicContact CE3-CB 3.9Å; W466-C518 HydrophobicContact CH2-CB 4Å; W466-C518 HydrophobicContact CZ2-CB 4.35Å; W466-C518 HydrophobicContact CZ3-CB 3.76Å
467	Q	88.7	Confident	83.9	Confident	67 Å²	67	45.5 Å²	45.5	31%	0.313	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	143.4	169.4	-63	-168.7	-22.5	0	0	109.6	E517	Q467-E517 PolarHBondContact N-O 2.03Å; Q467-E517 PolarHBondContact O-N 2.95Å
468	Q	88.5	Confident	83.2	Confident	3 Å²	3	47.5 Å²	47.5	1%	0.014	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	134	169.7	-176.2	-179.1	10	0	0	109.2	I476 L478 L481 F516	Q468-I476 HydrophobicContact CB-CB 4.35Å; Q468-I476 HydrophobicContact CG-CB 4.34Å; Q468-I476 PolarHBondContact O-N 3.11Å; Q468-L478 HydrophobicContact CB-CD1 4.06Å; Q468-L481 VanDerWaalsContact OE1-CD1 3.22Å; Q468-F516 HydrophobicContact CB-CD1 4.28Å; Q468-F516 HydrophobicContact CB-CE1 3.95Å; Q468-F516 HydrophobicContact CG-CD1 4.37Å; Q468-F516 HydrophobicContact CG-CE1 3.76Å; Q468-F516 HydrophobicContact CG-CZ 4.24Å
469	L	86.5	Confident	81.9	Confident	16 Å²	16	55.9 Å²	55.9	8%	0.084	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	146.2	170.2	-52.2	178.1	0	0	0	109.8	A474 I475 R515 E517	L469-A474 CarbonylContact C-O 3.57Å; L469-A474 WeakPolarHBondContact CA-O 3.29Å; L469-I475 HydrophobicContact CD2-CB 4.47Å; L469-I475 HydrophobicContact CD2-CG1 3.78Å; L469-R515 HydrophobicContact CB-CB 4.13Å; L469-R515 HydrophobicContact CB-CG 4.33Å; L469-R515 PolarHBondContact N-O 2.91Å; L469-R515 PolarHBondContact O-N 2.84Å; L469-R515 VanDerWaalsContact O-N 3.11Å; L469-E517 HydrophobicContact CD1-CB 4.13Å; L469-E517 HydrophobicContact CG-CB 4.36Å
470	D	81.1	Confident	80.2	Confident	40 Å²	40	59.7 Å²	59.7	21%	0.214	35%	0.35	C	S	.	.			trans	-76.1	-176.9	165.1	80.6	1.3	0	0	0	112.3	A472 G473 A474 I476 R514	D470-A472 PolarHBondContact O-N 2.83Å; D470-A472 WeakPolarHBondContact OD1-CA 3.39Å; D470-A472 WeakPolarHBondContact OD1-CB 3.45Å; D470-A472 PolarHBondContact OD1-N 2.82Å; D470-G473 PolarHBondContact O-N 3.28Å; D470-G473 PolarHBondContact OD1-N 2.87Å; D470-A474 PolarHBondContact N-O 2.79Å; D470-A474 PolarHBondContact OD1-N 3.39Å; D470-I476 HydrophobicContact CB-CD1 3.88Å; D470-R514 VanDerWaalsContact CB-NH1 3.32Å
471	S	72.5	Confident	78.8	Confident	74 Å²	74	60.5 Å²	60.5	52%	0.517	35%	0.352	S	S	.	.	S	Bend	trans	-69	-23.3	-178.2	-48.7	0	0	0	0	113	G513 R515	S471-G513 PolarHBondContact OG-O 2.93Å; S471-R515 PolarHBondContact O-NH2 3.17Å
472	A	77	Confident	77.3	Confident	95 Å²	95	66.9 Å²	66.9	79%	0.785	37%	0.374	S	S	*	.	S	Bend	trans	-89.1	-15.4	176.4	0	0	0	0	0	113.6	D470	D470-A472 PolarHBondContact O-N 2.83Å; D470-A472 WeakPolarHBondContact OD1-CA 3.39Å; D470-A472 WeakPolarHBondContact OD1-CB 3.45Å; D470-A472 PolarHBondContact OD1-N 2.82Å
473	G	75.5	Confident	76.3	Confident	37 Å²	37	68.5 Å²	68.5	38%	0.381	38%	0.382	S	S	.	.	S	Bend	trans	103	8.9	-179.7	0	0	0	0	0	114.9	D470	D470-G473 PolarHBondContact O-N 3.28Å; D470-G473 PolarHBondContact OD1-N 2.87Å
474	A	80.6	Confident	75.5	Confident	53 Å²	53	66.9 Å²	66.9	44%	0.438	38%	0.378	S	S	.	.			trans	-76.7	140.4	175.3	0	0	0	0	0	111.4	L469 D470	L469-A474 CarbonylContact C-O 3.57Å; L469-A474 WeakPolarHBondContact CA-O 3.29Å; D470-A474 PolarHBondContact N-O 2.79Å; D470-A474 PolarHBondContact OD1-N 3.39Å
475	I	80.7	Confident	74.9	Confident	112 Å²	112	69.6 Å²	69.6	57%	0.574	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	133.1	-177.3	-57.4	171.2	0	0	0	110.4	L469	L469-I475 HydrophobicContact CD2-CB 4.47Å; L469-I475 HydrophobicContact CD2-CG1 3.78Å
476	I	78.7	Confident	74.5	Confident	49 Å²	49	67.3 Å²	67.3	25%	0.251	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	142.8	176.7	-67.7	177.6	0	0	0	109.7	Q468 D470 L478	Q468-I476 HydrophobicContact CB-CB 4.35Å; Q468-I476 HydrophobicContact CG-CB 4.34Å; Q468-I476 PolarHBondContact O-N 3.11Å; D470-I476 HydrophobicContact CB-CD1 3.88Å; I476-L478 PolarHBondContact O-N 3.4Å
477	S	69.4	Low	74.2	Confident	55 Å²	55	69.5 Å²	69.5	39%	0.385	41%	0.407	S	S	.	.			trans	-68.4	124.3	175.2	-174.5	0	0	0	0	111.8	E479 T480	S477-E479 PolarHBondContact O-N 3.5Å; S477-E479 WeakPolarHBondContact OG-CB 3.49Å; S477-E479 VanDerWaalsContact OG-CD 3.28Å; S477-E479 WeakPolarHBondContact OG-CG 3.39Å; S477-E479 PolarHBondContact OG-N 2.94Å; S477-E479 PolarHBondContact OG-OE2 3.34Å; S477-T480 PolarHBondContact O-N 3.3Å; S477-T480 PolarHBondContact O-OG1 3.39Å
478	L	70.5	Confident	73.9	Confident	43 Å²	43	69.2 Å²	69.2	23%	0.225	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-60.8	-22.4	177.1	-149.6	72.6	0	0	0	112.6	W466 Q468 I476 T480 L481 M483 L503 F516	W466-L478 HydrophobicContact CB-CD2 4.25Å; Q468-L478 HydrophobicContact CB-CD1 4.06Å; I476-L478 PolarHBondContact O-N 3.4Å; L478-T480 PolarHBondContact O-N 2.93Å; L478-T480 VanDerWaalsContact O-N 3.17Å; L478-L481 PolarHBondContact O-N 3.46Å; L478-M483 HydrophobicContact CD1-CE 4.36Å; L478-M483 HydrophobicContact CD1-SD 3.44Å; L478-M483 WeakPolarHBondContact CD1-SD 3.43Å; L478-M483 HydrophobicContact CD2-SD 4.49Å; L478-M483 HydrophobicContact CG-SD 3.71Å; L478-L503 HydrophobicContact CD2-CD1 4.33Å; L478-F516 HydrophobicContact CD1-CE1 4.4Å
479	E	63.3	Low	73.8	Confident	175 Å²	175	75.1 Å²	75.1	82%	0.818	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-61	-21.9	-180	-60.6	164.3	138.8	0	0	113.4	S477 L481	S477-E479 PolarHBondContact O-N 3.5Å; S477-E479 WeakPolarHBondContact OG-CB 3.49Å; S477-E479 VanDerWaalsContact OG-CD 3.28Å; S477-E479 WeakPolarHBondContact OG-CG 3.39Å; S477-E479 PolarHBondContact OG-N 2.94Å; S477-E479 PolarHBondContact OG-OE2 3.34Å; E479-L481 PolarHBondContact O-N 3.5Å
480	T	52.7	Low	73.7	Confident	99 Å²	99	77.3 Å²	77.3	61%	0.607	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-73.4	-6.8	-178.5	57.2	0	0	0	0	113.9	S477 L478	S477-T480 PolarHBondContact O-N 3.3Å; S477-T480 PolarHBondContact O-OG1 3.39Å; L478-T480 PolarHBondContact O-N 2.93Å; L478-T480 VanDerWaalsContact O-N 3.17Å
481	L	57.5	Low	73.7	Confident	53 Å²	53	80.6 Å²	80.6	28%	0.277	47%	0.466	S	S	.	.	S	Bend	trans	-134.2	144.8	-168	-62.9	171.3	0	0	0	113.2	Q468 L478 E479 M483 L511	Q468-L481 VanDerWaalsContact OE1-CD1 3.22Å; L478-L481 PolarHBondContact O-N 3.46Å; E479-L481 PolarHBondContact O-N 3.5Å; L481-M483 VanDerWaalsContact C-N 3.3Å; L481-M483 HydrophobicContact CB-CE 3.7Å; L481-M483 HydrophobicContact CB-CG 4.13Å; L481-M483 HydrophobicContact CB-SD 4.18Å; L481-M483 HydrophobicContact CD1-CE 3.38Å; L481-M483 HydrophobicContact CG-CE 4.18Å; L481-M483 PolarHBondContact O-N 3.08Å; L481-L511 HydrophobicContact CD1-CD1 4.03Å; L481-L511 HydrophobicContact CD1-CD2 3.47Å; L481-L511 VanDerWaalsContact CD1-CD2 3.47Å; L481-L511 HydrophobicContact CD1-CG 4.41Å; L481-L511 HydrophobicContact CD2-CD1 4.17Å; L481-L511 HydrophobicContact CD2-CD2 3.9Å; L481-L511 HydrophobicContact CD2-CG 4.49Å; L481-L511 HydrophobicContact CG-CD2 4.36Å
482	K	55.9	Low	74.1	Confident	192 Å²	192	80.4 Å²	80.4	84%	0.835	46%	0.457	S	S	*	.			trans	-74.2	81.8	176	-68.2	-173.1	178.3	-175.9	0	110.5
483	M	66.2	Low	73.8	Confident	36 Å²	36	79.5 Å²	79.5	18%	0.177	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	146.7	177.8	-65.1	174.3	178.1	0	0	110.6	L478 L481 L503 T504 V505 F516	L478-M483 HydrophobicContact CD1-CE 4.36Å; L478-M483 HydrophobicContact CD1-SD 3.44Å; L478-M483 WeakPolarHBondContact CD1-SD 3.43Å; L478-M483 HydrophobicContact CD2-SD 4.49Å; L478-M483 HydrophobicContact CG-SD 3.71Å; L481-M483 VanDerWaalsContact C-N 3.3Å; L481-M483 HydrophobicContact CB-CE 3.7Å; L481-M483 HydrophobicContact CB-CG 4.13Å; L481-M483 HydrophobicContact CB-SD 4.18Å; L481-M483 HydrophobicContact CD1-CE 3.38Å; L481-M483 HydrophobicContact CG-CE 4.18Å; L481-M483 PolarHBondContact O-N 3.08Å; M483-L503 HydrophobicContact CB-CD1 3.89Å; M483-L503 HydrophobicContact CG-CD1 4.29Å; M483-L503 HydrophobicContact SD-CD1 3.97Å; M483-T504 VanDerWaalsContact CA-O 3.23Å; M483-T504 WeakPolarHBondContact CA-O 3.34Å; M483-T504 WeakPolarHBondContact CB-O 3.39Å; M483-T504 WeakPolarHBondContact CG-O 3.42Å; M483-V505 HydrophobicContact CE-CB 4.33Å; M483-V505 HydrophobicContact CE-CG1 3.65Å; M483-V505 HydrophobicContact CE-CG2 3.84Å; M483-V505 HydrophobicContact CG-CG2 4.19Å; M483-V505 HydrophobicContact SD-CG2 4.21Å; M483-F516 HydrophobicContact CE-CE1 3.37Å; M483-F516 HydrophobicContact CE-CZ 3.53Å; M483-F516 HydrophobicContact SD-CE1 4.17Å
484	S	71.3	Confident	73.6	Confident	57 Å²	57	78.9 Å²	78.9	40%	0.399	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136.2	166.7	74.1	0	0	0	0	110.3	L503 T504	S484-L503 CarbonylContact O-C 3.56Å; S484-L503 WeakPolarHBondContact O-CA 3.42Å; S484-T504 PolarHBondContact N-O 2.99Å; S484-T504 PolarHBondContact N-OG1 2.94Å; S484-T504 PolarHBondContact O-N 3.36Å; S484-T504 PolarHBondContact OG-OG1 2.88Å
485	V	79.4	Confident	73.5	Confident	73 Å²	73	78 Å²	78	44%	0.442	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.1	173.6	-178.6	0	0	0	0	108.1	V487 S501 N502 L503	V485-V487 HydrophobicContact CG1-CG2 4.39Å; V485-S501 WeakPolarHBondContact CG1-OG 3.02Å; V485-N502 CarbonylContact C-O 3.48Å; V485-N502 WeakPolarHBondContact CA-O 3.39Å; V485-L503 HydrophobicContact CG2-CD1 3.72Å
486	T	78.9	Confident	73.7	Confident	62 Å²	62	72.6 Å²	72.6	38%	0.38	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	155.6	163.4	83.5	0	0	0	0	109.6	S501 N502	T486-S501 CarbonylContact O-C 3.6Å; T486-S501 WeakPolarHBondContact O-CA 3.43Å; T486-S501 WeakPolarHBondContact O-CB 3.11Å; T486-S501 PolarHBondContact O-OG 2.82Å; T486-N502 PolarHBondContact N-O 3.21Å; T486-N502 PolarHBondContact O-N 2.83Å; T486-N502 PolarHBondContact OG1-ND2 2.82Å
487	V	83.1	Confident	74.1	Confident	69 Å²	69	71.1 Å²	71.1	42%	0.418	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	122.7	175	-177.3	0	0	0	0	107.8	V485 F489 T499 R500	V485-V487 HydrophobicContact CG1-CG2 4.39Å; V487-F489 HydrophobicContact CG1-CE1 4.18Å; V487-F489 HydrophobicContact CG1-CE2 4.02Å; V487-F489 HydrophobicContact CG1-CZ 3.75Å; V487-T499 HydrophobicContact CG1-CG2 3.94Å; V487-R500 CarbonylContact C-O 3.59Å; V487-R500 WeakPolarHBondContact CA-O 3.24Å
488	D	83.2	Confident	75.2	Confident	61 Å²	61	68.6 Å²	68.6	33%	0.326	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	138.7	-179.6	-40	-47.5	0	0	0	108.7	R500 N502	D488-R500 HydrophobicContact CB-CB 4.28Å; D488-R500 PolarHBondContact N-O 3.34Å; D488-R500 PolarHBondContact O-N 3.28Å; D488-N502 PolarHBondContact OD2-ND2 3.16Å
489	F	85.8	Confident	76.2	Confident	127 Å²	127	66.6 Å²	66.6	56%	0.557	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	122	177.9	-63	-74.4	0	0	0	109.9	P461 V487 V497 T499	P461-F489 HydrophobicContact CB-CD1 4.29Å; P461-F489 HydrophobicContact CB-CE1 4.19Å; V487-F489 HydrophobicContact CG1-CE1 4.18Å; V487-F489 HydrophobicContact CG1-CE2 4.02Å; V487-F489 HydrophobicContact CG1-CZ 3.75Å; F489-V497 HydrophobicContact CB-CG1 3.78Å; F489-V497 HydrophobicContact CD1-CG1 3.71Å; F489-V497 HydrophobicContact CG-CG1 4.2Å; F489-T499 HydrophobicContact CD1-CG2 4.03Å; F489-T499 HydrophobicContact CE1-CG2 3.73Å
490	I	84.3	Confident	77.5	Confident	61 Å²	61	62.1 Å²	62.1	31%	0.313	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	105.4	-177.6	-54.5	173.4	0	0	0	108.9	V498	I490-V498 HydrophobicContact CB-CB 4.24Å; I490-V498 PolarHBondContact N-O 2.82Å; I490-V498 PolarHBondContact O-N 2.9Å
491	T	82.2	Confident	79.4	Confident	110 Å²	110	57.4 Å²	57.4	68%	0.675	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72	127.9	176.5	47.8	0	0	0	0	111.3	A496 V497	T491-A496 CarbonylContact C-O 3.52Å; T491-A496 WeakPolarHBondContact CA-O 3.43Å; T491-V497 HydrophobicContact CG2-CG2 4.11Å
492	Q	79.7	Confident	81	Confident	69 Å²	69	55.8 Å²	55.8	32%	0.322	30%	0.304	S	S	.	.			trans	-91.6	170.2	176.6	-61.3	-56.9	-35	0	0	111.9	N494 G495 A496 V498	Q492-N494 WeakPolarHBondContact CB-OD1 3.04Å; Q492-N494 PolarHBondContact O-N 2.88Å; Q492-G495 PolarHBondContact O-N 3.05Å; Q492-A496 HydrophobicContact CB-CB 4.42Å; Q492-A496 PolarHBondContact N-O 2.88Å; Q492-V498 HydrophobicContact CG-CG2 3.73Å
493	S	71.3	Confident	82.7	Confident	77 Å²	77	46.7 Å²	46.7	54%	0.538	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-21	-178.6	52.4	0	0	0	0	114.5	F356 G495	F356-S493 WeakPolarHBondContact CB-O 3.42Å; F356-S493 WeakPolarHBondContact CD1-O 3.34Å; S493-G495 VanDerWaalsContact C-N 3.3Å
494	N	71.9	Confident	83.8	Confident	24 Å²	24	46.4 Å²	46.4	13%	0.128	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	13.3	170.5	68.1	-23.6	0	0	0	113.2	E394 N397 Q492 A496	E394-N494 PolarHBondContact O-ND2 3.21Å; E394-N494 VanDerWaalsContact O-ND2 3.08Å; N397-N494 WeakPolarHBondContact CB-O 3.43Å; N397-N494 PolarHBondContact ND2-O 2.83Å; Q492-N494 WeakPolarHBondContact CB-OD1 3.04Å; Q492-N494 PolarHBondContact O-N 2.88Å; N494-A496 PolarHBondContact O-N 2.86Å; N494-A496 VanDerWaalsContact O-N 3.14Å; N494-A496 WeakPolarHBondContact OD1-CB 3.31Å; N494-A496 PolarHBondContact OD1-N 2.81Å
495	G	76.8	Confident	84.7	Confident	33 Å²	33	43.8 Å²	43.8	34%	0.34	25%	0.246	S	C	.	.	S	Bend	trans	70.3	1.6	-175.9	0	0	0	0	0	115	Q492 S493	Q492-G495 PolarHBondContact O-N 3.05Å; S493-G495 VanDerWaalsContact C-N 3.3Å
496	A	85.3	Confident	85.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.244	C	C	.	.			trans	-66.8	155	172.6	0	0	0	0	0	111.1	F426 M456 T491 Q492 N494	F426-A496 HydrophobicContact CE2-CB 4Å; F426-A496 HydrophobicContact CZ-CB 3.69Å; M456-A496 WeakPolarHBondContact O-CB 3.4Å; T491-A496 CarbonylContact C-O 3.52Å; T491-A496 WeakPolarHBondContact CA-O 3.43Å; Q492-A496 HydrophobicContact CB-CB 4.42Å; Q492-A496 PolarHBondContact N-O 2.88Å; N494-A496 PolarHBondContact O-N 2.86Å; N494-A496 VanDerWaalsContact O-N 3.14Å; N494-A496 WeakPolarHBondContact OD1-CB 3.31Å; N494-A496 PolarHBondContact OD1-N 2.81Å
497	V	88.6	Confident	85.7	Confident	18 Å²	18	41 Å²	41	11%	0.109	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	119.7	176.3	-178.7	0	0	0	0	110.5	G457 S458 P461 F489 T491 T499	G457-V497 CarbonylContact C-O 3.59Å; G457-V497 WeakPolarHBondContact CA-O 3.41Å; S458-V497 PolarHBondContact N-O 2.86Å; S458-V497 PolarHBondContact O-N 2.89Å; S458-V497 PolarHBondContact OG-O 2.93Å; P461-V497 HydrophobicContact CB-CB 3.91Å; P461-V497 HydrophobicContact CB-CG1 3.92Å; P461-V497 HydrophobicContact CB-CG2 4.48Å; P461-V497 HydrophobicContact CG-CB 3.8Å; P461-V497 HydrophobicContact CG-CG1 4.12Å; P461-V497 HydrophobicContact CG-CG2 3.83Å; F489-V497 HydrophobicContact CB-CG1 3.78Å; F489-V497 HydrophobicContact CD1-CG1 3.71Å; F489-V497 HydrophobicContact CG-CG1 4.2Å; T491-V497 HydrophobicContact CG2-CG2 4.11Å; V497-T499 PolarHBondContact O-N 2.92Å
498	V	90.6	Very high	86	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.012	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	102.9	165.5	174	0	0	0	0	107.3	Q452 T453 D454 I490 Q492	Q452-V498 HydrophobicContact CG-CG1 3.73Å; T453-V498 WeakPolarHBondContact OG1-CA 3.29Å; D454-V498 WeakPolarHBondContact O-CG2 3.45Å; I490-V498 HydrophobicContact CB-CB 4.24Å; I490-V498 PolarHBondContact N-O 2.82Å; I490-V498 PolarHBondContact O-N 2.9Å; Q492-V498 HydrophobicContact CG-CG2 3.73Å
499	T	91.8	Very high	86.3	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	133.9	170.5	-48.5	0	0	0	0	109.6	T453 A462 L464 V487 F489 V497	T453-T499 PolarHBondContact N-O 2.97Å; T453-T499 VanDerWaalsContact N-O 3.07Å; T453-T499 PolarHBondContact OG1-N 2.78Å; T453-T499 PolarHBondContact OG1-O 2.7Å; A462-T499 VanDerWaalsContact O-CB 3.31Å; A462-T499 WeakPolarHBondContact O-CB 3.47Å; A462-T499 WeakPolarHBondContact O-CG2 3.3Å; A462-T499 PolarHBondContact O-OG1 3.04Å; L464-T499 HydrophobicContact CD1-CG2 3.89Å; L464-T499 HydrophobicContact CG-CG2 3.9Å; V487-T499 HydrophobicContact CG1-CG2 3.94Å; F489-T499 HydrophobicContact CD1-CG2 4.03Å; F489-T499 HydrophobicContact CE1-CG2 3.73Å; V497-T499 PolarHBondContact O-N 2.92Å
500	R	91.5	Very high	86.4	Confident	80 Å²	80	34.2 Å²	34.2	30%	0.302	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	146.1	167.5	-175.5	-176.7	-72.3	166.3	-4.1	109.3	C451 Q452 V487 D488	C451-R500 CarbonylContact O-C 3.58Å; C451-R500 VanDerWaalsContact O-CA 3.27Å; C451-R500 WeakPolarHBondContact O-CA 3.3Å; C451-R500 WeakPolarHBondContact O-CG 3.4Å; Q452-R500 HydrophobicContact CB-CG 4.45Å; Q452-R500 HydrophobicContact CG-CB 4.06Å; Q452-R500 HydrophobicContact CG-CG 4.29Å; V487-R500 CarbonylContact C-O 3.59Å; V487-R500 WeakPolarHBondContact CA-O 3.24Å; D488-R500 HydrophobicContact CB-CB 4.28Å; D488-R500 PolarHBondContact N-O 3.34Å; D488-R500 PolarHBondContact O-N 3.28Å
501	S	91.8	Very high	86.6	Confident	1 Å²	1	32 Å²	32	1%	0.007	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	132.1	168	178.6	0	0	0	0	110.9	C451 W466 V485 T486	C451-S501 PolarHBondContact N-O 3.16Å; C451-S501 PolarHBondContact O-N 2.79Å; W466-S501 PolarHBondContact NE1-OG 2.98Å; W466-S501 VanDerWaalsContact NE1-OG 3.08Å; V485-S501 WeakPolarHBondContact CG1-OG 3.02Å; T486-S501 CarbonylContact O-C 3.6Å; T486-S501 WeakPolarHBondContact O-CA 3.43Å; T486-S501 WeakPolarHBondContact O-CB 3.11Å; T486-S501 PolarHBondContact O-OG 2.82Å
502	N	91.7	Very high	86.9	Confident	19 Å²	19	27.5 Å²	27.5	10%	0.102	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	118	-179.8	-46.4	-58	0	0	0	109.3	M448 F449 S450 V485 T486 D488	M448-N502 HydrophobicContact CG-CB 4.14Å; M448-N502 HydrophobicContact SD-CB 3.96Å; F449-N502 CarbonylContact O-C 3.59Å; F449-N502 WeakPolarHBondContact O-CA 3.37Å; S450-N502 WeakPolarHBondContact CB-OD1 3.43Å; S450-N502 PolarHBondContact OG-OD1 3.21Å; V485-N502 CarbonylContact C-O 3.48Å; V485-N502 WeakPolarHBondContact CA-O 3.39Å; T486-N502 PolarHBondContact N-O 3.21Å; T486-N502 PolarHBondContact O-N 2.83Å; T486-N502 PolarHBondContact OG1-ND2 2.82Å; D488-N502 PolarHBondContact OD2-ND2 3.16Å
503	L	90.8	Very high	87.2	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	114.4	173.3	174.8	71.1	0	0	0	109.2	M448 F449 W466 L478 M483 S484 V485 V505 F516	M448-L503 CarbonylContact C-O 3.47Å; M448-L503 WeakPolarHBondContact CA-O 3.39Å; F449-L503 HydrophobicContact CB-CB 4.48Å; F449-L503 PolarHBondContact N-O 3.31Å; F449-L503 PolarHBondContact O-N 2.86Å; W466-L503 HydrophobicContact CB-CD2 4.4Å; W466-L503 HydrophobicContact CD2-CB 3.84Å; W466-L503 HydrophobicContact CD2-CD2 3.83Å; W466-L503 HydrophobicContact CD2-CG 4.39Å; W466-L503 HydrophobicContact CE3-CB 4.4Å; W466-L503 HydrophobicContact CE3-CD2 3.79Å; W466-L503 HydrophobicContact CG-CB 4.17Å; W466-L503 HydrophobicContact CG-CD2 4.13Å; W466-L503 HydrophobicContact CH2-CB 4.39Å; W466-L503 HydrophobicContact CZ2-CB 3.82Å; W466-L503 HydrophobicContact CZ3-CD2 4.3Å; L478-L503 HydrophobicContact CD2-CD1 4.33Å; M483-L503 HydrophobicContact CB-CD1 3.89Å; M483-L503 HydrophobicContact CG-CD1 4.29Å; M483-L503 HydrophobicContact SD-CD1 3.97Å; S484-L503 CarbonylContact O-C 3.56Å; S484-L503 WeakPolarHBondContact O-CA 3.42Å; V485-L503 HydrophobicContact CG2-CD1 3.72Å; L503-V505 HydrophobicContact CD2-CG2 4.08Å; L503-V505 HydrophobicContact CG-CG2 3.95Å; L503-F516 HydrophobicContact CD2-CB 4.19Å; L503-F516 HydrophobicContact CD2-CD1 3.61Å; L503-F516 HydrophobicContact CD2-CE1 4.27Å; L503-F516 HydrophobicContact CD2-CG 3.98Å
504	T	90.2	Very high	88.1	Confident	31 Å²	31	25.2 Å²	25.2	19%	0.19	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	137.3	169.3	76.7	0	0	0	0	110.5	M448 M483 S484	M448-T504 HydrophobicContact CB-CG2 4.39Å; M448-T504 HydrophobicContact CG-CG2 4.18Å; M483-T504 VanDerWaalsContact CA-O 3.23Å; M483-T504 WeakPolarHBondContact CA-O 3.34Å; M483-T504 WeakPolarHBondContact CB-O 3.39Å; M483-T504 WeakPolarHBondContact CG-O 3.42Å; S484-T504 PolarHBondContact N-O 2.99Å; S484-T504 PolarHBondContact N-OG1 2.94Å; S484-T504 PolarHBondContact O-N 3.36Å; S484-T504 PolarHBondContact OG-OG1 2.88Å
505	V	89.4	Confident	88.9	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.006	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	126.7	179.8	-173.8	0	0	0	0	109.2	Q446 K447 F449 M483 L503 A507 L511 F516 L535	Q446-V505 WeakPolarHBondContact CA-O 3.41Å; K447-V505 PolarHBondContact N-O 3.28Å; K447-V505 PolarHBondContact O-N 3.3Å; F449-V505 HydrophobicContact CD2-CG2 4.07Å; F449-V505 HydrophobicContact CE2-CG2 4.09Å; M483-V505 HydrophobicContact CE-CB 4.33Å; M483-V505 HydrophobicContact CE-CG1 3.65Å; M483-V505 HydrophobicContact CE-CG2 3.84Å; M483-V505 HydrophobicContact CG-CG2 4.19Å; M483-V505 HydrophobicContact SD-CG2 4.21Å; L503-V505 HydrophobicContact CD2-CG2 4.08Å; L503-V505 HydrophobicContact CG-CG2 3.95Å; V505-A507 PolarHBondContact O-N 2.86Å; V505-L511 HydrophobicContact CG1-CD1 3.88Å; V505-F516 HydrophobicContact CG1-CE2 4.44Å; V505-F516 HydrophobicContact CG1-CZ 4.14Å; V505-F516 HydrophobicContact CG2-CE1 4.32Å; V505-F516 HydrophobicContact CG2-CE2 4.2Å; V505-F516 HydrophobicContact CG2-CZ 4.04Å; V505-L535 HydrophobicContact CG1-CD2 3.76Å
506	L	90.1	Very high	89.6	Confident	75 Å²	75	25.7 Å²	25.7	39%	0.393	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	116.3	169.3	-176.3	65.4	0	0	0	109.4	S444 Q446 S508	S444-L506 WeakPolarHBondContact O-CD1 3.5Å; Q446-L506 HydrophobicContact CG-CD1 4.14Å; L506-S508 PolarHBondContact O-N 3.28Å
507	A	89.1	Confident	89.9	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.008	14%	0.143	C	C	.	.			trans	-67.7	129.7	-178.8	0	0	0	0	0	111.3	I441 S444 S445 V505 V537	I441-A507 HydrophobicContact CG1-CB 4.47Å; I441-A507 HydrophobicContact CG2-CB 3.71Å; S444-A507 WeakPolarHBondContact CA-O 3.31Å; S444-A507 PolarHBondContact N-O 2.94Å; S445-A507 WeakPolarHBondContact O-CB 3.37Å; S445-A507 PolarHBondContact O-N 3.11Å; V505-A507 PolarHBondContact O-N 2.86Å; A507-V537 HydrophobicContact CB-CG1 4.11Å; A507-V537 HydrophobicContact CB-CG2 4.07Å
508	S	90.2	Very high	90	Very high	47 Å²	47	25.9 Å²	25.9	33%	0.329	14%	0.138	S	C	.	.			trans	-143.3	148.5	173.4	174.1	0	0	0	0	107.9	L506 A510 L511 N512	L506-S508 PolarHBondContact O-N 3.28Å; S508-A510 PolarHBondContact O-N 2.84Å; S508-A510 VanDerWaalsContact O-N 3.12Å; S508-L511 WeakPolarHBondContact O-CA 3.44Å; S508-L511 WeakPolarHBondContact O-CB 3.43Å; S508-L511 PolarHBondContact O-N 3.02Å; S508-N512 PolarHBondContact O-N 3.27Å
509	R	90.1	Very high	90	Very high	28 Å²	28	26.2 Å²	26.2	11%	0.106	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-51.8	-36.2	177.4	63.2	-173	64	-154.1	3.3	113.2	E443 L511 N512 F539 S540 N542 F619	E443-R509 WeakPolarHBondContact OE1-CB 3.36Å; E443-R509 VanDerWaalsContact OE1-CG 3.28Å; E443-R509 WeakPolarHBondContact OE1-CG 3.47Å; E443-R509 PolarHBondContact OE1-N 2.82Å; E443-R509 IonicContact OE1-NE 3.94Å; E443-R509 PolarHBondContact OE1-NE 2.94Å; E443-R509 VanDerWaalsContact OE1-NE 3.07Å; E443-R509 IonicContact OE2-CZ 2.89Å; E443-R509 IonicContact OE2-NE 3.99Å; E443-R509 PolarHBondContact OE2-NE 3.36Å; E443-R509 VanDerWaalsContact OE2-NE 3.15Å; E443-R509 IonicContact OE2-NH2 2.94Å; E443-R509 PolarHBondContact OE2-NH2 3.17Å; R509-L511 PolarHBondContact O-N 3.04Å; R509-N512 WeakPolarHBondContact O-CB 3.29Å; R509-N512 PolarHBondContact O-N 3.44Å; R509-F539 HydrophobicContact CB-CB 4.28Å; R509-F539 HydrophobicContact CB-CD1 3.5Å; R509-F539 HydrophobicContact CB-CD2 4.07Å; R509-F539 HydrophobicContact CB-CE1 3.69Å; R509-F539 HydrophobicContact CB-CE2 4.22Å; R509-F539 HydrophobicContact CB-CG 3.71Å; R509-F539 HydrophobicContact CB-CZ 4.04Å; R509-S540 PolarHBondContact NH1-O 3.02Å; R509-S540 PolarHBondContact NH2-O 2.92Å; R509-S540 VanDerWaalsContact NH2-O 3.15Å; R509-N542 VanDerWaalsContact CZ-OD1 3.22Å; R509-N542 PolarHBondContact NH1-OD1 2.87Å; R509-N542 PolarHBondContact NH2-OD1 3.25Å; R509-F619 HydrophobicContact CB-CB 4.36Å; R509-F619 HydrophobicContact CB-CD2 4.22Å; R509-F619 HydrophobicContact CB-CG 4.39Å; R509-F619 HydrophobicContact CG-CD2 3.76Å; R509-F619 HydrophobicContact CG-CE2 4.02Å; R509-F619 HydrophobicContact CG-CG 4.19Å; R509-F619 VanDerWaalsContact O-CB 3.26Å; R509-F619 WeakPolarHBondContact O-CB 3.48Å
510	A	86.9	Confident	89.9	Confident	41 Å²	41	26.2 Å²	26.2	34%	0.339	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-62	-13.4	176	0	0	0	0	0	115	S508 R514 F619	S508-A510 PolarHBondContact O-N 2.84Å; S508-A510 VanDerWaalsContact O-N 3.12Å; A510-R514 PolarHBondContact O-NE 2.95Å; A510-R514 PolarHBondContact O-NH2 3.02Å; A510-F619 HydrophobicContact CB-CD1 4.17Å; A510-F619 HydrophobicContact CB-CE1 4.16Å
511	L	88	Confident	89.7	Confident	13 Å²	13	23.7 Å²	23.7	7%	0.068	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-107.8	3.3	175.4	-53.1	-178	0	0	0	114	L481 V505 S508 R509 R514 L535	L481-L511 HydrophobicContact CD1-CD1 4.03Å; L481-L511 HydrophobicContact CD1-CD2 3.47Å; L481-L511 VanDerWaalsContact CD1-CD2 3.47Å; L481-L511 HydrophobicContact CD1-CG 4.41Å; L481-L511 HydrophobicContact CD2-CD1 4.17Å; L481-L511 HydrophobicContact CD2-CD2 3.9Å; L481-L511 HydrophobicContact CD2-CG 4.49Å; L481-L511 HydrophobicContact CG-CD2 4.36Å; V505-L511 HydrophobicContact CG1-CD1 3.88Å; S508-L511 WeakPolarHBondContact O-CA 3.44Å; S508-L511 WeakPolarHBondContact O-CB 3.43Å; S508-L511 PolarHBondContact O-N 3.02Å; R509-L511 PolarHBondContact O-N 3.04Å; L511-R514 HydrophobicContact CB-CG 4.17Å; L511-R514 HydrophobicContact CD2-CG 4.27Å; L511-R514 WeakPolarHBondContact O-CB 3.33Å; L511-R514 VanDerWaalsContact O-CG 3.26Å; L511-R514 WeakPolarHBondContact O-CG 3.43Å; L511-R514 PolarHBondContact O-N 2.89Å; L511-L535 HydrophobicContact CB-CD2 3.7Å; L511-L535 HydrophobicContact CD1-CD2 4.32Å
512	N	89.1	Confident	89.5	Confident	17 Å²	17	24.4 Å²	24.4	9%	0.091	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	134.5	171.5	-172.8	46.9	0	0	0	110.2	S508 R509 R514 V537 F539 F619	S508-N512 PolarHBondContact O-N 3.27Å; R509-N512 WeakPolarHBondContact O-CB 3.29Å; R509-N512 PolarHBondContact O-N 3.44Å; N512-R514 PolarHBondContact O-N 3.16Å; N512-V537 HydrophobicContact CB-CB 4.14Å; N512-V537 HydrophobicContact CB-CG2 4.36Å; N512-V537 PolarHBondContact OD1-N 2.9Å; N512-F539 HydrophobicContact CB-CE1 4.02Å; N512-F619 PolarHBondContact ND2-O 2.89Å
513	G	87	Confident	88.8	Confident	33 Å²	33	29.1 Å²	29.1	34%	0.34	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	15.9	-178.1	0	0	0	0	0	114.7	S471 L535	S471-G513 PolarHBondContact OG-O 2.93Å; G513-L535 PolarHBondContact N-O 2.77Å
514	R	88.4	Confident	87.9	Confident	65 Å²	65	36.5 Å²	36.5	25%	0.245	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	152.4	167.2	-59.1	-65.4	-179.1	174.2	-2	110.3	D470 A510 L511 N512 F516 L535	D470-R514 VanDerWaalsContact CB-NH1 3.32Å; A510-R514 PolarHBondContact O-NE 2.95Å; A510-R514 PolarHBondContact O-NH2 3.02Å; L511-R514 HydrophobicContact CB-CG 4.17Å; L511-R514 HydrophobicContact CD2-CG 4.27Å; L511-R514 WeakPolarHBondContact O-CB 3.33Å; L511-R514 VanDerWaalsContact O-CG 3.26Å; L511-R514 WeakPolarHBondContact O-CG 3.43Å; L511-R514 PolarHBondContact O-N 2.89Å; N512-R514 PolarHBondContact O-N 3.16Å; R514-F516 HydrophobicContact CB-CE2 4.39Å; R514-L535 PolarHBondContact O-N 2.66Å
515	R	89.8	Confident	86.7	Confident	67 Å²	67	37.5 Å²	37.5	25%	0.253	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	146.9	176.7	-22.1	-175.3	-172.1	-160.1	1.1	109.6	L469 S471 E532 G533 F534	L469-R515 HydrophobicContact CB-CB 4.13Å; L469-R515 HydrophobicContact CB-CG 4.33Å; L469-R515 PolarHBondContact N-O 2.91Å; L469-R515 PolarHBondContact O-N 2.84Å; L469-R515 VanDerWaalsContact O-N 3.11Å; S471-R515 PolarHBondContact O-NH2 3.17Å; R515-E532 WeakPolarHBondContact CD-OE2 3.37Å; R515-E532 IonicContact NH1-OE1 3.6Å; R515-E532 IonicContact NH1-OE2 2.72Å; R515-E532 PolarHBondContact NH1-OE2 3.2Å; R515-G533 CarbonylContact C-O 3.58Å; R515-G533 WeakPolarHBondContact CA-O 3.38Å; R515-F534 HydrophobicContact CB-CD1 4.49Å; R515-F534 HydrophobicContact CB-CE1 4.5Å; R515-F534 HydrophobicContact CG-CD1 4.11Å; R515-F534 HydrophobicContact CG-CE1 3.94Å
516	F	91	Very high	85.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	106	177.2	-68.5	-74.6	0	0	0	108.7	F449 W466 Q468 L478 M483 L503 V505 R514 E532 G533 L535	F449-F516 HydrophobicContact CD2-CD2 4.13Å; F449-F516 HydrophobicContact CD2-CG 4.46Å; F449-F516 AromaticContact CE2-CD2 3.6Å; F449-F516 HydrophobicContact CE2-CD2 3.6Å; F449-F516 HydrophobicContact CE2-CE2 4.07Å; F449-F516 HydrophobicContact CE2-CG 4.36Å; F449-F516 AromaticContact CZ-CD2 3.9Å; F449-F516 HydrophobicContact CZ-CD2 3.9Å; W466-F516 HydrophobicContact CE3-CB 4.23Å; W466-F516 HydrophobicContact CZ3-CB 4.07Å; Q468-F516 HydrophobicContact CB-CD1 4.28Å; Q468-F516 HydrophobicContact CB-CE1 3.95Å; Q468-F516 HydrophobicContact CG-CD1 4.37Å; Q468-F516 HydrophobicContact CG-CE1 3.76Å; Q468-F516 HydrophobicContact CG-CZ 4.24Å; L478-F516 HydrophobicContact CD1-CE1 4.4Å; M483-F516 HydrophobicContact CE-CE1 3.37Å; M483-F516 HydrophobicContact CE-CZ 3.53Å; M483-F516 HydrophobicContact SD-CE1 4.17Å; L503-F516 HydrophobicContact CD2-CB 4.19Å; L503-F516 HydrophobicContact CD2-CD1 3.61Å; L503-F516 HydrophobicContact CD2-CE1 4.27Å; L503-F516 HydrophobicContact CD2-CG 3.98Å; V505-F516 HydrophobicContact CG1-CE2 4.44Å; V505-F516 HydrophobicContact CG1-CZ 4.14Å; V505-F516 HydrophobicContact CG2-CE1 4.32Å; V505-F516 HydrophobicContact CG2-CE2 4.2Å; V505-F516 HydrophobicContact CG2-CZ 4.04Å; R514-F516 HydrophobicContact CB-CE2 4.39Å; F516-E532 CarbonylContact O-C 3.6Å; F516-E532 WeakPolarHBondContact O-CA 3.33Å; F516-G533 PolarHBondContact N-O 2.9Å; F516-G533 PolarHBondContact O-N 3.07Å; F516-L535 HydrophobicContact CD2-CB 4.34Å; F516-L535 HydrophobicContact CE2-CB 3.85Å; F516-L535 HydrophobicContact CE2-CD2 3.88Å; F516-L535 HydrophobicContact CZ-CD2 4.46Å
517	E	91.2	Very high	84.1	Confident	22 Å²	22	45.7 Å²	45.7	10%	0.103	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	122.3	178.3	-169	-175.4	-115.5	0	0	108.9	W466 Q467 L469 R530	W466-E517 CarbonylContact C-O 3.2Å; W466-E517 WeakPolarHBondContact CA-O 3.01Å; Q467-E517 PolarHBondContact N-O 2.03Å; Q467-E517 PolarHBondContact O-N 2.95Å; L469-E517 HydrophobicContact CD1-CB 4.13Å; L469-E517 HydrophobicContact CG-CB 4.36Å; E517-R530 VanDerWaalsContact CD-NH1 3.29Å; E517-R530 HydrophobicContact CG-CB 4.17Å; E517-R530 WeakPolarHBondContact OE1-CD 3.36Å; E517-R530 IonicContact OE1-CZ 2.66Å; E517-R530 IonicContact OE1-NE 2.7Å; E517-R530 IonicContact OE1-NH1 3.17Å; E517-R530 PolarHBondContact OE1-NH1 3.35Å; E517-R530 WeakPolarHBondContact OE2-CD 3.36Å; E517-R530 IonicContact OE2-CZ 3.75Å; E517-R530 IonicContact OE2-NE 3.6Å; E517-R530 IonicContact OE2-NH1 3.78Å; E517-R530 PolarHBondContact OE2-NH1 3.2Å
518	C	91.5	Very high	83.1	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	123.8	163.7	-175	0	0	0	0	108.7	V433 C451 W466 R530 S531	V433-C518 HydrophobicContact CG2-CB 3.56Å; C451-C518 HydrophobicContact CB-CB 3.58Å; C451-C518 WeakPolarHBondContact CB-SG 3.45Å; C451-C518 WeakPolarHBondContact SG-CB 3.14Å; C451-C518 CovalentContact SG-SG 2.02Å; C451-C518 PolarHBondContact SG-SG 2.81Å; W466-C518 HydrophobicContact CD2-CB 4.27Å; W466-C518 HydrophobicContact CE3-CB 3.9Å; W466-C518 HydrophobicContact CH2-CB 4Å; W466-C518 HydrophobicContact CZ2-CB 4.35Å; W466-C518 HydrophobicContact CZ3-CB 3.76Å; C518-R530 VanDerWaalsContact O-CA 3.27Å; C518-R530 WeakPolarHBondContact O-CA 3.26Å; C518-S531 PolarHBondContact N-O 2.75Å; C518-S531 PolarHBondContact O-N 2.93Å
519	S	90	Very high	82.9	Confident	8 Å²	8	50.7 Å²	50.7	6%	0.056	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	140.6	176.9	61.6	0	0	0	0	110.7	K465 L529	K465-S519 PolarHBondContact N-O 2.84Å; K465-S519 PolarHBondContact O-N 3.47Å; K465-S519 PolarHBondContact O-OG 2.87Å; S519-L529 WeakPolarHBondContact CA-O 3.43Å
520	V	90	Very high	82.8	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.012	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	142.8	176	-169.2	0	0	0	0	110	P428 V431 A462 L464 T527 L529	P428-V520 HydrophobicContact CG-CG1 3.85Å; V431-V520 HydrophobicContact CB-CG2 3.66Å; V431-V520 HydrophobicContact CG1-CG2 3.93Å; V431-V520 HydrophobicContact CG2-CG2 3.73Å; A462-V520 HydrophobicContact CB-CG1 3.7Å; L464-V520 HydrophobicContact CD2-CB 4.47Å; L464-V520 HydrophobicContact CD2-CG1 4.43Å; L464-V520 HydrophobicContact CD2-CG2 3.85Å; V520-T527 VanDerWaalsContact O-O 3.09Å; V520-L529 HydrophobicContact CB-CB 4.05Å; V520-L529 HydrophobicContact CG2-CB 3.78Å; V520-L529 PolarHBondContact N-O 3.33Å
521	V	87.1	Confident	83	Confident	26 Å²	26	54.9 Å²	54.9	16%	0.158	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	125.9	169.3	-176.8	0	0	0	0	109	I463 K465	I463-V521 HydrophobicContact CB-CB 4.47Å; I463-V521 PolarHBondContact N-O 2.92Å; I463-V521 PolarHBondContact O-N 2.79Å; K465-V521 HydrophobicContact CD-CG2 3.91Å; K465-V521 HydrophobicContact CG-CG2 4.48Å
522	F	86.9	Confident	83.2	Confident	16 Å²	16	58.2 Å²	58.2	7%	0.07	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-122.3	124.8	178.6	177.6	-98.1	0	0	0	110.3	F426 P427 N459 P460 A462 D524 S525 T527	F426-F522 WeakPolarHBondContact O-CE2 3.35Å; F426-F522 WeakPolarHBondContact O-CZ 3.23Å; P427-F522 HydrophobicContact CB-CB 4.4Å; P427-F522 HydrophobicContact CB-CD1 3.79Å; P427-F522 HydrophobicContact CB-CD2 4.27Å; P427-F522 HydrophobicContact CB-CE1 4.07Å; P427-F522 HydrophobicContact CB-CG 3.9Å; P427-F522 HydrophobicContact CB-CZ 4.42Å; N459-F522 WeakPolarHBondContact O-CZ 3.5Å; P460-F522 HydrophobicContact CG-CE2 4.24Å; P460-F522 WeakPolarHBondContact O-CE2 3.41Å; A462-F522 HydrophobicContact CB-CD2 4.41Å; F522-D524 VanDerWaalsContact C-N 3.29Å; F522-D524 PolarHBondContact O-N 3.05Å; F522-S525 WeakPolarHBondContact O-CB 3.01Å; F522-S525 PolarHBondContact O-N 3.4Å; F522-S525 PolarHBondContact O-OG 2.96Å; F522-T527 WeakPolarHBondContact CB-OG1 3.45Å; F522-T527 PolarHBondContact N-OG1 2.85Å
523	N	77.3	Confident	83.2	Confident	118 Å²	118	57.8 Å²	57.8	63%	0.631	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.5	49	174.5	-159.1	63.9	0	0	0	113.8	S525	N523-S525 PolarHBondContact O-N 2.91Å
524	D	71.9	Confident	83.3	Confident	155 Å²	155	61.4 Å²	61.4	83%	0.829	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	17.5	-176.7	-61.7	-36.4	0	0	0	116.7	F522	F522-D524 VanDerWaalsContact C-N 3.29Å; F522-D524 PolarHBondContact O-N 3.05Å
525	S	66.5	Low	83.4	Confident	53 Å²	53	58.3 Å²	58.3	37%	0.371	29%	0.289	S	S	.	.	B	Isolated β-bridge	trans	-99.1	160.8	-179.6	75.8	0	0	0	0	112.8	F522 N523 T527	F522-S525 WeakPolarHBondContact O-CB 3.01Å; F522-S525 PolarHBondContact O-N 3.4Å; F522-S525 PolarHBondContact O-OG 2.96Å; N523-S525 PolarHBondContact O-N 2.91Å; S525-T527 PolarHBondContact O-N 3.49Å
526	K	61.4	Low	83.5	Confident	202 Å²	202	58.9 Å²	58.9	88%	0.878	30%	0.295	S	S	*	.			trans	-77.3	39.3	-175.7	-66.1	-174.1	176.7	179.4	0	114.3	L528	K526-L528 PolarHBondContact O-N 3.25Å
527	T	62.9	Low	83.5	Confident	46 Å²	46	58.9 Å²	58.9	28%	0.282	30%	0.295	S	S	.	.			trans	-75	66.6	175.6	56.9	0	0	0	0	111.7	V520 F522 S525 L529	V520-T527 VanDerWaalsContact O-O 3.09Å; F522-T527 WeakPolarHBondContact CB-OG1 3.45Å; F522-T527 PolarHBondContact N-OG1 2.85Å; S525-T527 PolarHBondContact O-N 3.49Å; T527-L529 PolarHBondContact O-N 3.42Å
528	L	68.8	Low	83.6	Confident	97 Å²	97	59.7 Å²	59.7	51%	0.508	30%	0.299	S	S	.	.			trans	-74.5	62.4	-175.2	-70.9	162.4	0	0	0	112.4	K526 R530	K526-L528 PolarHBondContact O-N 3.25Å; L528-R530 WeakPolarHBondContact O-CG 3.36Å
529	L	85.1	Confident	83.6	Confident	55 Å²	55	59.9 Å²	59.9	29%	0.288	30%	0.3	S	S	.	.			trans	-65.3	132.1	158.3	-72.4	175.4	0	0	0	108.3	P428 V431 S519 V520 T527	P428-L529 HydrophobicContact CG-CD1 4.38Å; P428-L529 WeakPolarHBondContact O-CD1 3.31Å; V431-L529 HydrophobicContact CG1-CB 3.99Å; S519-L529 WeakPolarHBondContact CA-O 3.43Å; V520-L529 HydrophobicContact CB-CB 4.05Å; V520-L529 HydrophobicContact CG2-CB 3.78Å; V520-L529 PolarHBondContact N-O 3.33Å; T527-L529 PolarHBondContact O-N 3.42Å
530	R	88.4	Confident	83.7	Confident	129 Å²	129	61.1 Å²	61.1	49%	0.487	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	151	-178.1	-42.9	-163.1	-164.2	-177.9	0.9	111.9	E517 C518 L528	E517-R530 VanDerWaalsContact CD-NH1 3.29Å; E517-R530 HydrophobicContact CG-CB 4.17Å; E517-R530 WeakPolarHBondContact OE1-CD 3.36Å; E517-R530 IonicContact OE1-CZ 2.66Å; E517-R530 IonicContact OE1-NE 2.7Å; E517-R530 IonicContact OE1-NH1 3.17Å; E517-R530 PolarHBondContact OE1-NH1 3.35Å; E517-R530 WeakPolarHBondContact OE2-CD 3.36Å; E517-R530 IonicContact OE2-CZ 3.75Å; E517-R530 IonicContact OE2-NE 3.6Å; E517-R530 IonicContact OE2-NH1 3.78Å; E517-R530 PolarHBondContact OE2-NH1 3.2Å; C518-R530 VanDerWaalsContact O-CA 3.27Å; C518-R530 WeakPolarHBondContact O-CA 3.26Å; L528-R530 WeakPolarHBondContact O-CG 3.36Å
531	S	91.2	Very high	83.8	Confident	29 Å²	29	61.5 Å²	61.5	20%	0.203	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	135.4	170.8	177.8	0	0	0	0	108.9	V433 C518	V433-S531 WeakPolarHBondContact CG2-O 3.4Å; V433-S531 PolarHBondContact N-OG 3.28Å; C518-S531 PolarHBondContact N-O 2.75Å; C518-S531 PolarHBondContact O-N 2.93Å
532	E	90.9	Very high	83.9	Confident	82 Å²	82	66 Å²	66	38%	0.383	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	147	-179.3	66.4	174.7	166	0	0	112.6	R515 F516 F534	R515-E532 WeakPolarHBondContact CD-OE2 3.37Å; R515-E532 IonicContact NH1-OE1 3.6Å; R515-E532 IonicContact NH1-OE2 2.72Å; R515-E532 PolarHBondContact NH1-OE2 3.2Å; F516-E532 CarbonylContact O-C 3.6Å; F516-E532 WeakPolarHBondContact O-CA 3.33Å; E532-F534 VanDerWaalsContact CD-CZ 3.47Å; E532-F534 HydrophobicContact CG-CE2 3.97Å; E532-F534 HydrophobicContact CG-CZ 4.17Å; E532-F534 WeakPolarHBondContact OE1-CZ 3.3Å
533	G	89.3	Confident	83.9	Confident	8 Å²	8	70.4 Å²	70.4	8%	0.082	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	137.8	170.5	0	0	0	0	0	111.7	R515 F516	R515-G533 CarbonylContact C-O 3.58Å; R515-G533 WeakPolarHBondContact CA-O 3.38Å; F516-G533 PolarHBondContact N-O 2.9Å; F516-G533 PolarHBondContact O-N 3.07Å
534	F	90	Very high	84.6	Confident	109 Å²	109	66.1 Å²	66.1	48%	0.478	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	136.5	-176.5	-63.4	-93.6	0	0	0	112.4	K447 R515 E532	K447-F534 PolarHBondContact NZ-O 2.7Å; R515-F534 HydrophobicContact CB-CD1 4.49Å; R515-F534 HydrophobicContact CB-CE1 4.5Å; R515-F534 HydrophobicContact CG-CD1 4.11Å; R515-F534 HydrophobicContact CG-CE1 3.94Å; E532-F534 VanDerWaalsContact CD-CZ 3.47Å; E532-F534 HydrophobicContact CG-CE2 3.97Å; E532-F534 HydrophobicContact CG-CZ 4.17Å; E532-F534 WeakPolarHBondContact OE1-CZ 3.3Å
535	L	90.4	Very high	85.5	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.005	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	103.7	171.8	179.7	55.5	0	0	0	110.4	I441 K447 F449 V505 L511 G513 R514 F516 V537	I441-L535 HydrophobicContact CG2-CD1 3.75Å; K447-L535 HydrophobicContact CB-CD1 4.31Å; K447-L535 HydrophobicContact CD-CD1 3.89Å; F449-L535 HydrophobicContact CZ-CB 4.08Å; V505-L535 HydrophobicContact CG1-CD2 3.76Å; L511-L535 HydrophobicContact CB-CD2 3.7Å; L511-L535 HydrophobicContact CD1-CD2 4.32Å; G513-L535 PolarHBondContact N-O 2.77Å; R514-L535 PolarHBondContact O-N 2.66Å; F516-L535 HydrophobicContact CD2-CB 4.34Å; F516-L535 HydrophobicContact CE2-CB 3.85Å; F516-L535 HydrophobicContact CE2-CD2 3.88Å; F516-L535 HydrophobicContact CZ-CD2 4.46Å; L535-V537 HydrophobicContact CD1-CG2 3.92Å; L535-V537 HydrophobicContact CD2-CG2 4.38Å; L535-V537 HydrophobicContact CG-CG2 3.8Å
536	E	90.9	Very high	86.7	Confident	78 Å²	78	65.3 Å²	65.3	36%	0.364	32%	0.315	S	S	.	.			trans	-103.8	120.1	173.3	-162.3	-173.3	-179.6	0	0	109.2	L440 I441 H570	L440-E536 HydrophobicContact CD2-CB 4.4Å; L440-E536 VanDerWaalsContact CD2-CD 3.48Å; L440-E536 HydrophobicContact CD2-CG 3.67Å; L440-E536 HydrophobicContact CG-CG 4.25Å; I441-E536 PolarHBondContact N-O 2.77Å; I441-E536 VanDerWaalsContact N-O 3.12Å; E536-H570 IonicContact OE1-CD2 2.97Å; E536-H570 IonicContact OE1-CE1 3.8Å; E536-H570 IonicContact OE1-NE2 2.66Å; E536-H570 PolarHBondContact OE1-NE2 2.8Å
537	V	92.3	Very high	88.2	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	119.9	-171.4	-175.3	0	0	0	0	110	I441 E443 A507 N512 L535 F539 H570	I441-V537 CarbonylContact O-C 3.51Å; I441-V537 WeakPolarHBondContact O-CA 3.43Å; E443-V537 HydrophobicContact CB-CG1 4.13Å; A507-V537 HydrophobicContact CB-CG1 4.11Å; A507-V537 HydrophobicContact CB-CG2 4.07Å; N512-V537 HydrophobicContact CB-CB 4.14Å; N512-V537 HydrophobicContact CB-CG2 4.36Å; N512-V537 PolarHBondContact OD1-N 2.9Å; L535-V537 HydrophobicContact CD1-CG2 3.92Å; L535-V537 HydrophobicContact CD2-CG2 4.38Å; L535-V537 HydrophobicContact CG-CG2 3.8Å; V537-F539 HydrophobicContact CB-CD1 4.45Å; V537-F539 HydrophobicContact CG1-CD1 4.37Å; V537-F539 WeakPolarHBondContact O-CD1 3.44Å; V537-H570 PolarHBondContact O-CD2 3.47Å
538	M	92.4	Very high	89.6	Confident	40 Å²	40	56.9 Å²	56.9	20%	0.197	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	118.2	170.1	179.5	179.9	71.4	0	0	109.8	L440 I441 A442 E443 H570 T649	L440-M538 HydrophobicContact CD2-CB 4.26Å; I441-M538 PolarHBondContact O-N 3.06Å; A442-M538 HydrophobicContact CB-CE 3.87Å; E443-M538 PolarHBondContact N-O 3.17Å; M538-H570 CarbonylContact C-O 3.53Å; M538-H570 VanDerWaalsContact CA-O 3.27Å; M538-H570 WeakPolarHBondContact CA-O 3.47Å; M538-T649 PolarHBondContact SD-OG1 2.93Å
539	F	92.8	Very high	90.5	Very high	3 Å²	3	57.5 Å²	57.5	1%	0.013	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-139.1	134.5	178.5	60.1	-96.9	0	0	0	112	E443 R509 N512 V537 S568 C569 H570 F619 H648	E443-F539 HydrophobicContact CB-CB 4.19Å; E443-F539 WeakPolarHBondContact OE2-CB 3.42Å; R509-F539 HydrophobicContact CB-CB 4.28Å; R509-F539 HydrophobicContact CB-CD1 3.5Å; R509-F539 HydrophobicContact CB-CD2 4.07Å; R509-F539 HydrophobicContact CB-CE1 3.69Å; R509-F539 HydrophobicContact CB-CE2 4.22Å; R509-F539 HydrophobicContact CB-CG 3.71Å; R509-F539 HydrophobicContact CB-CZ 4.04Å; N512-F539 HydrophobicContact CB-CE1 4.02Å; V537-F539 HydrophobicContact CB-CD1 4.45Å; V537-F539 HydrophobicContact CG1-CD1 4.37Å; V537-F539 WeakPolarHBondContact O-CD1 3.44Å; F539-S568 WeakPolarHBondContact CE2-O 3.16Å; F539-C569 WeakPolarHBondContact O-CA 3.32Å; F539-H570 HydrophobicContact CD1-CB 3.95Å; F539-H570 HydrophobicContact CE1-CB 3.61Å; F539-H570 HydrophobicContact CE2-CB 4.4Å; F539-H570 HydrophobicContact CG-CB 4.47Å; F539-H570 HydrophobicContact CZ-CB 3.88Å; F539-H570 PolarHBondContact N-O 2.89Å; F539-H570 PolarHBondContact O-N 3.34Å; F539-F619 HydrophobicContact CZ-CB 4.45Å; F539-H648 VanDerWaalsContact C-CE1 3.47Å; F539-H648 PolarHBondContact O-CE1 3.09Å; F539-H648 PolarHBondContact O-NE2 3.4Å
540	S	92	Very high	90.6	Very high	35 Å²	35	57.4 Å²	57.4	25%	0.245	29%	0.285	C	S	.	.			trans	-77.3	158.8	-180	47	0	0	0	0	112.4	R509 N542	R509-S540 PolarHBondContact NH1-O 3.02Å; R509-S540 PolarHBondContact NH2-O 2.92Å; R509-S540 VanDerWaalsContact NH2-O 3.15Å; S540-N542 PolarHBondContact O-OD1 3.11Å
541	P	92	Very high	90.1	Very high	10 Å²	10	57.6 Å²	57.6	7%	0.065	29%	0.294	C	S	.	.			trans	-65.3	133.5	170.9	28.3	-33.7	0	0	0	110.1	I544 S567 C569 M651	P541-I544 HydrophobicContact CB-CG1 4.43Å; P541-I544 HydrophobicContact CG-CD1 4.21Å; P541-I544 HydrophobicContact CG-CG1 4.26Å; P541-S567 WeakPolarHBondContact CB-OG 3.4Å; P541-C569 HydrophobicContact CB-CB 4.12Å; P541-C569 HydrophobicContact CG-CB 4.31Å; P541-M651 HydrophobicContact CG-SD 4.48Å
542	N	88.1	Confident	89.6	Confident	119 Å²	119	62.7 Å²	62.7	64%	0.636	32%	0.319	S	S	*	.	S	Bend	trans	-80.6	-23.7	-178.9	-65.4	5	0	0	0	112.7	R509 S540 S567	R509-N542 VanDerWaalsContact CZ-OD1 3.22Å; R509-N542 PolarHBondContact NH1-OD1 2.87Å; R509-N542 PolarHBondContact NH2-OD1 3.25Å; S540-N542 PolarHBondContact O-OD1 3.11Å; N542-S567 PolarHBondContact N-OG 3.4Å
543	N	88.3	Confident	89.2	Confident	110 Å²	110	59.2 Å²	59.2	59%	0.588	31%	0.305	S	S	*	.			trans	-144.4	143.2	-179.4	-168.4	-7.3	0	0	0	109.3	S567	N543-S567 PolarHBondContact N-OG 3.17Å; N543-S567 WeakPolarHBondContact O-CB 3.34Å; N543-S567 PolarHBondContact O-N 3.4Å; N543-S567 PolarHBondContact O-OG 3.43Å
544	I	90.7	Very high	89.3	Confident	28 Å²	28	58.8 Å²	58.8	14%	0.144	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	120.9	176.8	-68.7	157.4	0	0	0	105.8	P541 A565 T566 V646 V655	P541-I544 HydrophobicContact CB-CG1 4.43Å; P541-I544 HydrophobicContact CG-CD1 4.21Å; P541-I544 HydrophobicContact CG-CG1 4.26Å; I544-A565 WeakPolarHBondContact CA-O 3.27Å; I544-T566 HydrophobicContact CG1-CG2 4.39Å; I544-V646 HydrophobicContact CD1-CB 3.78Å; I544-V646 HydrophobicContact CD1-CG1 3.81Å; I544-V646 HydrophobicContact CD1-CG2 4.1Å; I544-V646 HydrophobicContact CG1-CB 4.46Å; I544-V646 HydrophobicContact CG1-CG1 4.31Å; I544-V646 HydrophobicContact CG1-CG2 4.33Å; I544-V646 HydrophobicContact CG2-CG2 3.69Å; I544-V655 HydrophobicContact CD1-CB 3.65Å; I544-V655 HydrophobicContact CD1-CG1 3.76Å; I544-V655 HydrophobicContact CD1-CG2 4.07Å
545	R	91	Very high	89.2	Confident	158 Å²	158	56.8 Å²	56.8	60%	0.596	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.3	138.5	178.2	63.8	179.2	-171.6	-165.2	0.5	110.3	C564 A565	R545-C564 CarbonylContact O-C 3.54Å; R545-C564 WeakPolarHBondContact O-CA 3.39Å; R545-A565 HydrophobicContact CG-CB 3.77Å; R545-A565 PolarHBondContact N-O 3.23Å; R545-A565 PolarHBondContact O-N 3.49Å
546	L	92.8	Very high	88.9	Confident	33 Å²	33	60 Å²	60	17%	0.173	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	122.5	166.4	176.5	58.1	0	0	0	107.6	C564 W577 C644 S657 H659	L546-C564 HydrophobicContact CD1-CB 4.12Å; L546-W577 HydrophobicContact CD1-CH2 3.48Å; L546-W577 VanDerWaalsContact CD1-CH2 3.48Å; L546-W577 HydrophobicContact CD1-CZ3 3.8Å; L546-C644 HydrophobicContact CD1-CB 4.44Å; L546-C644 HydrophobicContact CD2-CB 4.48Å; L546-S657 VanDerWaalsContact CB-OG 3.31Å; L546-S657 WeakPolarHBondContact CB-OG 3.45Å; L546-H659 HydrophobicContact CD2-CB 3.85Å; L546-H659 HydrophobicContact CG-CB 4.46Å
547	T	92.5	Very high	88.6	Confident	59 Å²	59	59.2 Å²	59.2	36%	0.362	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	132.5	178.9	49.6	0	0	0	0	109.7	T563	T547-T563 PolarHBondContact N-O 2.86Å; T547-T563 PolarHBondContact O-N 3.07Å; T547-T563 PolarHBondContact OG1-O 3.17Å; T547-T563 VanDerWaalsContact OG1-O 3.09Å
548	A	91	Very high	88.3	Confident	11 Å²	11	59.9 Å²	59.9	9%	0.091	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	143.8	176.3	0	0	0	0	0	110.6	I551 L560 E561 L562 H659	A548-I551 WeakPolarHBondContact O-CG1 3.07Å; A548-L560 HydrophobicContact CB-CD1 4.22Å; A548-E561 CarbonylContact C-O 3.46Å; A548-E561 WeakPolarHBondContact CA-O 3.22Å; A548-L562 HydrophobicContact CB-CD2 3.58Å; A548-H659 VanDerWaalsContact CB-CE1 3.42Å; A548-H659 WeakPolarHBondContact CB-CE1 3.39Å
549	Q	89.5	Confident	88.2	Confident	110 Å²	110	66.1 Å²	66.1	51%	0.514	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	121.5	170.4	-59.3	-171.6	39.3	0	0	110.1	E561	Q549-E561 HydrophobicContact CB-CB 4.36Å; Q549-E561 PolarHBondContact N-O 3.39Å; Q549-E561 PolarHBondContact O-N 3.45Å
550	P	85.8	Confident	88.1	Confident	54 Å²	54	66 Å²	66	35%	0.351	35%	0.348	S	S	.	.	S	Bend	cis	-65.8	155.1	-7.5	29	-36.6	0	0	0	113.7	G553 V554	P550-G553 WeakPolarHBondContact CG-O 3.38Å; P550-V554 HydrophobicContact CG-CB 4.32Å; P550-V554 HydrophobicContact CG-CG1 4.44Å; P550-V554 HydrophobicContact CG-CG2 3.99Å
551	I	79.3	Confident	88.2	Confident	133 Å²	133	66.3 Å²	66.3	68%	0.682	35%	0.346	S	S	*	.	S	Bend	trans	-78.8	-42	179.1	-62.4	172	0	0	0	111.5	A548 G553	A548-I551 WeakPolarHBondContact O-CG1 3.07Å; I551-G553 PolarHBondContact O-N 2.85Å
552	N	79.9	Confident	88.3	Confident	136 Å²	136	65.9 Å²	65.9	73%	0.727	34%	0.343	S	S	*	.	S	Bend	trans	-85.8	29.5	-166.8	-60.7	-5.4	0	0	0	113.4
553	G	83.3	Confident	88.6	Confident	8 Å²	8	60.9 Å²	60.9	8%	0.082	32%	0.317	C	S	.	.			trans	86.2	165.6	-168.2	0	0	0	0	0	113.6	P550 I551 Q662	P550-G553 WeakPolarHBondContact CG-O 3.38Å; I551-G553 PolarHBondContact O-N 2.85Å; G553-Q662 CarbonylContact C-O 3.58Å; G553-Q662 WeakPolarHBondContact CA-O 3.46Å
554	V	90.1	Very high	89	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	130.6	-167.4	-169.9	0	0	0	0	108.9	P550 R559 L560 T633 L661 Q662 I663 L664	P550-V554 HydrophobicContact CG-CB 4.32Å; P550-V554 HydrophobicContact CG-CG1 4.44Å; P550-V554 HydrophobicContact CG-CG2 3.99Å; V554-R559 WeakPolarHBondContact CG1-O 3.21Å; V554-L560 HydrophobicContact CG1-CB 4.41Å; V554-L560 HydrophobicContact CG2-CB 3.92Å; V554-L560 HydrophobicContact CG2-CD1 3.89Å; V554-L560 HydrophobicContact CG2-CD2 4.2Å; V554-L560 HydrophobicContact CG2-CG 4.22Å; V554-T633 HydrophobicContact CB-CG2 4.29Å; V554-T633 HydrophobicContact CG1-CG2 3.9Å; V554-L661 HydrophobicContact CB-CD1 4.31Å; V554-L661 HydrophobicContact CG2-CD1 3.77Å; V554-Q662 PolarHBondContact N-O 3.39Å; V554-I663 CarbonylContact O-C 3.44Å; V554-I663 VanDerWaalsContact O-CA 3.27Å; V554-I663 WeakPolarHBondContact O-CA 3.36Å; V554-L664 PolarHBondContact O-N 2.72Å
555	P	87.4	Confident	89.1	Confident	66 Å²	66	54.7 Å²	54.7	43%	0.429	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	151.4	173.5	26.4	-33.7	0	0	0	111.4	G558 T633 L664	P555-G558 WeakPolarHBondContact O-CA 3.38Å; P555-G558 PolarHBondContact O-N 2.87Å; P555-T633 PolarHBondContact O-OG1 2.81Å; P555-L664 CarbonylContact C-O 3.46Å; P555-L664 WeakPolarHBondContact CA-O 3.36Å
556	E	85.5	Confident	89.3	Confident	68 Å²	68	47.5 Å²	47.5	32%	0.318	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	140.5	173	-177.6	164.2	-131.9	0	0	111.6	G558 R635 I663 L664	E556-G558 PolarHBondContact O-N 2.96Å; E556-G558 VanDerWaalsContact O-N 3.07Å; E556-R635 VanDerWaalsContact CD-NE 3.29Å; E556-R635 WeakPolarHBondContact OE1-CD 3.21Å; E556-R635 VanDerWaalsContact OE1-CG 3.25Å; E556-R635 WeakPolarHBondContact OE1-CG 3.24Å; E556-R635 PolarHBondContact OE1-N 3.5Å; E556-R635 IonicContact OE1-NE 3.47Å; E556-R635 PolarHBondContact OE1-NE 3.44Å; E556-R635 VanDerWaalsContact OE1-NE 3.1Å; E556-R635 IonicContact OE2-CZ 2.93Å; E556-R635 IonicContact OE2-NE 2.65Å; E556-R635 PolarHBondContact OE2-NE 2.85Å; E556-R635 IonicContact OE2-NH2 2.77Å; E556-R635 PolarHBondContact OE2-NH2 2.93Å; E556-I663 HydrophobicContact CB-CG2 4.4Å; E556-L664 PolarHBondContact N-O 3.11Å
557	A	84.7	Confident	89.2	Confident	62 Å²	62	47.6 Å²	47.6	51%	0.512	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	58	4.2	-166.4	0	0	0	0	0	115.7	T633	A557-T633 VanDerWaalsContact CA-O 3.28Å; A557-T633 WeakPolarHBondContact CA-O 3.14Å; A557-T633 PolarHBondContact N-O 2.84Å
558	G	86.1	Confident	89.2	Confident	14 Å²	14	45 Å²	45	14%	0.144	25%	0.246	C	C	.	.			trans	-74.1	162.2	176.9	0	0	0	0	0	113.8	P555 E556 T633	P555-G558 WeakPolarHBondContact O-CA 3.38Å; P555-G558 PolarHBondContact O-N 2.87Å; E556-G558 PolarHBondContact O-N 2.96Å; E556-G558 VanDerWaalsContact O-N 3.07Å; G558-T633 PolarHBondContact O-N 2.89Å; G558-T633 PolarHBondContact O-OG1 2.84Å
559	R	89.2	Confident	89.3	Confident	171 Å²	171	44.4 Å²	44.4	65%	0.645	24%	0.241	S	C	*	.			trans	-84.8	146.3	173.9	87.8	-177.7	-157.4	-135.6	6	111.4	V554 I630	V554-R559 WeakPolarHBondContact CG1-O 3.21Å; R559-I630 CarbonylContact C-O 3.57Å; R559-I630 WeakPolarHBondContact CA-O 3.15Å
560	L	91.7	Very high	89.4	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	128.1	169.3	171.7	60.5	0	0	0	109.8	A548 V554 L562 I630 L661	A548-L560 HydrophobicContact CB-CD1 4.22Å; V554-L560 HydrophobicContact CG1-CB 4.41Å; V554-L560 HydrophobicContact CG2-CB 3.92Å; V554-L560 HydrophobicContact CG2-CD1 3.89Å; V554-L560 HydrophobicContact CG2-CD2 4.2Å; V554-L560 HydrophobicContact CG2-CG 4.22Å; L560-L562 HydrophobicContact CD1-CD2 3.84Å; L560-L562 HydrophobicContact CD1-CG 4.34Å; L560-L562 HydrophobicContact CD2-CD1 4.29Å; L560-L562 HydrophobicContact CD2-CD2 4.07Å; L560-L562 HydrophobicContact CD2-CG 4.14Å; L560-L562 HydrophobicContact CG-CD2 3.99Å; L560-L562 HydrophobicContact CG-CG 3.98Å; L560-I630 HydrophobicContact CB-CB 4.24Å; L560-I630 HydrophobicContact CD2-CD1 3.92Å; L560-I630 HydrophobicContact CG-CD1 4.31Å; L560-I630 PolarHBondContact N-O 2.85Å; L560-I630 PolarHBondContact O-N 3.44Å; L560-L661 HydrophobicContact CD2-CD1 3.88Å
561	E	93.5	Very high	89.7	Confident	43 Å²	43	40 Å²	40	20%	0.201	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	121.9	173	-171.8	-175.2	132.8	0	0	109.3	A548 Q549 T563 T627 I629	A548-E561 CarbonylContact C-O 3.46Å; A548-E561 WeakPolarHBondContact CA-O 3.22Å; Q549-E561 HydrophobicContact CB-CB 4.36Å; Q549-E561 PolarHBondContact N-O 3.39Å; Q549-E561 PolarHBondContact O-N 3.45Å; E561-T563 PolarHBondContact OE1-OG1 3.05Å; E561-T627 HydrophobicContact CG-CG2 3.6Å; E561-I629 HydrophobicContact CG-CG1 4.43Å
562	L	94.3	Very high	90.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	111.2	177.5	-63.7	-179.6	0	0	0	109.6	A548 L560 W577 T627 L628 I630 Y642 H659	A548-L562 HydrophobicContact CB-CD2 3.58Å; L560-L562 HydrophobicContact CD1-CD2 3.84Å; L560-L562 HydrophobicContact CD1-CG 4.34Å; L560-L562 HydrophobicContact CD2-CD1 4.29Å; L560-L562 HydrophobicContact CD2-CD2 4.07Å; L560-L562 HydrophobicContact CD2-CG 4.14Å; L560-L562 HydrophobicContact CG-CD2 3.99Å; L560-L562 HydrophobicContact CG-CG 3.98Å; L562-W577 HydrophobicContact CB-CH2 3.68Å; L562-W577 HydrophobicContact CB-CZ3 3.84Å; L562-W577 HydrophobicContact CD1-CZ3 4.32Å; L562-W577 VanDerWaalsContact O-CH2 3.26Å; L562-W577 WeakPolarHBondContact O-CH2 3.42Å; L562-W577 VanDerWaalsContact O-CZ2 3.31Å; L562-W577 WeakPolarHBondContact O-CZ2 3.4Å; L562-T627 WeakPolarHBondContact O-CA 3.1Å; L562-L628 HydrophobicContact CB-CB 4.4Å; L562-L628 PolarHBondContact N-O 2.92Å; L562-L628 PolarHBondContact O-N 2.93Å; L562-I630 HydrophobicContact CD1-CD1 4.05Å; L562-Y642 VanDerWaalsContact CD1-CB 3.42Å; L562-Y642 HydrophobicContact CD1-CD1 4.29Å; L562-Y642 HydrophobicContact CD1-CD2 3.75Å; L562-Y642 HydrophobicContact CD1-CG 3.54Å; L562-H659 HydrophobicContact CD2-CB 4.33Å
563	T	94.9	Very high	90.9	Very high	15 Å²	15	30.7 Å²	30.7	9%	0.092	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	111.9	-172.8	-61.6	0	0	0	0	109.6	T547 E561 L625 S626 T627	T547-T563 PolarHBondContact N-O 2.86Å; T547-T563 PolarHBondContact O-N 3.07Å; T547-T563 PolarHBondContact OG1-O 3.17Å; T547-T563 VanDerWaalsContact OG1-O 3.09Å; E561-T563 PolarHBondContact OE1-OG1 3.05Å; T563-L625 HydrophobicContact CG2-CD1 3.44Å; T563-L625 VanDerWaalsContact CG2-CD1 3.44Å; T563-L625 HydrophobicContact CG2-CG 4.08Å; T563-S626 CarbonylContact C-O 3.48Å; T563-S626 WeakPolarHBondContact CA-O 3.37Å; T563-T627 WeakPolarHBondContact OG1-CG2 3.45Å; T563-T627 PolarHBondContact OG1-OG1 2.83Å
564	C	95.1	Very high	91.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	120.1	177.6	-165.5	0	0	0	0	109.8	R545 L546 W577 S626 C644	R545-C564 CarbonylContact O-C 3.54Å; R545-C564 WeakPolarHBondContact O-CA 3.39Å; L546-C564 HydrophobicContact CD1-CB 4.12Å; C564-W577 HydrophobicContact CB-CH2 3.71Å; C564-W577 HydrophobicContact CB-CZ2 3.52Å; C564-S626 PolarHBondContact N-O 2.98Å; C564-S626 PolarHBondContact O-N 3.27Å; C564-C644 HydrophobicContact CB-CB 3.71Å; C564-C644 WeakPolarHBondContact CB-SG 3.31Å; C564-C644 WeakPolarHBondContact SG-CB 3.43Å; C564-C644 CovalentContact SG-SG 2.03Å; C564-C644 PolarHBondContact SG-SG 2.9Å
565	A	93.5	Very high	91.5	Very high	7 Å²	7	34.6 Å²	34.6	6%	0.058	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.9	-176.3	0	0	0	0	0	111.8	I544 R545 V624 L625	I544-A565 WeakPolarHBondContact CA-O 3.27Å; R545-A565 HydrophobicContact CG-CB 3.77Å; R545-A565 PolarHBondContact N-O 3.23Å; R545-A565 PolarHBondContact O-N 3.49Å; A565-V624 CarbonylContact C-O 3.58Å; A565-V624 WeakPolarHBondContact CA-O 3.46Å; A565-L625 HydrophobicContact CB-CD1 3.41Å; A565-L625 VanDerWaalsContact CB-CD1 3.41Å
566	T	94.1	Very high	91.8	Very high	8 Å²	8	36.6 Å²	36.6	5%	0.049	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	146.3	168	81	0	0	0	0	110.9	I544 A573 I575 V624 V646	I544-T566 HydrophobicContact CG1-CG2 4.39Å; T566-A573 HydrophobicContact CG2-CB 4.09Å; T566-I575 HydrophobicContact CG2-CD1 4.17Å; T566-I575 HydrophobicContact CG2-CG1 4.44Å; T566-V624 HydrophobicContact CG2-CB 4.3Å; T566-V624 PolarHBondContact N-O 2.73Å; T566-V624 PolarHBondContact OG1-N 3.49Å; T566-V624 VanDerWaalsContact OG1-N 3.14Å; T566-V646 HydrophobicContact CG2-CG1 3.82Å; T566-V646 HydrophobicContact CG2-CG2 4.47Å
567	S	91.8	Very high	92.1	Very high	34 Å²	34	33.4 Å²	33.4	24%	0.238	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-65.1	171.9	156.3	51.8	0	0	0	0	111.5	P541 N542 N543 C569	P541-S567 WeakPolarHBondContact CB-OG 3.4Å; N542-S567 PolarHBondContact N-OG 3.4Å; N543-S567 PolarHBondContact N-OG 3.17Å; N543-S567 WeakPolarHBondContact O-CB 3.34Å; N543-S567 PolarHBondContact O-N 3.4Å; N543-S567 PolarHBondContact O-OG 3.43Å; S567-C569 PolarHBondContact O-N 2.91Å
568	S	92.4	Very high	92.4	Very high	4 Å²	4	31.1 Å²	31.1	3%	0.028	16%	0.16	C	C	.	.	S	Bend	trans	-54.6	124.5	-178.3	-54.7	0	0	0	0	112.8	F539 G617 D618 T622 K623	F539-S568 WeakPolarHBondContact CE2-O 3.16Å; S568-G617 WeakPolarHBondContact OG-CA 3.47Å; S568-D618 PolarHBondContact OG-N 3.33Å; S568-D618 PolarHBondContact OG-OD2 2.86Å; S568-T622 WeakPolarHBondContact CA-O 3.25Å; S568-K623 WeakPolarHBondContact OG-CE 3.26Å; S568-K623 WeakPolarHBondContact OG-CG 3.27Å
569	C	92.4	Very high	92.7	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-140.7	152.7	-179.5	60.6	0	0	0	0	112	F539 P541 S567 P571 A573 G621 T622	F539-C569 WeakPolarHBondContact O-CA 3.32Å; P541-C569 HydrophobicContact CB-CB 4.12Å; P541-C569 HydrophobicContact CG-CB 4.31Å; S567-C569 PolarHBondContact O-N 2.91Å; C569-P571 CarbonylContact C-O 3.54Å; C569-A573 PolarHBondContact SG-N 3.44Å; C569-G621 CarbonylContact O-C 3.56Å; C569-G621 WeakPolarHBondContact O-CA 3.35Å; C569-T622 PolarHBondContact N-O 3.41Å; C569-T622 PolarHBondContact O-N 2.78Å; C569-T622 PolarHBondContact O-OG1 3.2Å; C569-T622 PolarHBondContact SG-O 3.43Å
570	H	92.2	Very high	92.6	Very high	32 Å²	32	25.1 Å²	25.1	15%	0.148	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-139.3	127.3	173.2	-167.2	57.4	0	0	0	110.4	E536 V537 M538 F539 H648	E536-H570 IonicContact OE1-CD2 2.97Å; E536-H570 IonicContact OE1-CE1 3.8Å; E536-H570 IonicContact OE1-NE2 2.66Å; E536-H570 PolarHBondContact OE1-NE2 2.8Å; V537-H570 PolarHBondContact O-CD2 3.47Å; M538-H570 CarbonylContact C-O 3.53Å; M538-H570 VanDerWaalsContact CA-O 3.27Å; M538-H570 WeakPolarHBondContact CA-O 3.47Å; F539-H570 HydrophobicContact CD1-CB 3.95Å; F539-H570 HydrophobicContact CE1-CB 3.61Å; F539-H570 HydrophobicContact CE2-CB 4.4Å; F539-H570 HydrophobicContact CG-CB 4.47Å; F539-H570 HydrophobicContact CZ-CB 3.88Å; F539-H570 PolarHBondContact N-O 2.89Å; F539-H570 PolarHBondContact O-N 3.34Å; H570-H648 PolarHBondContact O-CE1 3.41Å; H570-H648 PolarHBondContact O-NE2 2.8Å; H570-H648 VanDerWaalsContact O-NE2 3.17Å
571	P	91.4	Very high	92.1	Very high	38 Å²	38	26.5 Å²	26.5	25%	0.247	15%	0.146	C	C	.	.	S	Bend	cis	-61.3	175.2	-11.2	31.1	-37.6	0	0	0	112.1	C569 A573 H648 T649	C569-P571 CarbonylContact C-O 3.54Å; P571-A573 PolarHBondContact O-N 2.8Å; P571-H648 PolarHBondContact O-CD2 3.39Å; P571-H648 PolarHBondContact O-NE2 2.81Å; P571-T649 WeakPolarHBondContact CD-OG1 3.29Å; P571-T649 WeakPolarHBondContact CG-OG1 3.5Å
572	P	92.1	Very high	91.3	Very high	68 Å²	68	25.8 Å²	25.8	44%	0.442	15%	0.145	S	C	.	.	P	Polyproline II helix	trans	-54.1	136.3	175.2	-22.3	30.1	0	0	0	112.7	T622 V624	P572-T622 VanDerWaalsContact CA-OG1 3.32Å; P572-T622 WeakPolarHBondContact CA-OG1 3.14Å; P572-T622 WeakPolarHBondContact CB-OG1 3.3Å; P572-T622 HydrophobicContact CG-CG2 4.21Å; P572-T622 WeakPolarHBondContact CG-OG1 3.4Å; P572-V624 HydrophobicContact CB-CG2 4.13Å
573	A	92.5	Very high	90.1	Very high	6 Å²	6	31.7 Å²	31.7	5%	0.05	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-72.6	142.3	175.6	0	0	0	0	0	111.7	T566 C569 P571 V646 H648	T566-A573 HydrophobicContact CG2-CB 4.09Å; C569-A573 PolarHBondContact SG-N 3.44Å; P571-A573 PolarHBondContact O-N 2.8Å; A573-V646 HydrophobicContact CB-CG1 3.93Å; A573-H648 HydrophobicContact CB-CB 4.35Å
574	V	92.7	Very high	88.6	Confident	80 Å²	80	34.6 Å²	34.6	49%	0.485	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	117.6	176.6	179.8	0	0	0	0	108.7	N647	V574-N647 PolarHBondContact N-O 3.36Å; V574-N647 PolarHBondContact O-N 2.75Å
575	I	93.8	Very high	87	Confident	11 Å²	11	36.9 Å²	36.9	6%	0.056	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	140.2	174.1	-55.7	-178.8	0	0	0	109.1	T566 V624 C644 V646	T566-I575 HydrophobicContact CG2-CD1 4.17Å; T566-I575 HydrophobicContact CG2-CG1 4.44Å; I575-V624 HydrophobicContact CD1-CB 4.28Å; I575-V624 HydrophobicContact CD1-CG1 3.78Å; I575-V624 HydrophobicContact CG1-CG1 4.17Å; I575-C644 VanDerWaalsContact CG2-SG 3.59Å; I575-V646 HydrophobicContact CG1-CG2 4.3Å
576	R	93	Very high	85	Confident	107 Å²	107	43.6 Å²	43.6	40%	0.404	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	150	168.4	-75.2	-179.4	163.4	129.6	8.9	110.5	E605 T607 L645	R576-E605 WeakPolarHBondContact CD-OE1 3.4Å; R576-E605 WeakPolarHBondContact CG-OE1 3.34Å; R576-E605 IonicContact NE-OE1 2.75Å; R576-E605 PolarHBondContact NE-OE1 3.13Å; R576-T607 WeakPolarHBondContact CA-OG1 3.42Å; R576-T607 HydrophobicContact CG-CG2 4.27Å; R576-L645 HydrophobicContact CB-CB 4.28Å; R576-L645 PolarHBondContact N-O 2.91Å; R576-L645 PolarHBondContact O-N 2.76Å
577	W	93.5	Very high	82.9	Confident	1 Å²	1	49 Å²	49	0%	0.004	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	128.5	176.2	-70.1	96.7	0	0	0	110.7	L546 L562 C564 E605 L606 T607 A610 S626 L628 C644	L546-W577 HydrophobicContact CD1-CH2 3.48Å; L546-W577 VanDerWaalsContact CD1-CH2 3.48Å; L546-W577 HydrophobicContact CD1-CZ3 3.8Å; L562-W577 HydrophobicContact CB-CH2 3.68Å; L562-W577 HydrophobicContact CB-CZ3 3.84Å; L562-W577 HydrophobicContact CD1-CZ3 4.32Å; L562-W577 VanDerWaalsContact O-CH2 3.26Å; L562-W577 WeakPolarHBondContact O-CH2 3.42Å; L562-W577 VanDerWaalsContact O-CZ2 3.31Å; L562-W577 WeakPolarHBondContact O-CZ2 3.4Å; C564-W577 HydrophobicContact CB-CH2 3.71Å; C564-W577 HydrophobicContact CB-CZ2 3.52Å; W577-E605 CarbonylContact O-C 3.56Å; W577-E605 WeakPolarHBondContact O-CA 3.41Å; W577-L606 HydrophobicContact CB-CB 4.17Å; W577-L606 PolarHBondContact O-N 3.02Å; W577-T607 PolarHBondContact N-OG1 3.07Å; W577-T607 VanDerWaalsContact N-OG1 3.11Å; W577-A610 HydrophobicContact CG-CB 4.33Å; W577-S626 PolarHBondContact NE1-OG 3.25Å; W577-L628 HydrophobicContact CB-CD2 4.19Å; W577-L628 HydrophobicContact CD2-CB 3.98Å; W577-L628 HydrophobicContact CD2-CD2 4Å; W577-L628 HydrophobicContact CE3-CB 4.33Å; W577-L628 HydrophobicContact CE3-CD2 3.91Å; W577-L628 HydrophobicContact CG-CB 4.35Å; W577-L628 HydrophobicContact CG-CD2 4.16Å; W577-L628 HydrophobicContact CH2-CB 4.44Å; W577-L628 HydrophobicContact CZ2-CB 4.13Å; W577-C644 HydrophobicContact CE3-CB 4.28Å; W577-C644 HydrophobicContact CH2-CB 4.26Å; W577-C644 HydrophobicContact CZ3-CB 4.04Å
578	L	91.1	Very high	80.7	Confident	15 Å²	15	52.4 Å²	52.4	8%	0.079	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	135	176.6	-57.1	176.1	0	0	0	110	N604 E605 Y642 Q643	L578-N604 CarbonylContact C-O 3.58Å; L578-N604 WeakPolarHBondContact CA-O 3.24Å; L578-E605 HydrophobicContact CD2-CB 4.09Å; L578-E605 HydrophobicContact CD2-CG 4.16Å; L578-Y642 WeakPolarHBondContact O-CA 3.33Å; L578-Q643 HydrophobicContact CB-CB 4.36Å; L578-Q643 PolarHBondContact N-O 3.32Å; L578-Q643 PolarHBondContact O-N 3.21Å
579	E	91.2	Very high	78.5	Confident	33 Å²	33	59 Å²	59	15%	0.154	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	132.4	172.6	173.2	-176	-110.9	0	0	110.2	S603 N604 L606 T640 Y642	E579-S603 CarbonylContact O-C 3.46Å; E579-S603 WeakPolarHBondContact O-CA 3.34Å; E579-S603 VanDerWaalsContact O-CB 3.29Å; E579-S603 WeakPolarHBondContact O-CB 3.27Å; E579-N604 HydrophobicContact CB-CB 4.28Å; E579-N604 PolarHBondContact N-O 3.09Å; E579-N604 PolarHBondContact O-N 3.49Å; E579-N604 PolarHBondContact OE2-ND2 3.03Å; E579-L606 HydrophobicContact CB-CD1 3.72Å; E579-L606 HydrophobicContact CB-CG 4.12Å; E579-L606 HydrophobicContact CG-CD1 4.48Å; E579-T640 HydrophobicContact CG-CG2 3.79Å; E579-Y642 HydrophobicContact CB-CD1 4Å; E579-Y642 HydrophobicContact CB-CE1 3.74Å; E579-Y642 HydrophobicContact CG-CD1 4.23Å; E579-Y642 HydrophobicContact CG-CE1 3.59Å; E579-Y642 WeakPolarHBondContact OE1-CE1 3.33Å; E579-Y642 VanDerWaalsContact OE1-CZ 3.31Å; E579-Y642 PolarHBondContact OE1-OH 3.49Å
580	I	87.1	Confident	76.2	Confident	25 Å²	25	67.8 Å²	67.8	13%	0.128	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	102.7	175.4	-54	177.4	0	0	0	108.1	I585 I641 Q643	I580-I585 HydrophobicContact CG2-CG1 3.85Å; I580-I641 HydrophobicContact CB-CB 4.34Å; I580-I641 PolarHBondContact N-O 2.85Å; I580-I641 PolarHBondContact O-N 2.92Å; I580-Q643 HydrophobicContact CD1-CG 4.37Å
581	P	81.8	Confident	73.4	Confident	30 Å²	30	72.9 Å²	72.9	20%	0.195	37%	0.366	C	S	.	.			trans	-69.9	152.1	177.9	29.1	-35	0	0	0	111.6	D583 K584	P581-D583 VanDerWaalsContact C-N 3.33Å; P581-D583 PolarHBondContact O-N 3.19Å; P581-K584 HydrophobicContact CG-CD 4Å; P581-K584 HydrophobicContact CG-CG 4.23Å; P581-K584 PolarHBondContact O-N 2.86Å
582	P	75.5	Confident	70.9	Confident	28 Å²	28	75.6 Å²	75.6	18%	0.182	38%	0.378	C	S	.	.	H	α-helix	trans	-59.6	-36.5	-167.3	21.8	-34.3	0	0	0	114.2	K584 I585 T640	P582-K584 VanDerWaalsContact C-N 3.28Å; P582-K584 PolarHBondContact O-N 3.35Å; P582-I585 VanDerWaalsContact O-CB 3.32Å; P582-I585 WeakPolarHBondContact O-CB 3.28Å; P582-I585 PolarHBondContact O-N 2.8Å; P582-T640 WeakPolarHBondContact CD-OG1 3.48Å
583	D	70.6	Confident	68	Low	124 Å²	124	82.2 Å²	82.2	66%	0.663	40%	0.402	S	S	*	.	H	α-helix	trans	-57.8	-41.3	-179.5	-51	-38.5	0	0	0	112	P581 I585 Q586	P581-D583 VanDerWaalsContact C-N 3.33Å; P581-D583 PolarHBondContact O-N 3.19Å; D583-I585 VanDerWaalsContact C-N 3.27Å; D583-I585 PolarHBondContact O-N 3.31Å; D583-Q586 PolarHBondContact O-N 2.86Å
584	K	62.3	Low	65.1	Low	76 Å²	76	89.5 Å²	89.5	33%	0.33	44%	0.436	S	S	.	.	H	α-helix	trans	-76.3	-11.9	-179.2	-63.4	-175	-176.7	177.4	0	113.4	P581 P582 Q586 F602	P581-K584 HydrophobicContact CG-CD 4Å; P581-K584 HydrophobicContact CG-CG 4.23Å; P581-K584 PolarHBondContact O-N 2.86Å; P582-K584 VanDerWaalsContact C-N 3.28Å; P582-K584 PolarHBondContact O-N 3.35Å; K584-Q586 VanDerWaalsContact C-N 3.3Å; K584-F602 HydrophobicContact CD-CB 4.32Å; K584-F602 HydrophobicContact CD-CD1 4.4Å; K584-F602 WeakPolarHBondContact CD-O 3.36Å; K584-F602 PolarHBondContact NZ-O 2.83Å
585	I	63	Low	62.2	Low	48 Å²	48	90.6 Å²	90.6	25%	0.246	44%	0.435	C	S	.	.	H	α-helix	trans	-71.1	-31.6	172.1	-53.5	177.6	0	0	0	109.8	I580 P582 D583 K588 N639 I641	I580-I585 HydrophobicContact CG2-CG1 3.85Å; P582-I585 VanDerWaalsContact O-CB 3.32Å; P582-I585 WeakPolarHBondContact O-CB 3.28Å; P582-I585 PolarHBondContact O-N 2.8Å; D583-I585 VanDerWaalsContact C-N 3.27Å; D583-I585 PolarHBondContact O-N 3.31Å; I585-K588 WeakPolarHBondContact O-CB 3.5Å; I585-K588 PolarHBondContact O-N 3.2Å; I585-N639 WeakPolarHBondContact CD1-O 3.42Å; I585-I641 HydrophobicContact CD1-CD1 3.87Å; I585-I641 HydrophobicContact CD1-CG1 3.84Å
586	Q	50.1	Low	59.6	Low	147 Å²	147	100.5 Å²	100.5	69%	0.687	48%	0.478	S	S	*	.	H	α-helix	trans	-75.1	-37.5	-176.2	-57.3	-164.9	29.4	0	0	113.2	D583 K584 K588 N589	D583-Q586 PolarHBondContact O-N 2.86Å; K584-Q586 VanDerWaalsContact C-N 3.3Å; Q586-K588 PolarHBondContact O-N 2.69Å; Q586-N589 PolarHBondContact O-N 3.19Å
587	E	49.9	Very low	56.9	Low	121 Å²	121	103.7 Å²	103.7	57%	0.565	50%	0.498	S	S	*	.	H	α-helix	trans	-60.1	-34.8	174.4	-64.5	-166.4	121.2	0	0	112.1	N589 K590	E587-N589 PolarHBondContact O-N 3.43Å; E587-N589 VanDerWaalsContact O-N 3.13Å; E587-K590 PolarHBondContact O-N 3.49Å; E587-K590 VanDerWaalsContact O-N 3.12Å
588	K	45.9	Very low	54.2	Low	107 Å²	107	109.1 Å²	109.1	47%	0.465	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-26.1	-178.3	-156.6	174.3	-175	175.6	0	113.5	I585 Q586 I592	I585-K588 WeakPolarHBondContact O-CB 3.5Å; I585-K588 PolarHBondContact O-N 3.2Å; Q586-K588 PolarHBondContact O-N 2.69Å; K588-I592 HydrophobicContact CD-CD1 4.33Å; K588-I592 HydrophobicContact CG-CD1 3.53Å
589	N	45.4	Very low	51.9	Low	143 Å²	143	112.6 Å²	112.6	77%	0.765	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-1.5	-178.9	-71.8	-12.7	0	0	0	114.5	Q586 E587	Q586-N589 PolarHBondContact O-N 3.19Å; E587-N589 PolarHBondContact O-N 3.43Å; E587-N589 VanDerWaalsContact O-N 3.13Å
590	K	45	Very low	49.6	Very low	183 Å²	183	120.5 Å²	120.5	80%	0.796	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-23.2	176.6	-75.4	-175	175.4	175.5	0	114.9	E587	E587-K590 PolarHBondContact O-N 3.49Å; E587-K590 VanDerWaalsContact O-N 3.12Å
591	N	33.1	Very low	47.6	Very low	140 Å²	140	125.1 Å²	125.1	75%	0.749	60%	0.596	S	S	*	*	S	Bend	trans	-141.7	52	-165.9	-71.2	-37.8	0	0	0	114.6
592	I	39.4	Very low	46	Very low	95 Å²	95	128 Å²	128	49%	0.487	61%	0.606	S	S	.	*			trans	-139.3	99.5	169.1	-53.2	-176.9	0	0	0	112.9	K588	K588-I592 HydrophobicContact CD-CD1 4.33Å; K588-I592 HydrophobicContact CG-CD1 3.53Å
593	E	31.7	Very low	45.2	Very low	206 Å²	206	128 Å²	128	96%	0.963	61%	0.606	S	S	*	*	S	Bend	trans	-108.3	-25	135.1	-77.9	-161.6	126.5	0	0	111.5
594	E	31.5	Very low	45.3	Very low	160 Å²	160	125.5 Å²	125.5	75%	0.748	59%	0.593	S	S	*	*	S	Bend	trans	-120.1	112.6	174.2	-62.7	-167.7	159.2	0	0	111.2
595	H	31.8	Very low	46.4	Very low	103 Å²	103	126.8 Å²	126.8	48%	0.477	60%	0.6	S	S	.	*			trans	167	91.3	139.2	-86.1	-8.6	0	0	0	112.8	Q597 Y598	H595-Q597 PolarHBondContact O-N 2.86Å; H595-Y598 HydrophobicContact CB-CD2 4.11Å; H595-Y598 AromaticContact CD2-CD2 3.07Å; H595-Y598 WeakPolarHBondContact CD2-CD2 3.25Å; H595-Y598 AromaticContact CD2-CE2 3.2Å; H595-Y598 WeakPolarHBondContact CD2-CE2 3.38Å; H595-Y598 AromaticContact CD2-CG 3.89Å; H595-Y598 AromaticContact CG-CD2 3.68Å; H595-Y598 AromaticContact NE2-CD2 3.66Å; H595-Y598 AromaticContact NE2-CE2 3.3Å; H595-Y598 VanDerWaalsContact NE2-CE2 3.3Å; H595-Y598 WeakPolarHBondContact NE2-CE2 3.16Å
596	F	38.3	Very low	47.5	Very low	219 Å²	219	125.8 Å²	125.8	96%	0.961	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	21.6	164.8	-109	-81.1	0	0	0	113.5
597	Q	36.6	Very low	49.1	Very low	174 Å²	174	120.5 Å²	120.5	81%	0.813	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.2	-0.5	-168.9	-156.6	167.4	2	0	0	114.1	H595	H595-Q597 PolarHBondContact O-N 2.86Å
598	Y	38	Very low	50.6	Low	114 Å²	114	122.3 Å²	122.3	45%	0.447	59%	0.586	S	S	.	*			trans	-100.2	6.9	-169.3	-110.5	-102.9	0	0	0	116.8	H595 K600 L601 F602	H595-Y598 HydrophobicContact CB-CD2 4.11Å; H595-Y598 AromaticContact CD2-CD2 3.07Å; H595-Y598 WeakPolarHBondContact CD2-CD2 3.25Å; H595-Y598 AromaticContact CD2-CE2 3.2Å; H595-Y598 WeakPolarHBondContact CD2-CE2 3.38Å; H595-Y598 AromaticContact CD2-CG 3.89Å; H595-Y598 AromaticContact CG-CD2 3.68Å; H595-Y598 AromaticContact NE2-CD2 3.66Å; H595-Y598 AromaticContact NE2-CE2 3.3Å; H595-Y598 VanDerWaalsContact NE2-CE2 3.3Å; H595-Y598 WeakPolarHBondContact NE2-CE2 3.16Å; Y598-K600 PolarHBondContact O-N 3.49Å; Y598-L601 HydrophobicContact CD1-CB 4.24Å; Y598-L601 HydrophobicContact CD1-CD2 4.34Å; Y598-L601 HydrophobicContact CE1-CD2 3.82Å; Y598-L601 PolarHBondContact O-N 2.85Å; Y598-F602 HydrophobicContact CD1-CD2 4.45Å; Y598-F602 AromaticContact CD1-CE2 3.87Å; Y598-F602 HydrophobicContact CD1-CE2 3.87Å; Y598-F602 HydrophobicContact CE1-CE2 4.36Å
599	N	42.5	Very low	52.4	Low	88 Å²	88	123.4 Å²	123.4	47%	0.471	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.9	-13	179.7	-76.2	17.3	0	0	0	114.2	S603	N599-S603 PolarHBondContact O-OG 2.98Å; N599-S603 VanDerWaalsContact O-OG 3.08Å
600	K	43.1	Very low	54.4	Low	200 Å²	200	117.5 Å²	117.5	87%	0.87	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	0.1	-176.4	-128.3	-171.6	-177.3	-166.4	0	116.1	Y598	Y598-K600 PolarHBondContact O-N 3.49Å
601	L	44.4	Very low	56.5	Low	121 Å²	121	114.3 Å²	114.3	63%	0.634	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.2	-16.1	-175.9	-145.4	75.3	0	0	0	114.9	Y598	Y598-L601 HydrophobicContact CD1-CB 4.24Å; Y598-L601 HydrophobicContact CD1-CD2 4.34Å; Y598-L601 HydrophobicContact CE1-CD2 3.82Å; Y598-L601 PolarHBondContact O-N 2.85Å
602	F	47.7	Very low	59.3	Low	91 Å²	91	113 Å²	113	40%	0.399	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.6	-17.2	-166.9	-65.5	-68.8	0	0	0	115.9	K584 Y598	K584-F602 HydrophobicContact CD-CB 4.32Å; K584-F602 HydrophobicContact CD-CD1 4.4Å; K584-F602 WeakPolarHBondContact CD-O 3.36Å; K584-F602 PolarHBondContact NZ-O 2.83Å; Y598-F602 HydrophobicContact CD1-CD2 4.45Å; Y598-F602 AromaticContact CD1-CE2 3.87Å; Y598-F602 HydrophobicContact CD1-CE2 3.87Å; Y598-F602 HydrophobicContact CE1-CE2 4.36Å
603	S	59.8	Low	61.7	Low	28 Å²	28	113.3 Å²	113.3	20%	0.196	55%	0.547	C	S	.	.	S	Bend	trans	-104.3	144.6	179.5	61.2	0	0	0	0	112.2	E579 N599	E579-S603 CarbonylContact O-C 3.46Å; E579-S603 WeakPolarHBondContact O-CA 3.34Å; E579-S603 VanDerWaalsContact O-CB 3.29Å; E579-S603 WeakPolarHBondContact O-CB 3.27Å; N599-S603 PolarHBondContact O-OG 2.98Å; N599-S603 VanDerWaalsContact O-OG 3.08Å
604	N	72.8	Confident	64.4	Low	72 Å²	72	107.8 Å²	107.8	39%	0.385	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	130.2	170.9	-57.1	-26.4	0	0	0	108.1	L578 E579 L606	L578-N604 CarbonylContact C-O 3.58Å; L578-N604 WeakPolarHBondContact CA-O 3.24Å; E579-N604 HydrophobicContact CB-CB 4.28Å; E579-N604 PolarHBondContact N-O 3.09Å; E579-N604 PolarHBondContact O-N 3.49Å; E579-N604 PolarHBondContact OE2-ND2 3.03Å; N604-L606 HydrophobicContact CB-CD2 4.28Å
605	E	83.9	Confident	67.1	Low	102 Å²	102	104.1 Å²	104.1	48%	0.477	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	113.1	172.7	-172.6	165.1	-179.5	0	0	109.1	R576 W577 L578 T607	R576-E605 WeakPolarHBondContact CD-OE1 3.4Å; R576-E605 WeakPolarHBondContact CG-OE1 3.34Å; R576-E605 IonicContact NE-OE1 2.75Å; R576-E605 PolarHBondContact NE-OE1 3.13Å; W577-E605 CarbonylContact O-C 3.56Å; W577-E605 WeakPolarHBondContact O-CA 3.41Å; L578-E605 HydrophobicContact CD2-CB 4.09Å; L578-E605 HydrophobicContact CD2-CG 4.16Å; E605-T607 VanDerWaalsContact CG-OG1 3.24Å; E605-T607 WeakPolarHBondContact CG-OG1 3.13Å; E605-T607 PolarHBondContact OE1-OG1 3.08Å
606	L	86.4	Confident	69.7	Low	28 Å²	28	108.1 Å²	108.1	15%	0.147	53%	0.532	C	S	.	.			trans	-100.5	11.1	-177.2	-58	-175.5	0	0	0	112.8	W577 E579 N604 D608 L609 L628 Y642	W577-L606 HydrophobicContact CB-CB 4.17Å; W577-L606 PolarHBondContact O-N 3.02Å; E579-L606 HydrophobicContact CB-CD1 3.72Å; E579-L606 HydrophobicContact CB-CG 4.12Å; E579-L606 HydrophobicContact CG-CD1 4.48Å; N604-L606 HydrophobicContact CB-CD2 4.28Å; L606-D608 PolarHBondContact O-N 3.21Å; L606-D608 VanDerWaalsContact O-N 3.17Å; L606-L609 HydrophobicContact CD2-CD1 4.32Å; L606-L609 PolarHBondContact O-N 3.45Å; L606-L628 HydrophobicContact CB-CD1 4.24Å; L606-L628 HydrophobicContact CB-CD2 4.35Å; L606-L628 HydrophobicContact CD1-CD2 4.08Å; L606-Y642 HydrophobicContact CD1-CD1 4.26Å; L606-Y642 HydrophobicContact CD1-CE1 3.85Å
607	T	83.5	Confident	72	Confident	35 Å²	35	98.2 Å²	98.2	22%	0.215	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-53.7	-37.2	-175.5	-51.7	0	0	0	0	112.6	R576 W577 E605 L609 A610	R576-T607 WeakPolarHBondContact CA-OG1 3.42Å; R576-T607 HydrophobicContact CG-CG2 4.27Å; W577-T607 PolarHBondContact N-OG1 3.07Å; W577-T607 VanDerWaalsContact N-OG1 3.11Å; E605-T607 VanDerWaalsContact CG-OG1 3.24Å; E605-T607 WeakPolarHBondContact CG-OG1 3.13Å; E605-T607 PolarHBondContact OE1-OG1 3.08Å; T607-L609 VanDerWaalsContact C-N 3.26Å; T607-L609 PolarHBondContact O-N 2.88Å; T607-A610 PolarHBondContact O-N 2.92Å
608	D	82.3	Confident	74.3	Confident	160 Å²	160	93.9 Å²	93.9	86%	0.856	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-72.5	-14.2	-178.4	-61.3	-17.2	0	0	0	113.9	L606	L606-D608 PolarHBondContact O-N 3.21Å; L606-D608 VanDerWaalsContact O-N 3.17Å
609	L	84.1	Confident	76.7	Confident	129 Å²	129	93.6 Å²	93.6	68%	0.675	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-95.7	-8.8	175.8	-59.8	179.9	0	0	0	112.9	L606 T607 L628	L606-L609 HydrophobicContact CD2-CD1 4.32Å; L606-L609 PolarHBondContact O-N 3.45Å; T607-L609 VanDerWaalsContact C-N 3.26Å; T607-L609 PolarHBondContact O-N 2.88Å; L609-L628 HydrophobicContact CB-CD1 4.11Å
610	A	87	Confident	78.6	Confident	19 Å²	19	92.3 Å²	92.3	16%	0.157	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	133.5	-179.1	0	0	0	0	0	111.1	W577 T607 S626 T627 L628	W577-A610 HydrophobicContact CG-CB 4.33Å; T607-A610 PolarHBondContact O-N 2.92Å; A610-S626 WeakPolarHBondContact CB-OG 3.47Å; A610-T627 CarbonylContact C-O 3.6Å; A610-T627 WeakPolarHBondContact CA-O 3.41Å; A610-L628 HydrophobicContact CB-CB 4.24Å; A610-L628 HydrophobicContact CB-CD1 4.41Å
611	Q	89.3	Confident	80.8	Confident	117 Å²	117	82.9 Å²	82.9	55%	0.547	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	146.4	169.2	-59.1	-179.6	15.6	0	0	108.6	S626 T627	Q611-S626 CarbonylContact O-C 3.52Å; Q611-S626 WeakPolarHBondContact O-CA 3.31Å; Q611-S626 PolarHBondContact O-OG 2.91Å; Q611-S626 VanDerWaalsContact O-OG 3.07Å; Q611-T627 PolarHBondContact N-O 2.8Å; Q611-T627 PolarHBondContact O-N 3.15Å
612	L	90.5	Very high	83	Confident	111 Å²	111	78.6 Å²	78.6	58%	0.581	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.3	118.2	-177.2	-173.8	73.5	0	0	0	109.8	V624	L612-V624 HydrophobicContact CD1-CG1 3.65Å
613	E	90	Very high	85.1	Confident	102 Å²	102	77.6 Å²	77.6	48%	0.477	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	138.7	175	-58.1	-177	168.7	0	0	110.2	L625	E613-L625 HydrophobicContact CB-CB 4.28Å; E613-L625 PolarHBondContact N-O 3.31Å; E613-L625 PolarHBondContact O-N 2.71Å
614	T	88.8	Confident	86.7	Confident	90 Å²	90	76.4 Å²	76.4	55%	0.552	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	104.1	177.1	46.2	0	0	0	0	109.8	V624	T614-V624 HydrophobicContact CG2-CG1 4.43Å; T614-V624 HydrophobicContact CG2-CG2 4.44Å
615	N	89.3	Confident	87.8	Confident	83 Å²	83	74.8 Å²	74.8	44%	0.444	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	149.8	-179.4	-74.2	-66.7	0	0	0	110.5	G617 T622 K623	N615-G617 PolarHBondContact O-N 3.1Å; N615-T622 WeakPolarHBondContact O-CA 3.41Å; N615-K623 HydrophobicContact CB-CB 4.37Å; N615-K623 PolarHBondContact N-O 2.77Å; N615-K623 PolarHBondContact O-N 3.47Å
616	Q	86.4	Confident	88.3	Confident	187 Å²	187	70.1 Å²	70.1	87%	0.874	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.9	127.4	174.5	-79.1	-172.9	-16.4	0	0	110.4
617	G	85	Confident	88.7	Confident	12 Å²	12	69.7 Å²	69.7	12%	0.124	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-94	167.1	179.2	0	0	0	0	0	112.2	S568 N615 G621	S568-G617 WeakPolarHBondContact OG-CA 3.47Å; N615-G617 PolarHBondContact O-N 3.1Å; G617-G621 VanDerWaalsContact CA-O 3.24Å; G617-G621 WeakPolarHBondContact CA-O 3.28Å; G617-G621 PolarHBondContact N-O 3.49Å
618	D	86.2	Confident	89.2	Confident	82 Å²	82	68.2 Å²	68.2	44%	0.439	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-65	147.5	173.1	-30.2	-65.9	0	0	0	108.8	S568 G620 G621 K623	S568-D618 PolarHBondContact OG-N 3.33Å; S568-D618 PolarHBondContact OG-OD2 2.86Å; D618-G620 VanDerWaalsContact C-N 3.26Å; D618-G620 PolarHBondContact O-N 2.79Å; D618-G621 PolarHBondContact O-N 3.01Å; D618-K623 WeakPolarHBondContact OD1-CE 3.42Å; D618-K623 IonicContact OD1-NZ 3.41Å; D618-K623 PolarHBondContact OD1-NZ 3.3Å; D618-K623 WeakPolarHBondContact OD2-CE 3Å; D618-K623 IonicContact OD2-NZ 2.71Å; D618-K623 PolarHBondContact OD2-NZ 3.38Å
619	F	87.2	Confident	89.7	Confident	108 Å²	108	64 Å²	64	47%	0.474	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	58.6	30.6	-178	-37.8	-74.2	0	0	0	115.1	R509 A510 N512 F539 G621	R509-F619 HydrophobicContact CB-CB 4.36Å; R509-F619 HydrophobicContact CB-CD2 4.22Å; R509-F619 HydrophobicContact CB-CG 4.39Å; R509-F619 HydrophobicContact CG-CD2 3.76Å; R509-F619 HydrophobicContact CG-CE2 4.02Å; R509-F619 HydrophobicContact CG-CG 4.19Å; R509-F619 VanDerWaalsContact O-CB 3.26Å; R509-F619 WeakPolarHBondContact O-CB 3.48Å; A510-F619 HydrophobicContact CB-CD1 4.17Å; A510-F619 HydrophobicContact CB-CE1 4.16Å; N512-F619 PolarHBondContact ND2-O 2.89Å; F539-F619 HydrophobicContact CZ-CB 4.45Å; F619-G621 PolarHBondContact O-N 3.32Å
620	G	82.5	Confident	89.9	Confident	61 Å²	61	58.9 Å²	58.9	63%	0.629	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	69.6	12.1	179.6	0	0	0	0	0	114.4	D618	D618-G620 VanDerWaalsContact C-N 3.26Å; D618-G620 PolarHBondContact O-N 2.79Å
621	G	89	Confident	89.9	Confident	3 Å²	3	62.8 Å²	62.8	3%	0.031	34%	0.34	C	S	.	.			trans	-76.5	-167.9	166.9	0	0	0	0	0	111.9	C569 G617 D618 F619	C569-G621 CarbonylContact O-C 3.56Å; C569-G621 WeakPolarHBondContact O-CA 3.35Å; G617-G621 VanDerWaalsContact CA-O 3.24Å; G617-G621 WeakPolarHBondContact CA-O 3.28Å; G617-G621 PolarHBondContact N-O 3.49Å; D618-G621 PolarHBondContact O-N 3.01Å; F619-G621 PolarHBondContact O-N 3.32Å
622	T	92	Very high	89.7	Confident	31 Å²	31	61.7 Å²	61.7	19%	0.19	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	141.1	174.4	46.8	0	0	0	0	111	S568 C569 P572 N615	S568-T622 WeakPolarHBondContact CA-O 3.25Å; C569-T622 PolarHBondContact N-O 3.41Å; C569-T622 PolarHBondContact O-N 2.78Å; C569-T622 PolarHBondContact O-OG1 3.2Å; C569-T622 PolarHBondContact SG-O 3.43Å; P572-T622 VanDerWaalsContact CA-OG1 3.32Å; P572-T622 WeakPolarHBondContact CA-OG1 3.14Å; P572-T622 WeakPolarHBondContact CB-OG1 3.3Å; P572-T622 HydrophobicContact CG-CG2 4.21Å; P572-T622 WeakPolarHBondContact CG-OG1 3.4Å; N615-T622 WeakPolarHBondContact O-CA 3.41Å
623	K	91.9	Very high	89.6	Confident	70 Å²	70	56.4 Å²	56.4	30%	0.304	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	113.7	168.8	-70.9	162.9	-174.3	162.7	0	106.5	S568 N615 D618	S568-K623 WeakPolarHBondContact OG-CE 3.26Å; S568-K623 WeakPolarHBondContact OG-CG 3.27Å; N615-K623 HydrophobicContact CB-CB 4.37Å; N615-K623 PolarHBondContact N-O 2.77Å; N615-K623 PolarHBondContact O-N 3.47Å; D618-K623 WeakPolarHBondContact OD1-CE 3.42Å; D618-K623 IonicContact OD1-NZ 3.41Å; D618-K623 PolarHBondContact OD1-NZ 3.3Å; D618-K623 WeakPolarHBondContact OD2-CE 3Å; D618-K623 IonicContact OD2-NZ 2.71Å; D618-K623 PolarHBondContact OD2-NZ 3.38Å
624	V	93.8	Very high	89.5	Confident	3 Å²	3	55.9 Å²	55.9	2%	0.018	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	124.6	-177.7	-171.4	0	0	0	0	108.6	A565 T566 P572 I575 L612 T614	A565-V624 CarbonylContact C-O 3.58Å; A565-V624 WeakPolarHBondContact CA-O 3.46Å; T566-V624 HydrophobicContact CG2-CB 4.3Å; T566-V624 PolarHBondContact N-O 2.73Å; T566-V624 PolarHBondContact OG1-N 3.49Å; T566-V624 VanDerWaalsContact OG1-N 3.14Å; P572-V624 HydrophobicContact CB-CG2 4.13Å; I575-V624 HydrophobicContact CD1-CB 4.28Å; I575-V624 HydrophobicContact CD1-CG1 3.78Å; I575-V624 HydrophobicContact CG1-CG1 4.17Å; L612-V624 HydrophobicContact CD1-CG1 3.65Å; T614-V624 HydrophobicContact CG2-CG1 4.43Å; T614-V624 HydrophobicContact CG2-CG2 4.44Å
625	L	94.1	Very high	89.4	Confident	37 Å²	37	56.4 Å²	56.4	19%	0.194	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	129.7	175.6	-172.4	70.3	0	0	0	107.8	T563 A565 E613	T563-L625 HydrophobicContact CG2-CD1 3.44Å; T563-L625 VanDerWaalsContact CG2-CD1 3.44Å; T563-L625 HydrophobicContact CG2-CG 4.08Å; A565-L625 HydrophobicContact CB-CD1 3.41Å; A565-L625 VanDerWaalsContact CB-CD1 3.41Å; E613-L625 HydrophobicContact CB-CB 4.28Å; E613-L625 PolarHBondContact N-O 3.31Å; E613-L625 PolarHBondContact O-N 2.71Å
626	S	95	Very high	89.1	Confident	5 Å²	5	56.4 Å²	56.4	4%	0.035	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	133.7	171	-176.3	0	0	0	0	110.3	T563 C564 W577 A610 Q611	T563-S626 CarbonylContact C-O 3.48Å; T563-S626 WeakPolarHBondContact CA-O 3.37Å; C564-S626 PolarHBondContact N-O 2.98Å; C564-S626 PolarHBondContact O-N 3.27Å; W577-S626 PolarHBondContact NE1-OG 3.25Å; A610-S626 WeakPolarHBondContact CB-OG 3.47Å; Q611-S626 CarbonylContact O-C 3.52Å; Q611-S626 WeakPolarHBondContact O-CA 3.31Å; Q611-S626 PolarHBondContact O-OG 2.91Å; Q611-S626 VanDerWaalsContact O-OG 3.07Å
627	T	94.8	Very high	89	Confident	19 Å²	19	50.1 Å²	50.1	12%	0.117	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	112.7	-174.7	-59.1	0	0	0	0	109.7	E561 L562 T563 A610 Q611 I629	E561-T627 HydrophobicContact CG-CG2 3.6Å; L562-T627 WeakPolarHBondContact O-CA 3.1Å; T563-T627 WeakPolarHBondContact OG1-CG2 3.45Å; T563-T627 PolarHBondContact OG1-OG1 2.83Å; A610-T627 CarbonylContact C-O 3.6Å; A610-T627 WeakPolarHBondContact CA-O 3.41Å; Q611-T627 PolarHBondContact N-O 2.8Å; Q611-T627 PolarHBondContact O-N 3.15Å; T627-I629 HydrophobicContact CG2-CG1 4.05Å
628	L	94.1	Very high	89	Confident	4 Å²	4	51.4 Å²	51.4	2%	0.021	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	123.5	173.1	176.8	65.7	0	0	0	108.9	L562 W577 L606 L609 A610 Y642	L562-L628 HydrophobicContact CB-CB 4.4Å; L562-L628 PolarHBondContact N-O 2.92Å; L562-L628 PolarHBondContact O-N 2.93Å; W577-L628 HydrophobicContact CB-CD2 4.19Å; W577-L628 HydrophobicContact CD2-CB 3.98Å; W577-L628 HydrophobicContact CD2-CD2 4Å; W577-L628 HydrophobicContact CE3-CB 4.33Å; W577-L628 HydrophobicContact CE3-CD2 3.91Å; W577-L628 HydrophobicContact CG-CB 4.35Å; W577-L628 HydrophobicContact CG-CD2 4.16Å; W577-L628 HydrophobicContact CH2-CB 4.44Å; W577-L628 HydrophobicContact CZ2-CB 4.13Å; L606-L628 HydrophobicContact CB-CD1 4.24Å; L606-L628 HydrophobicContact CB-CD2 4.35Å; L606-L628 HydrophobicContact CD1-CD2 4.08Å; L609-L628 HydrophobicContact CB-CD1 4.11Å; A610-L628 HydrophobicContact CB-CB 4.24Å; A610-L628 HydrophobicContact CB-CD1 4.41Å; L628-Y642 HydrophobicContact CD2-CD1 4.27Å
629	I	91.8	Very high	89	Confident	71 Å²	71	52.1 Å²	52.1	36%	0.364	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	116.8	-180	-55.3	177.4	0	0	0	109	E561 T627	E561-I629 HydrophobicContact CG-CG1 4.43Å; T627-I629 HydrophobicContact CG2-CG1 4.05Å
630	I	90	Very high	89.1	Confident	22 Å²	22	47 Å²	47	11%	0.113	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	114	174.3	-63	153.4	0	0	0	106.7	R559 L560 L562 T633 Y642	R559-I630 CarbonylContact C-O 3.57Å; R559-I630 WeakPolarHBondContact CA-O 3.15Å; L560-I630 HydrophobicContact CB-CB 4.24Å; L560-I630 HydrophobicContact CD2-CD1 3.92Å; L560-I630 HydrophobicContact CG-CD1 4.31Å; L560-I630 PolarHBondContact N-O 2.85Å; L560-I630 PolarHBondContact O-N 3.44Å; L562-I630 HydrophobicContact CD1-CD1 4.05Å; I630-T633 HydrophobicContact CG2-CG2 4.42Å; I630-Y642 HydrophobicContact CD1-CD1 4.25Å; I630-Y642 HydrophobicContact CD1-CD2 4.08Å; I630-Y642 HydrophobicContact CD1-CE1 3.81Å; I630-Y642 HydrophobicContact CD1-CE2 3.61Å; I630-Y642 HydrophobicContact CD1-CG 4.39Å; I630-Y642 VanDerWaalsContact CD1-CZ 3.49Å
631	T	86.4	Confident	89.5	Confident	100 Å²	100	44.8 Å²	44.8	61%	0.613	23%	0.227	S	C	*	.			trans	-80.5	-29.4	-167.1	50.7	0	0	0	0	114.5
632	K	85.7	Confident	89.6	Confident	95 Å²	95	44.8 Å²	44.8	41%	0.413	23%	0.226	S	C	.	.			trans	-140.1	138.5	175.7	-61.9	179.6	-174.2	173	0	109.9	Y634	K632-Y634 HydrophobicContact CB-CE2 4.15Å; K632-Y634 WeakPolarHBondContact CD-OH 3.34Å
633	T	88.4	Confident	89.6	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.22	C	C	.	.			trans	-108.4	154.3	169.2	57.2	0	0	0	0	110.8	V554 P555 A557 G558 I630 L661	V554-T633 HydrophobicContact CB-CG2 4.29Å; V554-T633 HydrophobicContact CG1-CG2 3.9Å; P555-T633 PolarHBondContact O-OG1 2.81Å; A557-T633 VanDerWaalsContact CA-O 3.28Å; A557-T633 WeakPolarHBondContact CA-O 3.14Å; A557-T633 PolarHBondContact N-O 2.84Å; G558-T633 PolarHBondContact O-N 2.89Å; G558-T633 PolarHBondContact O-OG1 2.84Å; I630-T633 HydrophobicContact CG2-CG2 4.42Å; T633-L661 HydrophobicContact CG2-CD1 4.47Å; T633-L661 HydrophobicContact CG2-CD2 4.18Å
634	Y	88	Confident	89.7	Confident	91 Å²	91	40.6 Å²	40.6	36%	0.357	21%	0.206	S	C	.	.			trans	-137.6	153.1	177.6	-60.4	-81.7	0	0	0	109.6	K632 S636 H637 I663	K632-Y634 HydrophobicContact CB-CE2 4.15Å; K632-Y634 WeakPolarHBondContact CD-OH 3.34Å; Y634-S636 PolarHBondContact O-N 2.96Å; Y634-H637 AromaticContact CD2-CE1 3.84Å; Y634-H637 WeakPolarHBondContact O-CB 3.42Å; Y634-H637 PolarHBondContact O-N 3.26Å; Y634-I663 WeakPolarHBondContact O-CD1 3.01Å
635	R	86.3	Confident	89.6	Confident	100 Å²	100	41.9 Å²	41.9	38%	0.377	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-47.8	-31.3	177.3	-76.7	165.1	-145.3	-138.4	-1.6	114.7	E556 H637 Q638 Y665	E556-R635 VanDerWaalsContact CD-NE 3.29Å; E556-R635 WeakPolarHBondContact OE1-CD 3.21Å; E556-R635 VanDerWaalsContact OE1-CG 3.25Å; E556-R635 WeakPolarHBondContact OE1-CG 3.24Å; E556-R635 PolarHBondContact OE1-N 3.5Å; E556-R635 IonicContact OE1-NE 3.47Å; E556-R635 PolarHBondContact OE1-NE 3.44Å; E556-R635 VanDerWaalsContact OE1-NE 3.1Å; E556-R635 IonicContact OE2-CZ 2.93Å; E556-R635 IonicContact OE2-NE 2.65Å; E556-R635 PolarHBondContact OE2-NE 2.85Å; E556-R635 IonicContact OE2-NH2 2.77Å; E556-R635 PolarHBondContact OE2-NH2 2.93Å; R635-H637 PolarHBondContact O-N 3.33Å; R635-Q638 VanDerWaalsContact O-CB 3.31Å; R635-Q638 WeakPolarHBondContact O-CB 3.44Å; R635-Q638 PolarHBondContact O-N 3.32Å; R635-Y665 HydrophobicContact CG-CD1 3.69Å; R635-Y665 HydrophobicContact CG-CD2 4.4Å; R635-Y665 HydrophobicContact CG-CE1 3.89Å; R635-Y665 HydrophobicContact CG-CG 3.97Å
636	S	82.4	Confident	89.6	Confident	84 Å²	84	40.1 Å²	40.1	59%	0.587	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-63.3	-22.5	174.8	49.2	0	0	0	0	114.8	Y634 Q638	Y634-S636 PolarHBondContact O-N 2.96Å; S636-Q638 VanDerWaalsContact C-N 3.3Å
637	H	85.3	Confident	89.4	Confident	55 Å²	55	43.2 Å²	43.2	26%	0.255	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-89.2	6.9	179	-57	-176.8	0	0	0	112.4	Y634 R635 N639 T640 L661 I663	Y634-H637 AromaticContact CD2-CE1 3.84Å; Y634-H637 WeakPolarHBondContact O-CB 3.42Å; Y634-H637 PolarHBondContact O-N 3.26Å; R635-H637 PolarHBondContact O-N 3.33Å; H637-N639 PolarHBondContact O-N 2.77Å; H637-T640 WeakPolarHBondContact CA-OG1 3.45Å; H637-T640 VanDerWaalsContact O-CB 3.29Å; H637-T640 WeakPolarHBondContact O-CB 3.18Å; H637-T640 PolarHBondContact O-N 3.08Å; H637-T640 VanDerWaalsContact O-N 3.09Å; H637-T640 PolarHBondContact O-OG1 2.78Å; H637-L661 HydrophobicContact CB-CD2 3.95Å; H637-I663 VanDerWaalsContact C-CD1 3.44Å; H637-I663 HydrophobicContact CB-CD1 3.66Å
638	Q	85.1	Confident	89.3	Confident	39 Å²	39	42.6 Å²	42.6	18%	0.182	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	131.5	176.8	177.4	59	47.8	0	0	110.2	R635 S636 T640 L661 N694	R635-Q638 VanDerWaalsContact O-CB 3.31Å; R635-Q638 WeakPolarHBondContact O-CB 3.44Å; R635-Q638 PolarHBondContact O-N 3.32Å; S636-Q638 VanDerWaalsContact C-N 3.3Å; Q638-T640 PolarHBondContact O-N 2.73Å; Q638-L661 PolarHBondContact NE2-O 3.34Å; Q638-N694 PolarHBondContact OE1-ND2 3.05Å; Q638-N694 VanDerWaalsContact OE1-ND2 3.08Å
639	N	85	Confident	89	Confident	96 Å²	96	47.1 Å²	47.1	51%	0.513	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	11.2	-173.5	-52.7	-31.8	0	0	0	115.5	I585 H637 I641 L661	I585-N639 WeakPolarHBondContact CD1-O 3.42Å; H637-N639 PolarHBondContact O-N 2.77Å; N639-I641 PolarHBondContact O-N 2.91Å; N639-L661 PolarHBondContact N-O 3.09Å
640	T	89.4	Confident	88.4	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.012	24%	0.241	C	C	.	.			trans	-55.8	134.4	166.2	-65.8	0	0	0	0	109.7	E579 P582 H637 Q638 Y642 L661	E579-T640 HydrophobicContact CG-CG2 3.79Å; P582-T640 WeakPolarHBondContact CD-OG1 3.48Å; H637-T640 WeakPolarHBondContact CA-OG1 3.45Å; H637-T640 VanDerWaalsContact O-CB 3.29Å; H637-T640 WeakPolarHBondContact O-CB 3.18Å; H637-T640 PolarHBondContact O-N 3.08Å; H637-T640 VanDerWaalsContact O-N 3.09Å; H637-T640 PolarHBondContact O-OG1 2.78Å; Q638-T640 PolarHBondContact O-N 2.73Å; T640-Y642 HydrophobicContact CG2-CD2 4.28Å; T640-Y642 HydrophobicContact CG2-CE1 4.26Å; T640-Y642 HydrophobicContact CG2-CE2 3.65Å; T640-L661 WeakPolarHBondContact O-CB 3.32Å; T640-L661 PolarHBondContact O-N 3.48Å
641	I	90.5	Very high	88.1	Confident	13 Å²	13	45.8 Å²	45.8	7%	0.067	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	120.6	178.4	-50.3	-175	0	0	0	109.4	I580 I585 N639 Q643 E658 H659 R660	I580-I641 HydrophobicContact CB-CB 4.34Å; I580-I641 PolarHBondContact N-O 2.85Å; I580-I641 PolarHBondContact O-N 2.92Å; I585-I641 HydrophobicContact CD1-CD1 3.87Å; I585-I641 HydrophobicContact CD1-CG1 3.84Å; N639-I641 PolarHBondContact O-N 2.91Å; I641-Q643 HydrophobicContact CG2-CG 3.8Å; I641-E658 HydrophobicContact CG2-CB 3.77Å; I641-E658 HydrophobicContact CG2-CG 4.33Å; I641-H659 WeakPolarHBondContact CA-O 3.47Å; I641-R660 HydrophobicContact CD1-CG 4.48Å; I641-R660 HydrophobicContact CG1-CG 4.19Å
642	Y	92.1	Very high	87.8	Confident	3 Å²	3	49.4 Å²	49.4	1%	0.012	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	125.2	169.4	-66.3	-76.5	0	0	0	109.2	L562 L578 E579 L606 L628 I630 T640 E658 H659 L661	L562-Y642 VanDerWaalsContact CD1-CB 3.42Å; L562-Y642 HydrophobicContact CD1-CD1 4.29Å; L562-Y642 HydrophobicContact CD1-CD2 3.75Å; L562-Y642 HydrophobicContact CD1-CG 3.54Å; L578-Y642 WeakPolarHBondContact O-CA 3.33Å; E579-Y642 HydrophobicContact CB-CD1 4Å; E579-Y642 HydrophobicContact CB-CE1 3.74Å; E579-Y642 HydrophobicContact CG-CD1 4.23Å; E579-Y642 HydrophobicContact CG-CE1 3.59Å; E579-Y642 WeakPolarHBondContact OE1-CE1 3.33Å; E579-Y642 VanDerWaalsContact OE1-CZ 3.31Å; E579-Y642 PolarHBondContact OE1-OH 3.49Å; L606-Y642 HydrophobicContact CD1-CD1 4.26Å; L606-Y642 HydrophobicContact CD1-CE1 3.85Å; L628-Y642 HydrophobicContact CD2-CD1 4.27Å; I630-Y642 HydrophobicContact CD1-CD1 4.25Å; I630-Y642 HydrophobicContact CD1-CD2 4.08Å; I630-Y642 HydrophobicContact CD1-CE1 3.81Å; I630-Y642 HydrophobicContact CD1-CE2 3.61Å; I630-Y642 HydrophobicContact CD1-CG 4.39Å; I630-Y642 VanDerWaalsContact CD1-CZ 3.49Å; T640-Y642 HydrophobicContact CG2-CD2 4.28Å; T640-Y642 HydrophobicContact CG2-CE1 4.26Å; T640-Y642 HydrophobicContact CG2-CE2 3.65Å; Y642-E658 WeakPolarHBondContact O-CA 3.4Å; Y642-H659 PolarHBondContact N-O 3.29Å; Y642-H659 PolarHBondContact O-N 3.25Å; Y642-L661 HydrophobicContact CE2-CB 4.33Å; Y642-L661 HydrophobicContact CE2-CD2 4Å
643	Q	91.7	Very high	87.6	Confident	14 Å²	14	52.4 Å²	52.4	7%	0.065	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	118.9	-176.7	-57	-168.7	-35.7	0	0	110.2	L578 I580 I641 L656 S657 E658	L578-Q643 HydrophobicContact CB-CB 4.36Å; L578-Q643 PolarHBondContact N-O 3.32Å; L578-Q643 PolarHBondContact O-N 3.21Å; I580-Q643 HydrophobicContact CD1-CG 4.37Å; I641-Q643 HydrophobicContact CG2-CG 3.8Å; Q643-L656 HydrophobicContact CB-CD2 4.08Å; Q643-L656 HydrophobicContact CB-CG 4.3Å; Q643-L656 HydrophobicContact CG-CD2 4.11Å; Q643-S657 CarbonylContact C-O 3.52Å; Q643-S657 WeakPolarHBondContact CA-O 3.29Å; Q643-E658 HydrophobicContact CG-CB 3.93Å; Q643-E658 PolarHBondContact NE2-OE2 3.02Å
644	C	93.6	Very high	87.3	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	116.1	165.6	175.8	0	0	0	0	108.7	L546 C564 I575 W577 L656 S657	L546-C644 HydrophobicContact CD1-CB 4.44Å; L546-C644 HydrophobicContact CD2-CB 4.48Å; C564-C644 HydrophobicContact CB-CB 3.71Å; C564-C644 WeakPolarHBondContact CB-SG 3.31Å; C564-C644 WeakPolarHBondContact SG-CB 3.43Å; C564-C644 CovalentContact SG-SG 2.03Å; C564-C644 PolarHBondContact SG-SG 2.9Å; I575-C644 VanDerWaalsContact CG2-SG 3.59Å; W577-C644 HydrophobicContact CE3-CB 4.28Å; W577-C644 HydrophobicContact CH2-CB 4.26Å; W577-C644 HydrophobicContact CZ3-CB 4.04Å; C644-L656 WeakPolarHBondContact O-CA 3.26Å; C644-S657 PolarHBondContact N-O 2.67Å; C644-S657 PolarHBondContact O-N 2.83Å
645	L	92	Very high	87.3	Confident	30 Å²	30	54 Å²	54	16%	0.157	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	107.5	176.9	-176.1	76.5	0	0	0	109.2	R576 P654 L656	R576-L645 HydrophobicContact CB-CB 4.28Å; R576-L645 PolarHBondContact N-O 2.91Å; R576-L645 PolarHBondContact O-N 2.76Å; L645-P654 HydrophobicContact CD1-CB 3.73Å; L645-P654 HydrophobicContact CD1-CG 3.89Å; L645-P654 HydrophobicContact CG-CB 4.09Å; L645-L656 HydrophobicContact CD1-CB 4.26Å; L645-L656 HydrophobicContact CD1-CD1 4.24Å; L645-L656 HydrophobicContact CD1-CG 4.42Å
646	V	93.2	Very high	87.2	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	123.8	179.6	-174.8	0	0	0	0	110	I544 T566 A573 I575 M651 P654 V655	I544-V646 HydrophobicContact CD1-CB 3.78Å; I544-V646 HydrophobicContact CD1-CG1 3.81Å; I544-V646 HydrophobicContact CD1-CG2 4.1Å; I544-V646 HydrophobicContact CG1-CB 4.46Å; I544-V646 HydrophobicContact CG1-CG1 4.31Å; I544-V646 HydrophobicContact CG1-CG2 4.33Å; I544-V646 HydrophobicContact CG2-CG2 3.69Å; T566-V646 HydrophobicContact CG2-CG1 3.82Å; T566-V646 HydrophobicContact CG2-CG2 4.47Å; A573-V646 HydrophobicContact CB-CG1 3.93Å; I575-V646 HydrophobicContact CG1-CG2 4.3Å; V646-M651 HydrophobicContact CG1-CE 4.3Å; V646-M651 VanDerWaalsContact O-CE 3.3Å; V646-M651 WeakPolarHBondContact O-CE 3.43Å; V646-P654 CarbonylContact O-C 3.6Å; V646-P654 VanDerWaalsContact O-CA 3.23Å; V646-P654 WeakPolarHBondContact O-CA 3.46Å; V646-P654 WeakPolarHBondContact O-CB 3.18Å; V646-V655 PolarHBondContact N-O 2.85Å; V646-V655 PolarHBondContact O-N 3.07Å
647	N	91.6	Very high	87.5	Confident	69 Å²	69	50.4 Å²	50.4	37%	0.369	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	141.4	178.9	-170.3	35	0	0	0	111.2	V574 P654	V574-N647 PolarHBondContact N-O 3.36Å; V574-N647 PolarHBondContact O-N 2.75Å; N647-P654 HydrophobicContact CB-CB 4.24Å
648	H	91.8	Very high	87.7	Confident	7 Å²	7	51.5 Å²	51.5	3%	0.032	28%	0.282	C	S	.	.			trans	-152.5	145.6	-179.5	-178.5	-92.1	0	0	0	109.8	F539 H570 P571 A573 G650 M651	F539-H648 VanDerWaalsContact C-CE1 3.47Å; F539-H648 PolarHBondContact O-CE1 3.09Å; F539-H648 PolarHBondContact O-NE2 3.4Å; H570-H648 PolarHBondContact O-CE1 3.41Å; H570-H648 PolarHBondContact O-NE2 2.8Å; H570-H648 VanDerWaalsContact O-NE2 3.17Å; P571-H648 PolarHBondContact O-CD2 3.39Å; P571-H648 PolarHBondContact O-NE2 2.81Å; A573-H648 HydrophobicContact CB-CB 4.35Å; H648-G650 PolarHBondContact ND1-N 3.03Å; H648-G650 PolarHBondContact O-N 2.79Å; H648-M651 HydrophobicContact CB-CE 3.78Å; H648-M651 HydrophobicContact CB-CG 4.07Å; H648-M651 HydrophobicContact CB-SD 4.48Å; H648-M651 PolarHBondContact O-N 2.84Å
649	T	87.6	Confident	87.9	Confident	98 Å²	98	51.6 Å²	51.6	60%	0.601	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.6	-174.8	47.4	0	0	0	0	114	M538 P571	M538-T649 PolarHBondContact SD-OG1 2.93Å; P571-T649 WeakPolarHBondContact CD-OG1 3.29Å; P571-T649 WeakPolarHBondContact CG-OG1 3.5Å
650	G	80.9	Confident	88.2	Confident	33 Å²	33	54.6 Å²	54.6	34%	0.34	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	4.9	172.4	0	0	0	0	0	114.9	H648	H648-G650 PolarHBondContact ND1-N 3.03Å; H648-G650 PolarHBondContact O-N 2.79Å
651	M	83.9	Confident	88.2	Confident	32 Å²	32	54.6 Å²	54.6	16%	0.158	29%	0.286	C	S	.	.			trans	-110	126.8	178.4	-63.6	-163.5	-57.6	0	0	111.9	P541 V646 H648 K653 V655	P541-M651 HydrophobicContact CG-SD 4.48Å; V646-M651 HydrophobicContact CG1-CE 4.3Å; V646-M651 VanDerWaalsContact O-CE 3.3Å; V646-M651 WeakPolarHBondContact O-CE 3.43Å; H648-M651 HydrophobicContact CB-CE 3.78Å; H648-M651 HydrophobicContact CB-CG 4.07Å; H648-M651 HydrophobicContact CB-SD 4.48Å; H648-M651 PolarHBondContact O-N 2.84Å; M651-K653 PolarHBondContact O-N 2.86Å; M651-V655 HydrophobicContact CE-CG2 4.17Å; M651-V655 HydrophobicContact SD-CG2 3.81Å
652	N	79.5	Confident	88.2	Confident	177 Å²	177	57.9 Å²	57.9	95%	0.947	30%	0.301	S	S	*	.	S	Bend	trans	-65.9	-20.6	-179.9	-69.7	-32.4	0	0	0	114.2
653	K	80.6	Confident	88.1	Confident	158 Å²	158	57.7 Å²	57.7	69%	0.687	30%	0.301	S	S	*	.	S	Bend	trans	-147.5	148.8	174.5	-66.2	-173.9	-180	-178.2	0	107.9	M651	M651-K653 PolarHBondContact O-N 2.86Å
654	P	83.2	Confident	88	Confident	62 Å²	62	57.8 Å²	57.8	40%	0.403	30%	0.301	S	S	.	.			trans	-64.3	144.2	170.3	30.1	-35.7	0	0	0	110.2	L645 V646 N647	L645-P654 HydrophobicContact CD1-CB 3.73Å; L645-P654 HydrophobicContact CD1-CG 3.89Å; L645-P654 HydrophobicContact CG-CB 4.09Å; V646-P654 CarbonylContact O-C 3.6Å; V646-P654 VanDerWaalsContact O-CA 3.23Å; V646-P654 WeakPolarHBondContact O-CA 3.46Å; V646-P654 WeakPolarHBondContact O-CB 3.18Å; N647-P654 HydrophobicContact CB-CB 4.24Å
655	V	86.7	Confident	87.7	Confident	62 Å²	62	60.2 Å²	60.2	38%	0.376	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	138.4	173.6	175.2	0	0	0	0	108.3	I544 V646 M651	I544-V655 HydrophobicContact CD1-CB 3.65Å; I544-V655 HydrophobicContact CD1-CG1 3.76Å; I544-V655 HydrophobicContact CD1-CG2 4.07Å; V646-V655 PolarHBondContact N-O 2.85Å; V646-V655 PolarHBondContact O-N 3.07Å; M651-V655 HydrophobicContact CE-CG2 4.17Å; M651-V655 HydrophobicContact SD-CG2 3.81Å
656	L	86	Confident	87.4	Confident	72 Å²	72	60 Å²	60	38%	0.377	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	127.4	-177.7	-168.7	158.7	0	0	0	108.8	Q643 C644 L645 E658	Q643-L656 HydrophobicContact CB-CD2 4.08Å; Q643-L656 HydrophobicContact CB-CG 4.3Å; Q643-L656 HydrophobicContact CG-CD2 4.11Å; C644-L656 WeakPolarHBondContact O-CA 3.26Å; L645-L656 HydrophobicContact CD1-CB 4.26Å; L645-L656 HydrophobicContact CD1-CD1 4.24Å; L645-L656 HydrophobicContact CD1-CG 4.42Å; L656-E658 HydrophobicContact CD2-CB 4.3Å
657	S	87.4	Confident	87.2	Confident	36 Å²	36	60.1 Å²	60.1	25%	0.252	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	131.8	171.9	-166.4	0	0	0	0	108.7	L546 Q643 C644	L546-S657 VanDerWaalsContact CB-OG 3.31Å; L546-S657 WeakPolarHBondContact CB-OG 3.45Å; Q643-S657 CarbonylContact C-O 3.52Å; Q643-S657 WeakPolarHBondContact CA-O 3.29Å; C644-S657 PolarHBondContact N-O 2.67Å; C644-S657 PolarHBondContact O-N 2.83Å
658	E	90	Very high	87	Confident	78 Å²	78	60.1 Å²	60.1	36%	0.364	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	143.2	-177.3	73.4	171	-140.8	0	0	112.9	I641 Y642 Q643 L656 R660	I641-E658 HydrophobicContact CG2-CB 3.77Å; I641-E658 HydrophobicContact CG2-CG 4.33Å; Y642-E658 WeakPolarHBondContact O-CA 3.4Å; Q643-E658 HydrophobicContact CG-CB 3.93Å; Q643-E658 PolarHBondContact NE2-OE2 3.02Å; L656-E658 HydrophobicContact CD2-CB 4.3Å; E658-R660 IonicContact OE1-CZ 3.56Å; E658-R660 VanDerWaalsContact OE1-CZ 3.27Å; E658-R660 IonicContact OE1-NE 3.53Å; E658-R660 PolarHBondContact OE1-NE 2.88Å; E658-R660 IonicContact OE1-NH2 2.64Å; E658-R660 PolarHBondContact OE1-NH2 2.89Å
659	H	89.9	Confident	87	Confident	41 Å²	41	61 Å²	61	19%	0.19	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	138	168.6	176.6	77.4	0	0	0	109	L546 A548 L562 I641 Y642	L546-H659 HydrophobicContact CD2-CB 3.85Å; L546-H659 HydrophobicContact CG-CB 4.46Å; A548-H659 VanDerWaalsContact CB-CE1 3.42Å; A548-H659 WeakPolarHBondContact CB-CE1 3.39Å; L562-H659 HydrophobicContact CD2-CB 4.33Å; I641-H659 WeakPolarHBondContact CA-O 3.47Å; Y642-H659 PolarHBondContact N-O 3.29Å; Y642-H659 PolarHBondContact O-N 3.25Å
660	R	90.8	Very high	87.1	Confident	159 Å²	159	59.7 Å²	59.7	60%	0.6	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.5	120.1	-178	-57.8	-170.2	176.6	-161.9	-3.3	109.2	I641 E658 Q662	I641-R660 HydrophobicContact CD1-CG 4.48Å; I641-R660 HydrophobicContact CG1-CG 4.19Å; E658-R660 IonicContact OE1-CZ 3.56Å; E658-R660 VanDerWaalsContact OE1-CZ 3.27Å; E658-R660 IonicContact OE1-NE 3.53Å; E658-R660 PolarHBondContact OE1-NE 2.88Å; E658-R660 IonicContact OE1-NH2 2.64Å; E658-R660 PolarHBondContact OE1-NH2 2.89Å; R660-Q662 PolarHBondContact O-N 2.88Å
661	L	90	Very high	87.7	Confident	2 Å²	2	59 Å²	59	1%	0.01	30%	0.297	C	S	.	.			trans	-72.9	115.1	-175.7	177.1	47.4	0	0	0	111.3	V554 L560 T633 H637 Q638 N639 T640 Y642 I663	V554-L661 HydrophobicContact CB-CD1 4.31Å; V554-L661 HydrophobicContact CG2-CD1 3.77Å; L560-L661 HydrophobicContact CD2-CD1 3.88Å; T633-L661 HydrophobicContact CG2-CD1 4.47Å; T633-L661 HydrophobicContact CG2-CD2 4.18Å; H637-L661 HydrophobicContact CB-CD2 3.95Å; Q638-L661 PolarHBondContact NE2-O 3.34Å; N639-L661 PolarHBondContact N-O 3.09Å; T640-L661 WeakPolarHBondContact O-CB 3.32Å; T640-L661 PolarHBondContact O-N 3.48Å; Y642-L661 HydrophobicContact CE2-CB 4.33Å; Y642-L661 HydrophobicContact CE2-CD2 4Å; L661-I663 HydrophobicContact CD1-CD1 4.45Å; L661-I663 HydrophobicContact CD1-CG1 3.79Å; L661-I663 HydrophobicContact CD2-CD1 3.93Å; L661-I663 HydrophobicContact CD2-CG1 4.17Å; L661-I663 HydrophobicContact CG-CD1 3.91Å; L661-I663 HydrophobicContact CG-CG1 3.65Å
662	Q	89.5	Confident	88	Confident	82 Å²	82	60.2 Å²	60.2	38%	0.383	30%	0.304	S	S	.	.			trans	-101.5	128.2	165.7	-176.7	171.8	1.8	0	0	109.7	G553 V554 R660	G553-Q662 CarbonylContact C-O 3.58Å; G553-Q662 WeakPolarHBondContact CA-O 3.46Å; V554-Q662 PolarHBondContact N-O 3.39Å; R660-Q662 PolarHBondContact O-N 2.88Å
663	I	90	Very high	88.4	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	118.4	-173.4	-54.6	-180	0	0	0	108.8	V554 E556 Y634 H637 L661 Y665 N694	V554-I663 CarbonylContact O-C 3.44Å; V554-I663 VanDerWaalsContact O-CA 3.27Å; V554-I663 WeakPolarHBondContact O-CA 3.36Å; E556-I663 HydrophobicContact CB-CG2 4.4Å; Y634-I663 WeakPolarHBondContact O-CD1 3.01Å; H637-I663 VanDerWaalsContact C-CD1 3.44Å; H637-I663 HydrophobicContact CB-CD1 3.66Å; L661-I663 HydrophobicContact CD1-CD1 4.45Å; L661-I663 HydrophobicContact CD1-CG1 3.79Å; L661-I663 HydrophobicContact CD2-CD1 3.93Å; L661-I663 HydrophobicContact CD2-CG1 4.17Å; L661-I663 HydrophobicContact CG-CD1 3.91Å; L661-I663 HydrophobicContact CG-CG1 3.65Å; I663-Y665 VanDerWaalsContact O-CD1 3.24Å; I663-Y665 WeakPolarHBondContact O-CD1 3.42Å; I663-N694 WeakPolarHBondContact O-CB 3.44Å; I663-N694 PolarHBondContact O-ND2 3.42Å
664	L	89.4	Confident	88.8	Confident	15 Å²	15	48.9 Å²	48.9	8%	0.079	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	128.5	-177.2	-51.1	170	0	0	0	108.6	V554 P555 E556 N694 I791	V554-L664 PolarHBondContact O-N 2.72Å; P555-L664 CarbonylContact C-O 3.46Å; P555-L664 WeakPolarHBondContact CA-O 3.36Å; E556-L664 PolarHBondContact N-O 3.11Å; L664-N694 WeakPolarHBondContact CA-O 3.06Å; L664-I791 HydrophobicContact CD1-CG2 4.25Å
665	Y	87.7	Confident	88.9	Confident	51 Å²	51	48.2 Å²	48.2	20%	0.2	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-149.9	149.3	178.9	55.4	-94.6	0	0	0	110.5	R635 I663 G693 N694	R635-Y665 HydrophobicContact CG-CD1 3.69Å; R635-Y665 HydrophobicContact CG-CD2 4.4Å; R635-Y665 HydrophobicContact CG-CE1 3.89Å; R635-Y665 HydrophobicContact CG-CG 3.97Å; I663-Y665 VanDerWaalsContact O-CD1 3.24Å; I663-Y665 WeakPolarHBondContact O-CD1 3.42Å; Y665-G693 WeakPolarHBondContact O-CA 3.39Å; Y665-N694 HydrophobicContact CD1-CB 3.81Å; Y665-N694 HydrophobicContact CE1-CB 3.41Å; Y665-N694 VanDerWaalsContact CE1-CB 3.41Å; Y665-N694 HydrophobicContact CE2-CB 4.21Å; Y665-N694 HydrophobicContact CG-CB 4.36Å; Y665-N694 PolarHBondContact N-O 3.17Å; Y665-N694 PolarHBondContact O-N 2.84Å
666	P	86.2	Confident	88.7	Confident	27 Å²	27	51.1 Å²	51.1	18%	0.175	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-75.1	158.3	-177.2	33.1	-35.7	0	0	0	111.1	G792	P666-G792 VanDerWaalsContact CD-O 3.3Å; P666-G792 WeakPolarHBondContact CD-O 3.38Å
667	P	87.8	Confident	88.6	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.006	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-67.3	153.6	174.7	30	-35.8	0	0	0	111.8	I669 A690 L699 V788 S795	P667-I669 HydrophobicContact CG-CG1 4.45Å; P667-A690 HydrophobicContact CB-CB 3.94Å; P667-A690 HydrophobicContact CG-CB 4.41Å; P667-L699 HydrophobicContact CB-CD1 4.41Å; P667-L699 HydrophobicContact CG-CD1 4.44Å; P667-L699 HydrophobicContact CG-CD2 4.06Å; P667-V788 HydrophobicContact CG-CB 4.11Å; P667-V788 HydrophobicContact CG-CG1 3.94Å; P667-S795 WeakPolarHBondContact O-CB 3.37Å; P667-S795 PolarHBondContact O-OG 2.77Å
668	S	87.8	Confident	88.4	Confident	69 Å²	69	51.7 Å²	51.7	48%	0.483	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	129.9	164.2	-62.2	0	0	0	0	108.6	A690 I691	S668-A690 CarbonylContact O-C 3.59Å; S668-I691 PolarHBondContact N-O 2.81Å; S668-I691 PolarHBondContact O-N 2.96Å
669	I	91.3	Very high	88.2	Confident	26 Å²	26	51.4 Å²	51.4	13%	0.133	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	140.9	-173.5	-54	160.9	0	0	0	110.8	P667 C688 Q689 V788 S795 A797	P667-I669 HydrophobicContact CG-CG1 4.45Å; I669-C688 WeakPolarHBondContact CG2-SG 3.47Å; I669-Q689 WeakPolarHBondContact CA-O 3.48Å; I669-V788 HydrophobicContact CD1-CB 3.6Å; I669-V788 HydrophobicContact CD1-CG2 3.66Å; I669-V788 HydrophobicContact CG1-CB 4.08Å; I669-V788 HydrophobicContact CG1-CG2 3.96Å; I669-V788 HydrophobicContact CG2-CG2 4.46Å; I669-S795 VanDerWaalsContact CD1-CB 3.4Å; I669-S795 WeakPolarHBondContact CD1-O 2.99Å; I669-A797 HydrophobicContact CB-CB 4.05Å; I669-A797 HydrophobicContact CG2-CB 3.69Å
670	H	91.1	Very high	87.9	Confident	71 Å²	71	50.6 Å²	50.6	33%	0.329	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	155.9	159.2	61.8	94.2	0	0	0	111.4	Q689 I691	H670-Q689 VanDerWaalsContact CE1-CD 3.42Å; H670-Q689 PolarHBondContact CE1-OE1 2.88Å; H670-Q689 PolarHBondContact N-O 2.8Å; H670-Q689 PolarHBondContact O-N 2.82Å; H670-I691 WeakPolarHBondContact NE2-CD1 3.47Å
671	I	92	Very high	87.5	Confident	18 Å²	18	49.9 Å²	49.9	9%	0.092	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	123.7	178.7	-61.6	163.8	0	0	0	109	L686 F687 W703 C786 A797 H799	I671-L686 HydrophobicContact CG2-CB 4.21Å; I671-F687 WeakPolarHBondContact CA-O 3.36Å; I671-W703 HydrophobicContact CD1-CZ3 4.18Å; I671-W703 HydrophobicContact CG1-CH2 4.46Å; I671-W703 HydrophobicContact CG1-CZ3 4.39Å; I671-W703 HydrophobicContact CG2-CH2 4.13Å; I671-W703 HydrophobicContact CG2-CZ3 4.17Å; I671-C786 HydrophobicContact CD1-CB 3.76Å; I671-C786 HydrophobicContact CG1-CB 4Å; I671-A797 HydrophobicContact CD1-CB 4.04Å; I671-A797 WeakPolarHBondContact CD1-O 3.2Å; I671-A797 HydrophobicContact CG1-CB 4.05Å; I671-H799 HydrophobicContact CB-CB 3.88Å; I671-H799 HydrophobicContact CD1-CB 4.08Å; I671-H799 HydrophobicContact CG2-CB 3.76Å; I671-H799 PolarHBondContact O-ND1 3.14Å
672	I	90.4	Very high	87.2	Confident	58 Å²	58	53.4 Å²	53.4	30%	0.297	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	135	172.4	-58.1	175.1	0	0	0	108.6	L674 L686 F687	I672-L674 HydrophobicContact CG2-CD2 4.02Å; I672-L674 HydrophobicContact CG2-CG 4.16Å; I672-L686 CarbonylContact O-C 3.56Å; I672-L686 WeakPolarHBondContact O-CA 3.46Å; I672-F687 PolarHBondContact N-O 3.18Å; I672-F687 PolarHBondContact O-N 2.87Å
673	S	89.6	Confident	87.1	Confident	11 Å²	11	52.7 Å²	52.7	8%	0.077	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	129.3	165.9	47.5	0	0	0	0	110.5	P675 N676 H799	S673-P675 CarbonylContact O-C 3.57Å; S673-N676 WeakPolarHBondContact O-CA 3.04Å; S673-N676 PolarHBondContact O-N 3.22Å; S673-N676 VanDerWaalsContact O-N 3.17Å; S673-N676 PolarHBondContact O-OD1 3.29Å; S673-H799 PolarHBondContact OG-CE1 2.87Å; S673-H799 VanDerWaalsContact OG-CE1 3.28Å; S673-H799 PolarHBondContact OG-NE2 3.17Å
674	L	87.9	Confident	87.1	Confident	86 Å²	86	52.7 Å²	52.7	45%	0.45	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	113.8	175.3	-66.3	176.3	0	0	0	109.2	I672 I685	I672-L674 HydrophobicContact CG2-CD2 4.02Å; I672-L674 HydrophobicContact CG2-CG 4.16Å; L674-I685 HydrophobicContact CB-CB 4.38Å; L674-I685 PolarHBondContact N-O 3.14Å; L674-I685 PolarHBondContact O-N 2.99Å
675	P	86.4	Confident	87.1	Confident	48 Å²	48	55 Å²	55	31%	0.312	29%	0.287	S	S	.	.	S	Bend	cis	-74	157.8	-4.7	34.4	-37.9	0	0	0	113	S673 Q677 P678	S673-P675 CarbonylContact O-C 3.57Å; P675-Q677 PolarHBondContact O-N 3.05Å; P675-Q677 VanDerWaalsContact O-N 3.11Å; P675-P678 HydrophobicContact CG-CB 4.49Å; P675-P678 WeakPolarHBondContact O-CD 3.24Å
676	N	82	Confident	87.3	Confident	122 Å²	122	52.5 Å²	52.5	65%	0.652	28%	0.278	S	S	*	.	S	Bend	trans	-61.3	-20.4	180	-57.5	24.9	0	0	0	114.3	S673	S673-N676 WeakPolarHBondContact O-CA 3.04Å; S673-N676 PolarHBondContact O-N 3.22Å; S673-N676 VanDerWaalsContact O-N 3.17Å; S673-N676 PolarHBondContact O-OD1 3.29Å
677	Q	82.5	Confident	87.6	Confident	116 Å²	116	54.1 Å²	54.1	54%	0.542	28%	0.282	S	S	.	.	S	Bend	trans	-125.1	81.3	173.9	-71.1	-175.6	-17.6	0	0	108.7	P675 Y804	P675-Q677 PolarHBondContact O-N 3.05Å; P675-Q677 VanDerWaalsContact O-N 3.11Å; Q677-Y804 HydrophobicContact CB-CD2 4.06Å; Q677-Y804 HydrophobicContact CB-CE2 3.82Å; Q677-Y804 HydrophobicContact CG-CE2 3.8Å; Q677-Y804 PolarHBondContact NE2-OH 2.89Å
678	P	84.7	Confident	87.8	Confident	4 Å²	4	54 Å²	54	3%	0.026	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-76.9	129.8	-174.1	25.8	-26.6	0	0	0	111.5	P675 V684 L801 D802 L803 Y804	P675-P678 HydrophobicContact CG-CB 4.49Å; P675-P678 WeakPolarHBondContact O-CD 3.24Å; P678-V684 HydrophobicContact CB-CB 4.4Å; P678-V684 HydrophobicContact CB-CG1 4.04Å; P678-V684 HydrophobicContact CB-CG2 3.43Å; P678-V684 VanDerWaalsContact CB-CG2 3.43Å; P678-V684 HydrophobicContact CG-CG1 4.4Å; P678-V684 HydrophobicContact CG-CG2 4.4Å; P678-L801 HydrophobicContact CB-CD1 4.45Å; P678-L801 HydrophobicContact CG-CD1 3.52Å; P678-D802 WeakPolarHBondContact CG-O 3.28Å; P678-L803 HydrophobicContact CB-CD2 4.09Å; P678-L803 HydrophobicContact CG-CD2 4.07Å; P678-Y804 PolarHBondContact O-N 3.18Å
679	I	85.7	Confident	88	Confident	72 Å²	72	54 Å²	54	37%	0.369	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-88.4	142.3	179	-59	170.5	0	0	0	109.3	R681 Q682 Y804 L957	I679-R681 PolarHBondContact O-N 2.82Å; I679-Q682 HydrophobicContact CB-CB 4.39Å; I679-Q682 VanDerWaalsContact N-OE1 3.11Å; I679-Q682 WeakPolarHBondContact O-CB 3.2Å; I679-Q682 PolarHBondContact O-N 2.86Å; I679-Y804 CarbonylContact C-O 3.59Å; I679-Y804 WeakPolarHBondContact CA-O 3.32Å; I679-L957 HydrophobicContact CD1-CD2 3.92Å; I679-L957 HydrophobicContact CG1-CD2 4.23Å
680	A	82.1	Confident	87.8	Confident	24 Å²	24	54 Å²	54	20%	0.198	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	135.2	174.2	0	0	0	0	0	111.4	Q682 L778 Y804	A680-Q682 VanDerWaalsContact C-N 3.27Å; A680-Q682 PolarHBondContact O-N 3.26Å; A680-L778 HydrophobicContact CB-CD2 3.91Å; A680-L778 HydrophobicContact CB-CG 4.35Å; A680-Y804 PolarHBondContact N-O 2.96Å
681	R	82.5	Confident	87.5	Confident	144 Å²	144	54.9 Å²	54.9	54%	0.543	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	0.2	-168	-53.7	-176.5	-178.2	176.2	-0.9	116.8	I679 N775 I776	I679-R681 PolarHBondContact O-N 2.82Å; R681-N775 WeakPolarHBondContact CA-OD1 3.42Å; R681-N775 VanDerWaalsContact CB-OD1 3.3Å; R681-N775 WeakPolarHBondContact CB-OD1 3.32Å; R681-I776 WeakPolarHBondContact CA-O 3.35Å; R681-I776 PolarHBondContact N-O 3.32Å
682	Q	84.6	Confident	86.9	Confident	77 Å²	77	56.1 Å²	56.1	36%	0.36	30%	0.301	S	S	.	.	S	Bend	trans	-71.8	158.9	165.5	-159.2	171.3	3.3	0	0	110.1	I679 A680 I776	I679-Q682 HydrophobicContact CB-CB 4.39Å; I679-Q682 VanDerWaalsContact N-OE1 3.11Å; I679-Q682 WeakPolarHBondContact O-CB 3.2Å; I679-Q682 PolarHBondContact O-N 2.86Å; A680-Q682 VanDerWaalsContact C-N 3.27Å; A680-Q682 PolarHBondContact O-N 3.26Å; Q682-I776 WeakPolarHBondContact O-CG2 3.45Å; Q682-I776 PolarHBondContact O-N 2.88Å
683	S	87.2	Confident	86.4	Confident	67 Å²	67	53.4 Å²	53.4	47%	0.469	29%	0.288	S	S	.	.			trans	-84.9	135.5	162.9	-61.7	0	0	0	0	109.3	L773	S683-L773 CarbonylContact C-O 3.53Å; S683-L773 VanDerWaalsContact CA-O 3.31Å; S683-L773 WeakPolarHBondContact CA-O 3.35Å
684	V	89.2	Confident	86.1	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	135.5	-177.7	-169.3	0	0	0	0	108.7	P678 L686 L773 I776 L801	P678-V684 HydrophobicContact CB-CB 4.4Å; P678-V684 HydrophobicContact CB-CG1 4.04Å; P678-V684 HydrophobicContact CB-CG2 3.43Å; P678-V684 VanDerWaalsContact CB-CG2 3.43Å; P678-V684 HydrophobicContact CG-CG1 4.4Å; P678-V684 HydrophobicContact CG-CG2 4.4Å; V684-L686 HydrophobicContact CG1-CD2 4.24Å; V684-L773 PolarHBondContact N-O 3.37Å; V684-L773 PolarHBondContact O-N 2.78Å; V684-I776 HydrophobicContact CG2-CB 4.47Å; V684-I776 HydrophobicContact CG2-CD1 4.43Å; V684-I776 HydrophobicContact CG2-CG2 3.87Å; V684-L801 HydrophobicContact CG1-CD1 4.2Å
685	I	90.6	Very high	85.8	Confident	62 Å²	62	51.4 Å²	51.4	32%	0.318	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	122.1	172.1	-56.1	-175	0	0	0	107.5	L674 Q770 N772	L674-I685 HydrophobicContact CB-CB 4.38Å; L674-I685 PolarHBondContact N-O 3.14Å; L674-I685 PolarHBondContact O-N 2.99Å; I685-Q770 HydrophobicContact CG2-CB 4.39Å; I685-N772 VanDerWaalsContact CG1-OD1 3.31Å; I685-N772 WeakPolarHBondContact CG1-OD1 3.22Å; I685-N772 WeakPolarHBondContact CG2-OD1 3.11Å
686	L	91.9	Very high	85.3	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	120.6	166.9	-57.5	-175.3	0	0	0	108.2	I671 I672 V684 W703 Q770 L771 L773 Y784 L801	I671-L686 HydrophobicContact CG2-CB 4.21Å; I672-L686 CarbonylContact O-C 3.56Å; I672-L686 WeakPolarHBondContact O-CA 3.46Å; V684-L686 HydrophobicContact CG1-CD2 4.24Å; L686-W703 HydrophobicContact CB-CH2 3.53Å; L686-W703 HydrophobicContact CB-CZ2 4.43Å; L686-W703 HydrophobicContact CB-CZ3 3.74Å; L686-W703 HydrophobicContact CD1-CZ3 4.15Å; L686-W703 WeakPolarHBondContact O-CH2 3.45Å; L686-W703 WeakPolarHBondContact O-CZ2 3.46Å; L686-Q770 WeakPolarHBondContact O-CA 3.49Å; L686-L771 HydrophobicContact CB-CB 4.34Å; L686-L771 HydrophobicContact CD1-CD2 4.43Å; L686-L771 PolarHBondContact N-O 2.03Å; L686-L771 PolarHBondContact O-N 2.84Å; L686-L773 HydrophobicContact CD1-CD1 4.21Å; L686-L773 HydrophobicContact CG-CD1 4.39Å; L686-Y784 HydrophobicContact CD1-CD1 3.96Å; L686-Y784 HydrophobicContact CD1-CD2 4.13Å; L686-Y784 HydrophobicContact CD1-CG 3.68Å; L686-L801 HydrophobicContact CD1-CD2 4.45Å; L686-L801 HydrophobicContact CD2-CD1 4.44Å
687	F	92.7	Very high	84.8	Confident	60 Å²	60	52.8 Å²	52.8	26%	0.263	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	118.5	179.4	-171.4	-91	0	0	0	110	I671 I672 Q689 Q770	I671-F687 WeakPolarHBondContact CA-O 3.36Å; I672-F687 PolarHBondContact N-O 3.18Å; I672-F687 PolarHBondContact O-N 2.87Å; F687-Q689 HydrophobicContact CD1-CB 3.89Å; F687-Q689 HydrophobicContact CE1-CB 3.77Å; F687-Q689 HydrophobicContact CE1-CG 4.2Å; F687-Q689 PolarHBondContact O-N 2.93Å; F687-Q770 HydrophobicContact CD2-CG 3.77Å; F687-Q770 HydrophobicContact CE2-CG 3.96Å
688	C	92.4	Very high	84.5	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	95	178.4	-176.5	0	0	0	0	109.6	I669 A690 Y701 W703 S769 C786	I669-C688 WeakPolarHBondContact CG2-SG 3.47Å; C688-A690 PolarHBondContact O-N 2.93Å; C688-Y701 HydrophobicContact CB-CD1 4.33Å; C688-W703 HydrophobicContact CB-CH2 3.74Å; C688-W703 HydrophobicContact CB-CZ2 3.47Å; C688-W703 VanDerWaalsContact CB-CZ2 3.47Å; C688-S769 PolarHBondContact N-O 3.4Å; C688-C786 HydrophobicContact CB-CB 3.77Å; C688-C786 WeakPolarHBondContact CB-SG 3.07Å; C688-C786 WeakPolarHBondContact SG-CB 3.26Å; C688-C786 CovalentContact SG-SG 2.03Å; C688-C786 PolarHBondContact SG-SG 3.39Å
689	Q	90.2	Very high	84.5	Confident	68 Å²	68	54.8 Å²	54.8	32%	0.318	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	108	-177.4	-173.8	167.1	-15.9	0	0	110.5	I669 H670 F687 I691	I669-Q689 WeakPolarHBondContact CA-O 3.48Å; H670-Q689 VanDerWaalsContact CE1-CD 3.42Å; H670-Q689 PolarHBondContact CE1-OE1 2.88Å; H670-Q689 PolarHBondContact N-O 2.8Å; H670-Q689 PolarHBondContact O-N 2.82Å; F687-Q689 HydrophobicContact CD1-CB 3.89Å; F687-Q689 HydrophobicContact CE1-CB 3.77Å; F687-Q689 HydrophobicContact CE1-CG 4.2Å; F687-Q689 PolarHBondContact O-N 2.93Å; Q689-I691 HydrophobicContact CG-CD1 4.45Å; Q689-I691 HydrophobicContact CG-CG1 4.06Å
690	A	88.8	Confident	84.6	Confident	27 Å²	27	55.1 Å²	55.1	22%	0.223	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	130.8	166.6	0	0	0	0	0	110.3	P667 S668 C688 L699 V788	P667-A690 HydrophobicContact CB-CB 3.94Å; P667-A690 HydrophobicContact CG-CB 4.41Å; S668-A690 CarbonylContact O-C 3.59Å; C688-A690 PolarHBondContact O-N 2.93Å; A690-L699 HydrophobicContact CB-CD1 4.09Å; A690-V788 HydrophobicContact CB-CG1 4.41Å
691	I	83.8	Confident	85.1	Confident	89 Å²	89	56.4 Å²	56.4	46%	0.456	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	123.4	176.4	-58.5	-176.7	0	0	0	108.7	S668 H670 Q689	S668-I691 PolarHBondContact N-O 2.81Å; S668-I691 PolarHBondContact O-N 2.96Å; H670-I691 WeakPolarHBondContact NE2-CD1 3.47Å; Q689-I691 HydrophobicContact CG-CD1 4.45Å; Q689-I691 HydrophobicContact CG-CG1 4.06Å
692	G	79.8	Confident	85.5	Confident	43 Å²	43	50.1 Å²	50.1	44%	0.443	29%	0.287	S	S	.	.			trans	75.7	-142.9	-176.1	0	0	0	0	0	112.6
693	G	79.1	Confident	85.9	Confident	2 Å²	2	46.5 Å²	46.5	2%	0.021	27%	0.27	C	S	.	.			trans	83.1	144.4	-164.2	0	0	0	0	0	112.2	Y665 S696	Y665-G693 WeakPolarHBondContact O-CA 3.39Å; G693-S696 PolarHBondContact O-N 2.55Å; G693-S696 PolarHBondContact O-OG 2.91Å
694	N	84.8	Confident	86.1	Confident	24 Å²	24	44.4 Å²	44.4	13%	0.128	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-137.3	122.8	176.3	-172	17.8	0	0	0	110.6	Q638 I663 L664 Y665	Q638-N694 PolarHBondContact OE1-ND2 3.05Å; Q638-N694 VanDerWaalsContact OE1-ND2 3.08Å; I663-N694 WeakPolarHBondContact O-CB 3.44Å; I663-N694 PolarHBondContact O-ND2 3.42Å; L664-N694 WeakPolarHBondContact CA-O 3.06Å; Y665-N694 HydrophobicContact CD1-CB 3.81Å; Y665-N694 HydrophobicContact CE1-CB 3.41Å; Y665-N694 VanDerWaalsContact CE1-CB 3.41Å; Y665-N694 HydrophobicContact CE2-CB 4.21Å; Y665-N694 HydrophobicContact CG-CB 4.36Å; Y665-N694 PolarHBondContact N-O 3.17Å; Y665-N694 PolarHBondContact O-N 2.84Å
695	P	81.7	Confident	86.2	Confident	31 Å²	31	46.1 Å²	46.1	20%	0.201	26%	0.263	C	S	.	.	S	Bend	cis	-58.9	150.4	-10.7	28.4	-35.8	0	0	0	111.8	N697 I791	P695-N697 VanDerWaalsContact C-N 3.28Å; P695-I791 HydrophobicContact CG-CB 4.34Å; P695-I791 HydrophobicContact CG-CD1 4.12Å; P695-I791 HydrophobicContact CG-CG1 4.39Å
696	S	75.4	Confident	85.9	Confident	75 Å²	75	44.5 Å²	44.5	52%	0.524	26%	0.259	S	S	.	.	S	Bend	trans	-84.1	-9.3	174.4	-39.1	0	0	0	0	112.5	G693	G693-S696 PolarHBondContact O-N 2.55Å; G693-S696 PolarHBondContact O-OG 2.91Å
697	N	71.7	Confident	84.8	Confident	123 Å²	123	50.5 Å²	50.5	66%	0.658	29%	0.285	S	S	*	.	S	Bend	trans	-88.6	159	169.3	-58.4	-4.1	0	0	0	108.9	P695	P695-N697 VanDerWaalsContact C-N 3.28Å
698	D	76.5	Confident	83.1	Confident	126 Å²	126	50.6 Å²	50.6	67%	0.674	29%	0.293	S	S	*	.	S	Bend	trans	62.5	37.3	178.9	-48.6	-32.5	0	0	0	114.4
699	L	84.1	Confident	81	Confident	37 Å²	37	55.8 Å²	55.8	19%	0.194	33%	0.325	C	S	.	.			trans	-80.2	136.5	165.6	-63.5	-178.6	0	0	0	111	P667 A690 V788	P667-L699 HydrophobicContact CB-CD1 4.41Å; P667-L699 HydrophobicContact CG-CD1 4.44Å; P667-L699 HydrophobicContact CG-CD2 4.06Å; A690-L699 HydrophobicContact CB-CD1 4.09Å; L699-V788 HydrophobicContact CB-CG1 3.96Å; L699-V788 HydrophobicContact CD1-CG1 4.4Å; L699-V788 HydrophobicContact CD2-CG1 4.34Å; L699-V788 HydrophobicContact CG-CG1 4.47Å
700	T	88.3	Confident	78.8	Confident	79 Å²	79	58.3 Å²	58.3	49%	0.485	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	141.5	179.1	56.4	0	0	0	0	110.6	V788 S789	T700-V788 CarbonylContact O-C 3.49Å; T700-V788 VanDerWaalsContact O-CA 3.23Å; T700-V788 WeakPolarHBondContact O-CA 3.27Å; T700-V788 WeakPolarHBondContact O-CG1 3.3Å; T700-S789 PolarHBondContact N-O 3.48Å; T700-S789 PolarHBondContact O-N 2.92Å; T700-S789 PolarHBondContact OG1-O 2.94Å; T700-S789 PolarHBondContact OG1-OG 3.35Å
701	Y	91.8	Very high	76.3	Confident	51 Å²	51	60.9 Å²	60.9	20%	0.2	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	147.3	-175.2	-58.7	-103.2	0	0	0	111	C688 H767 E787 V788	C688-Y701 HydrophobicContact CB-CD1 4.33Å; Y701-H767 WeakPolarHBondContact O-CA 3.39Å; Y701-H767 PolarHBondContact O-ND1 2.95Å; Y701-E787 WeakPolarHBondContact CA-O 3.47Å; Y701-V788 HydrophobicContact CD1-CB 4.48Å; Y701-V788 HydrophobicContact CD1-CG1 4.32Å; Y701-V788 HydrophobicContact CD1-CG2 3.41Å; Y701-V788 VanDerWaalsContact CD1-CG2 3.41Å; Y701-V788 HydrophobicContact CE1-CG1 4.13Å; Y701-V788 HydrophobicContact CE1-CG2 3.57Å; Y701-V788 HydrophobicContact CG-CG2 4.24Å
702	A	91.6	Very high	73.9	Confident	12 Å²	12	59.4 Å²	59.4	10%	0.099	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	132.7	169.4	0	0	0	0	0	111	F704 C786 E787	A702-F704 HydrophobicContact CB-CE2 3.84Å; A702-F704 HydrophobicContact CB-CZ 4.48Å; A702-C786 CarbonylContact O-C 3.58Å; A702-C786 WeakPolarHBondContact O-CA 3.35Å; A702-E787 PolarHBondContact N-O 2.94Å; A702-E787 PolarHBondContact O-N 3.03Å
703	W	92.6	Very high	71.7	Confident	0 Å²	0	62 Å²	62	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	150.1	178.7	-70.5	89	0	0	0	112.6	I671 L686 C688 L763 D768 L771 G785 C786	I671-W703 HydrophobicContact CD1-CZ3 4.18Å; I671-W703 HydrophobicContact CG1-CH2 4.46Å; I671-W703 HydrophobicContact CG1-CZ3 4.39Å; I671-W703 HydrophobicContact CG2-CH2 4.13Å; I671-W703 HydrophobicContact CG2-CZ3 4.17Å; L686-W703 HydrophobicContact CB-CH2 3.53Å; L686-W703 HydrophobicContact CB-CZ2 4.43Å; L686-W703 HydrophobicContact CB-CZ3 3.74Å; L686-W703 HydrophobicContact CD1-CZ3 4.15Å; L686-W703 WeakPolarHBondContact O-CH2 3.45Å; L686-W703 WeakPolarHBondContact O-CZ2 3.46Å; C688-W703 HydrophobicContact CB-CH2 3.74Å; C688-W703 HydrophobicContact CB-CZ2 3.47Å; C688-W703 VanDerWaalsContact CB-CZ2 3.47Å; W703-L763 HydrophobicContact CB-CB 4.27Å; W703-L763 HydrophobicContact CB-CD1 4.07Å; W703-L763 PolarHBondContact O-N 2.84Å; W703-D768 PolarHBondContact NE1-O 2.89Å; W703-L771 HydrophobicContact CB-CD2 4.15Å; W703-L771 HydrophobicContact CD2-CB 3.62Å; W703-L771 HydrophobicContact CD2-CD2 3.84Å; W703-L771 HydrophobicContact CD2-CG 4.34Å; W703-L771 HydrophobicContact CE3-CB 4Å; W703-L771 HydrophobicContact CE3-CD2 3.71Å; W703-L771 HydrophobicContact CG-CB 4.04Å; W703-L771 HydrophobicContact CG-CD2 4.05Å; W703-L771 HydrophobicContact CH2-CB 4.18Å; W703-L771 HydrophobicContact CZ2-CB 3.82Å; W703-L771 HydrophobicContact CZ3-CB 4.27Å; W703-L771 HydrophobicContact CZ3-CD2 4.37Å; W703-G785 CarbonylContact C-O 3.56Å; W703-G785 WeakPolarHBondContact CA-O 3.44Å; W703-C786 HydrophobicContact CD2-CB 4.3Å; W703-C786 HydrophobicContact CE3-CB 4.03Å; W703-C786 HydrophobicContact CH2-CB 4.32Å; W703-C786 HydrophobicContact CZ3-CB 4.04Å
704	F	91.7	Very high	69.5	Low	23 Å²	23	68 Å²	68	10%	0.101	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	153.3	-176.5	-64.4	-106.1	0	0	0	110.9	A702 F757 M760 I761 Q762 Y784 G785 E787	A702-F704 HydrophobicContact CB-CE2 3.84Å; A702-F704 HydrophobicContact CB-CZ 4.48Å; F704-F757 HydrophobicContact CB-CZ 4.46Å; F704-F757 HydrophobicContact CD1-CE1 4.25Å; F704-F757 HydrophobicContact CD1-CZ 4.32Å; F704-F757 AromaticContact CD2-CE1 3.98Å; F704-F757 HydrophobicContact CD2-CE1 3.98Å; F704-F757 HydrophobicContact CD2-CE2 4.26Å; F704-F757 AromaticContact CD2-CZ 3.4Å; F704-F757 HydrophobicContact CD2-CZ 3.4Å; F704-F757 VanDerWaalsContact CD2-CZ 3.4Å; F704-F757 HydrophobicContact CE1-CE1 4.03Å; F704-F757 HydrophobicContact CE1-CZ 4.41Å; F704-F757 AromaticContact CE2-CE1 3.76Å; F704-F757 HydrophobicContact CE2-CE1 3.76Å; F704-F757 AromaticContact CE2-CZ 3.54Å; F704-F757 HydrophobicContact CE2-CZ 3.54Å; F704-F757 HydrophobicContact CG-CE1 4.23Å; F704-F757 HydrophobicContact CG-CE2 4.47Å; F704-F757 AromaticContact CG-CZ 3.83Å; F704-F757 HydrophobicContact CG-CZ 3.83Å; F704-F757 AromaticContact CZ-CE1 3.78Å; F704-F757 HydrophobicContact CZ-CE1 3.78Å; F704-F757 HydrophobicContact CZ-CZ 4.06Å; F704-M760 HydrophobicContact CB-CB 4.07Å; F704-M760 HydrophobicContact CB-CE 4.37Å; F704-I761 CarbonylContact C-O 2.89Å; F704-I761 VanDerWaalsContact CA-O 3.23Å; F704-I761 WeakPolarHBondContact CA-O 3.29Å; F704-Q762 HydrophobicContact CD1-CB 3.85Å; F704-Q762 HydrophobicContact CD1-CG 4.21Å; F704-Q762 HydrophobicContact CE1-CB 3.66Å; F704-Q762 HydrophobicContact CE1-CG 3.81Å; F704-Q762 HydrophobicContact CE2-CG 4.26Å; F704-Q762 HydrophobicContact CZ-CB 4.23Å; F704-Q762 HydrophobicContact CZ-CG 3.84Å; F704-Y784 CarbonylContact O-C 3.59Å; F704-Y784 WeakPolarHBondContact O-CA 3.5Å; F704-G785 PolarHBondContact N-O 3.3Å; F704-G785 PolarHBondContact O-N 2.87Å; F704-E787 HydrophobicContact CE2-CB 3.82Å
705	V	90.4	Very high	67.1	Low	36 Å²	36	71.8 Å²	71.8	22%	0.218	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	141.1	176.5	69.3	0	0	0	0	111.2	I761 L763 Y784	V705-I761 HydrophobicContact CG1-CB 4.34Å; V705-I761 PolarHBondContact N-O 3.3Å; V705-I761 PolarHBondContact O-N 3.45Å; V705-L763 HydrophobicContact CB-CD2 4.39Å; V705-L763 HydrophobicContact CG1-CD2 3.76Å; V705-L763 HydrophobicContact CG1-CG 4.37Å; V705-Y784 HydrophobicContact CB-CD1 4.4Å; V705-Y784 HydrophobicContact CB-CE1 4.32Å; V705-Y784 HydrophobicContact CG2-CD1 4.28Å; V705-Y784 HydrophobicContact CG2-CE1 3.96Å; V705-Y784 HydrophobicContact CG2-CE2 4.48Å
706	A	85.2	Confident	64.6	Low	28 Å²	28	79.1 Å²	79.1	23%	0.231	43%	0.431	C	S	.	.			trans	-68.6	146	178.8	0	0	0	0	0	112.2	S708 P755 M760 W783	A706-S708 PolarHBondContact O-N 3.02Å; A706-P755 HydrophobicContact CB-CG 4.42Å; A706-M760 HydrophobicContact CB-CE 4.24Å; A706-W783 HydrophobicContact CB-CB 3.98Å; A706-W783 PolarHBondContact N-O 2.99Å
707	K	67.8	Low	62.5	Low	127 Å²	127	83.9 Å²	83.9	55%	0.552	45%	0.446	S	S	*	.			trans	-62.9	106.7	175.5	-78.2	166.2	-178.8	148.9	0	110.2	T709 S759 I761	K707-T709 VanDerWaalsContact C-N 3.26Å; K707-T709 PolarHBondContact O-N 2.89Å; K707-S759 PolarHBondContact NZ-O 3.11Å; K707-I761 HydrophobicContact CD-CD1 4.5Å; K707-I761 HydrophobicContact CD-CG1 4.46Å; K707-I761 HydrophobicContact CG-CD1 3.61Å; K707-I761 HydrophobicContact CG-CG1 3.84Å
708	S	57.3	Low	60.6	Low	62 Å²	62	85.2 Å²	85.2	43%	0.434	45%	0.452	S	S	.	.			trans	-74.9	73.4	-177.9	-168.9	0	0	0	0	112.3	A706 S712	A706-S708 PolarHBondContact O-N 3.02Å; S708-S712 PolarHBondContact O-OG 3Å
709	T	48.2	Very low	58.4	Low	109 Å²	109	85.7 Å²	85.7	67%	0.669	46%	0.455	S	S	*	.			trans	-82.7	-14.3	174.5	54.8	0	0	0	0	113.1	K707	K707-T709 VanDerWaalsContact C-N 3.26Å; K707-T709 PolarHBondContact O-N 2.89Å
710	Q	43.2	Very low	55.8	Low	120 Å²	120	87.8 Å²	87.8	56%	0.561	47%	0.467	S	S	*	.	S	Bend	trans	-82.7	-22.8	-177.3	-64.5	-168.2	-5	0	0	113.9	S713	Q710-S713 PolarHBondContact O-OG 3.18Å
711	F	36.9	Very low	52.9	Low	82 Å²	82	89.4 Å²	89.4	36%	0.36	48%	0.476	S	S	.	.	S	Bend	trans	-101.4	-15.4	179	-71.3	-74.5	0	0	0	114.6	S713 L714	F711-S713 PolarHBondContact O-N 3.08Å; F711-L714 PolarHBondContact O-N 2.84Å
712	S	33.1	Very low	49.9	Very low	58 Å²	58	94.4 Å²	94.4	41%	0.406	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-64.1	-24.2	-178.2	-13	0	0	0	0	113	S708 L714	S708-S712 PolarHBondContact O-OG 3Å; S712-L714 VanDerWaalsContact C-N 3.35Å
713	S	34.4	Very low	46.9	Very low	98 Å²	98	100.4 Å²	100.4	69%	0.685	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-78.1	-11.4	179.7	56.1	0	0	0	0	114.7	Q710 F711	Q710-S713 PolarHBondContact O-OG 3.18Å; F711-S713 PolarHBondContact O-N 3.08Å
714	L	32.9	Very low	43.8	Very low	127 Å²	127	106.5 Å²	106.5	67%	0.665	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-103	-4	178.3	-70.7	172	0	0	0	113.5	F711 S712	F711-L714 PolarHBondContact O-N 2.84Å; S712-L714 VanDerWaalsContact C-N 3.35Å
715	L	34.7	Very low	40.8	Very low	104 Å²	104	111.2 Å²	111.2	55%	0.545	59%	0.59	S	S	.	*	S	Bend	trans	-135.2	19	-172.6	-67.6	176	0	0	0	113.5	Y877	L715-Y877 WeakPolarHBondContact CD2-OH 3.31Å
716	K	28.5	Very low	37.8	Very low	184 Å²	184	115.4 Å²	115.4	80%	0.8	61%	0.611	S	S	*	*			trans	-128.9	73.3	170.8	-78	-160.7	170.1	-165	0	111.7
717	Q	31.9	Very low	35.3	Very low	176 Å²	176	122.2 Å²	122.2	82%	0.822	64%	0.638	S	S	*	*			trans	-152.2	139.5	152.3	-147	163.2	6	0	0	107.7
718	D	32.1	Very low	33.3	Very low	150 Å²	150	124.8 Å²	124.8	80%	0.802	65%	0.646	S	S	*	*	S	Bend	trans	66.4	127.1	-171.6	-39.9	-20	0	0	0	114.5
719	D	30.3	Very low	32	Very low	137 Å²	137	131.2 Å²	131.2	73%	0.733	67%	0.669	S	S	*	*			cis	-157.4	151.7	-30	-151.6	-7.1	0	0	0	108.2
720	D	28.5	Very low	31.2	Very low	81 Å²	81	133.4 Å²	133.4	43%	0.433	67%	0.672	S	S	.	*			trans	-169.9	115.9	158.1	-116.3	-17.8	0	0	0	113.9	Y875	D720-Y875 WeakPolarHBondContact CB-OH 2.99Å; D720-Y875 VanDerWaalsContact CG-OH 3.3Å; D720-Y875 WeakPolarHBondContact OD2-CE2 2.99Å; D720-Y875 PolarHBondContact OD2-OH 2.94Å
721	T	27.9	Very low	30.6	Very low	112 Å²	112	134.3 Å²	134.3	69%	0.687	68%	0.68	S	S	*	*			trans	-138.3	146.1	149.4	57.3	0	0	0	0	104.8
722	Q	28.9	Very low	30.3	Very low	157 Å²	157	136 Å²	136	73%	0.734	70%	0.697	S	S	*	*			cis	-158.8	152.5	47.4	-68	176.3	-3.2	0	0	111.9
723	L	28.2	Very low	30.1	Very low	138 Å²	138	139.1 Å²	139.1	72%	0.723	71%	0.71	S	S	*	*			trans	53.7	150.1	134.9	-60.2	165.9	0	0	0	119.1
724	N	26.7	Very low	30.1	Very low	128 Å²	128	142.7 Å²	142.7	68%	0.684	72%	0.721	S	S	*	*			cis	-131.4	159.9	30.3	-88.3	51.4	0	0	0	113.9
725	D	28.8	Very low	29.8	Very low	121 Å²	121	141.3 Å²	141.3	65%	0.647	72%	0.722	S	S	*	*			trans	29	129.2	136.6	-32.6	-28.4	0	0	0	118.2
726	D	29.2	Very low	29.7	Very low	124 Å²	124	144.6 Å²	144.6	66%	0.663	74%	0.739	S	S	*	*			cis	-153.8	-175.3	15.4	-150.8	23.7	0	0	0	108
727	Q	30.9	Very low	29.6	Very low	171 Å²	171	142.4 Å²	142.4	80%	0.799	74%	0.736	S	S	*	*			cis	-154	168.5	18.3	-171.6	154.6	94.5	0	0	111.5
728	Y	26.9	Very low	29.5	Very low	181 Å²	181	142.4 Å²	142.4	71%	0.71	74%	0.741	S	S	*	*			trans	-69.7	145.4	-178.4	-85.7	-118.8	0	0	0	115	E730	Y728-E730 HydrophobicContact CD1-CG 3.97Å; Y728-E730 HydrophobicContact CE1-CG 4.25Å
729	E	30.9	Very low	29.3	Very low	197 Å²	197	140 Å²	140	92%	0.921	74%	0.736	S	S	*	*				-149.1	144.3	113.1	-133.1	173.1	-152	0	0	110.5
730	E	29.8	Very low	29.2	Very low	156 Å²	156	138.8 Å²	138.8	73%	0.729	74%	0.738	S	S	*	*			trans	-102.5	162.5	180	-59.9	166	116.9	0	0	109.6	Y728	Y728-E730 HydrophobicContact CD1-CG 3.97Å; Y728-E730 HydrophobicContact CE1-CG 4.25Å
731	D	31.8	Very low	29.3	Very low	139 Å²	139	142.9 Å²	142.9	74%	0.743	76%	0.759	S	S	*	*			cis	-131.5	-118.9	-2	-167.7	13	0	0	0	109.7
732	T	29.1	Very low	29.3	Very low	116 Å²	116	146.7 Å²	146.7	71%	0.712	77%	0.766	S	S	*	*			cis	-145.1	137.7	-3.6	-42.4	0	0	0	0	110.5
733	D	29.2	Very low	29.2	Very low	125 Å²	125	146.1 Å²	146.1	67%	0.668	77%	0.768	S	S	*	*			trans	11.8	115.5	167.5	-78.6	-39.9	0	0	0	120.7
734	N	34.7	Very low	29.3	Very low	172 Å²	172	146.3 Å²	146.3	92%	0.92	77%	0.765	S	S	*	*				-154.5	118.8	112.6	-112.4	-79.4	0	0	0	111.5
735	S	27.4	Very low	29.3	Very low	98 Å²	98	150.4 Å²	150.4	69%	0.685	78%	0.777	S	S	*	*			trans	-95.3	126.9	-174.6	57.8	0	0	0	0	113.1
736	L	31.6	Very low	29.2	Very low	174 Å²	174	149 Å²	149	91%	0.911	77%	0.769	S	S	*	*			trans	-126.9	130.1	165	-87.5	172.3	0	0	0	110.8	L738	L736-L738 PolarHBondContact O-N 2.89Å
737	N	27.9	Very low	29.1	Very low	138 Å²	138	146.2 Å²	146.2	74%	0.738	76%	0.759	S	S	*	*			trans	-73.1	105.9	-166	-89.9	-80.1	0	0	0	113.3	S739	N737-S739 PolarHBondContact O-N 2.84Å
738	L	28.2	Very low	29	Very low	175 Å²	175	141.1 Å²	141.1	92%	0.916	74%	0.742	S	S	*	*			trans	-76	69.4	169.9	-168.6	69.4	0	0	0	111.7	L736	L736-L738 PolarHBondContact O-N 2.89Å
739	S	27.7	Very low	29.2	Very low	100 Å²	100	136.9 Å²	136.9	70%	0.699	74%	0.739	S	S	*	*			trans	-138	25.5	180	57.2	0	0	0	0	115.2	N737	N737-S739 PolarHBondContact O-N 2.84Å
740	S	28.8	Very low	29.4	Very low	111 Å²	111	133 Å²	133	78%	0.776	72%	0.724	S	S	*	*			trans	-130.8	28	-177.4	65	0	0	0	0	115.4
741	L	30.5	Very low	29.9	Very low	167 Å²	167	130.4 Å²	130.4	87%	0.874	72%	0.719	S	S	*	*			trans	-118.6	64.5	177.8	-151.9	76.7	0	0	0	113.8
742	K	27.9	Very low	30.8	Very low	193 Å²	193	129 Å²	129	84%	0.839	72%	0.715	S	S	*	*	S	Bend	trans	-128.1	135.9	158.9	-90.6	179.5	176.3	169.5	0	109.9
743	N	27.5	Very low	32.1	Very low	145 Å²	145	131 Å²	131	78%	0.775	72%	0.716	S	S	*	*	S	Bend	trans	64.6	68.7	170.1	-53.4	-15.6	0	0	0	116.4
744	H	29.1	Very low	34.1	Very low	141 Å²	141	132.4 Å²	132.4	65%	0.653	71%	0.712	S	S	*	*			trans	-140.2	60.1	156.7	-110	75.9	0	0	0	112.5	I746	H744-I746 WeakPolarHBondContact NE2-CD1 3.24Å; H744-I746 PolarHBondContact O-N 2.84Å
745	F	26.6	Very low	36.1	Very low	214 Å²	214	125.7 Å²	125.7	94%	0.939	68%	0.678	S	S	*	*			trans	-84.7	90.7	163.5	-81.2	-81.7	0	0	0	109.1
746	I	27.4	Very low	38.6	Very low	93 Å²	93	128.6 Å²	128.6	48%	0.477	68%	0.681	S	S	.	*			trans	-133.1	140.1	-177.9	-56.7	-170.7	0	0	0	111.3	H744	H744-I746 WeakPolarHBondContact NE2-CD1 3.24Å; H744-I746 PolarHBondContact O-N 2.84Å
747	S	27	Very low	41	Very low	65 Å²	65	121.2 Å²	121.2	46%	0.455	64%	0.641	S	S	.	*			trans	61	109.1	167.8	49.3	0	0	0	0	119.2	S749	S747-S749 PolarHBondContact O-N 2.94Å
748	S	28.9	Very low	43.4	Very low	64 Å²	64	122.1 Å²	122.1	45%	0.448	65%	0.646	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.1	61.1	155.7	22.1	0	0	0	0	111.9	L928 Y929	S748-L928 PolarHBondContact OG-O 3.25Å; S748-L928 VanDerWaalsContact OG-O 3.13Å; S748-Y929 VanDerWaalsContact CB-CE1 3.4Å; S748-Y929 WeakPolarHBondContact OG-CE1 3.49Å
749	S	31.6	Very low	45.8	Very low	92 Å²	92	116.3 Å²	116.3	64%	0.643	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.9	2.3	-177.9	-48.1	0	0	0	0	113.8	S747	S747-S749 PolarHBondContact O-N 2.94Å
750	L	35.8	Very low	48.5	Very low	115 Å²	115	112.1 Å²	112.1	60%	0.602	59%	0.59	S	S	*	*			trans	-105.6	14.8	-179.6	-100.4	74.4	0	0	0	113.9
751	V	40.2	Very low	51.2	Low	102 Å²	102	110.8 Å²	110.8	62%	0.618	57%	0.573	S	S	*	*	S	Bend	trans	-89	138.4	166.5	-169.4	0	0	0	0	107.4
752	T	50.2	Low	53.9	Low	109 Å²	109	108 Å²	108	67%	0.669	56%	0.555	S	S	*	*			trans	66.9	30.2	-177.7	71.1	0	0	0	0	119.7
753	Q	55.5	Low	56.6	Low	158 Å²	158	100.7 Å²	100.7	74%	0.738	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-69.7	131.2	145	-78.8	-170.8	-16.8	0	0	109.2	W783	Q753-W783 PolarHBondContact O-NE1 3.37Å
754	R	72.2	Confident	58.9	Low	155 Å²	155	99 Å²	99	59%	0.585	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-80.2	124.4	177.4	178	175.9	173.9	139.5	-2.8	108.3	W783 L798	R754-W783 HydrophobicContact CB-CH2 4.16Å; R754-W783 HydrophobicContact CB-CZ2 3.97Å; R754-W783 HydrophobicContact CG-CH2 4.07Å; R754-W783 HydrophobicContact CG-CZ2 4.27Å; R754-W783 HydrophobicContact CG-CZ3 4.32Å; R754-L798 HydrophobicContact CG-CD1 3.92Å
755	P	76.5	Confident	60.9	Low	30 Å²	30	95.2 Å²	95.2	20%	0.195	52%	0.524	C	S	.	.	P	Polyproline II helix	trans	-68.9	149.7	-178.6	29	-35.2	0	0	0	111.1	A706 M760 W783 L798	A706-P755 HydrophobicContact CB-CG 4.42Å; P755-M760 HydrophobicContact CG-SD 4.15Å; P755-W783 VanDerWaalsContact CD-CG 3.46Å; P755-W783 HydrophobicContact CG-CB 3.81Å; P755-W783 HydrophobicContact CG-CD2 4.32Å; P755-W783 HydrophobicContact CG-CG 3.75Å; P755-L798 HydrophobicContact CG-CD1 4.46Å; P755-L798 WeakPolarHBondContact O-CD1 3.4Å
756	E	80.1	Confident	63.1	Low	159 Å²	159	90.4 Å²	90.4	74%	0.743	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-67.5	138.3	164.2	-65.8	179	142.4	0	0	109.1	D758 S759	E756-D758 VanDerWaalsContact C-N 3.3Å; E756-D758 PolarHBondContact O-N 2.89Å; E756-S759 WeakPolarHBondContact O-CB 3.38Å; E756-S759 PolarHBondContact O-N 3.45Å; E756-S759 VanDerWaalsContact O-N 3.08Å; E756-S759 PolarHBondContact O-OG 3.26Å
757	F	82.1	Confident	65.6	Low	20 Å²	20	92 Å²	92	9%	0.088	51%	0.506	C	S	.	.	G	3₁₀ helix	trans	-57.6	-45.1	-172.3	-165.3	-97.4	0	0	0	111.7	F704 S759 M760 E787 H796 L798	F704-F757 HydrophobicContact CB-CZ 4.46Å; F704-F757 HydrophobicContact CD1-CE1 4.25Å; F704-F757 HydrophobicContact CD1-CZ 4.32Å; F704-F757 AromaticContact CD2-CE1 3.98Å; F704-F757 HydrophobicContact CD2-CE1 3.98Å; F704-F757 HydrophobicContact CD2-CE2 4.26Å; F704-F757 AromaticContact CD2-CZ 3.4Å; F704-F757 HydrophobicContact CD2-CZ 3.4Å; F704-F757 VanDerWaalsContact CD2-CZ 3.4Å; F704-F757 HydrophobicContact CE1-CE1 4.03Å; F704-F757 HydrophobicContact CE1-CZ 4.41Å; F704-F757 AromaticContact CE2-CE1 3.76Å; F704-F757 HydrophobicContact CE2-CE1 3.76Å; F704-F757 AromaticContact CE2-CZ 3.54Å; F704-F757 HydrophobicContact CE2-CZ 3.54Å; F704-F757 HydrophobicContact CG-CE1 4.23Å; F704-F757 HydrophobicContact CG-CE2 4.47Å; F704-F757 AromaticContact CG-CZ 3.83Å; F704-F757 HydrophobicContact CG-CZ 3.83Å; F704-F757 AromaticContact CZ-CE1 3.78Å; F704-F757 HydrophobicContact CZ-CE1 3.78Å; F704-F757 HydrophobicContact CZ-CZ 4.06Å; F757-S759 PolarHBondContact O-N 2.8Å; F757-M760 HydrophobicContact CD2-SD 4.5Å; F757-M760 VanDerWaalsContact O-CB 3.3Å; F757-M760 WeakPolarHBondContact O-CB 3.11Å; F757-M760 WeakPolarHBondContact O-CG 3.36Å; F757-M760 PolarHBondContact O-N 3.34Å; F757-E787 HydrophobicContact CE1-CB 4.26Å; F757-E787 HydrophobicContact CZ-CB 3.92Å; F757-H796 HydrophobicContact CD1-CB 4.47Å; F757-H796 HydrophobicContact CD2-CB 3.83Å; F757-H796 AromaticContact CD2-CD2 3.63Å; F757-H796 AromaticContact CD2-CG 3.66Å; F757-H796 HydrophobicContact CE1-CB 4.19Å; F757-H796 HydrophobicContact CE2-CB 3.53Å; F757-H796 AromaticContact CE2-CG 3.92Å; F757-H796 HydrophobicContact CG-CB 4.31Å; F757-H796 AromaticContact CG-CG 3.89Å; F757-H796 HydrophobicContact CZ-CB 3.72Å; F757-L798 HydrophobicContact CD2-CD2 3.71Å; F757-L798 HydrophobicContact CD2-CG 4.37Å; F757-L798 HydrophobicContact CE2-CD2 4.04Å
758	D	78.4	Confident	68.3	Low	157 Å²	157	93.5 Å²	93.5	84%	0.84	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-61.5	-15.9	-179.5	-49.6	-10.8	0	0	0	113.8	E756	E756-D758 VanDerWaalsContact C-N 3.3Å; E756-D758 PolarHBondContact O-N 2.89Å
759	S	79.2	Confident	71.1	Confident	52 Å²	52	91.3 Å²	91.3	36%	0.364	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-82.2	-16.7	176.5	76.3	0	0	0	0	113.8	K707 E756 F757	K707-S759 PolarHBondContact NZ-O 3.11Å; E756-S759 WeakPolarHBondContact O-CB 3.38Å; E756-S759 PolarHBondContact O-N 3.45Å; E756-S759 VanDerWaalsContact O-N 3.08Å; E756-S759 PolarHBondContact O-OG 3.26Å; F757-S759 PolarHBondContact O-N 2.8Å
760	M	83.9	Confident	73.9	Confident	13 Å²	13	90.6 Å²	90.6	6%	0.064	48%	0.479	C	S	.	.	S	Bend	trans	-81.2	157.3	-172.9	-57.4	-178.4	69.9	0	0	112.4	F704 A706 P755 F757 W783 L798	F704-M760 HydrophobicContact CB-CB 4.07Å; F704-M760 HydrophobicContact CB-CE 4.37Å; A706-M760 HydrophobicContact CB-CE 4.24Å; P755-M760 HydrophobicContact CG-SD 4.15Å; F757-M760 HydrophobicContact CD2-SD 4.5Å; F757-M760 VanDerWaalsContact O-CB 3.3Å; F757-M760 WeakPolarHBondContact O-CB 3.11Å; F757-M760 WeakPolarHBondContact O-CG 3.36Å; F757-M760 PolarHBondContact O-N 3.34Å; M760-W783 HydrophobicContact CE-CB 4.24Å; M760-W783 VanDerWaalsContact CE-O 3.29Å; M760-W783 WeakPolarHBondContact CE-O 3.38Å; M760-L798 HydrophobicContact CE-CD2 4.02Å; M760-L798 HydrophobicContact SD-CD2 3.45Å; M760-L798 WeakPolarHBondContact SD-CD2 3.47Å
761	I	84.8	Confident	76.4	Confident	83 Å²	83	85.2 Å²	85.2	43%	0.426	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	126.1	176.9	-65.7	168.8	0	0	0	108.8	F704 V705 K707	F704-I761 CarbonylContact C-O 2.89Å; F704-I761 VanDerWaalsContact CA-O 3.23Å; F704-I761 WeakPolarHBondContact CA-O 3.29Å; V705-I761 HydrophobicContact CG1-CB 4.34Å; V705-I761 PolarHBondContact N-O 3.3Å; V705-I761 PolarHBondContact O-N 3.45Å; K707-I761 HydrophobicContact CD-CD1 4.5Å; K707-I761 HydrophobicContact CD-CG1 4.46Å; K707-I761 HydrophobicContact CG-CD1 3.61Å; K707-I761 HydrophobicContact CG-CG1 3.84Å
762	Q	87.4	Confident	78.7	Confident	107 Å²	107	84.3 Å²	84.3	50%	0.5	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	135.7	172	-163.8	-179.6	33.7	0	0	111	F704 S764	F704-Q762 HydrophobicContact CD1-CB 3.85Å; F704-Q762 HydrophobicContact CD1-CG 4.21Å; F704-Q762 HydrophobicContact CE1-CB 3.66Å; F704-Q762 HydrophobicContact CE1-CG 3.81Å; F704-Q762 HydrophobicContact CE2-CG 4.26Å; F704-Q762 HydrophobicContact CZ-CB 4.23Å; F704-Q762 HydrophobicContact CZ-CG 3.84Å; Q762-S764 PolarHBondContact O-N 2.83Å
763	L	85.1	Confident	80.4	Confident	41 Å²	41	80 Å²	80	22%	0.215	42%	0.416	C	S	.	.			trans	-87.3	90.8	176.9	-64.2	179.5	0	0	0	110	W703 V705 G765 Y766 L771	W703-L763 HydrophobicContact CB-CB 4.27Å; W703-L763 HydrophobicContact CB-CD1 4.07Å; W703-L763 PolarHBondContact O-N 2.84Å; V705-L763 HydrophobicContact CB-CD2 4.39Å; V705-L763 HydrophobicContact CG1-CD2 3.76Å; V705-L763 HydrophobicContact CG1-CG 4.37Å; L763-G765 PolarHBondContact O-N 2.94Å; L763-Y766 HydrophobicContact CB-CD2 4.01Å; L763-Y766 PolarHBondContact O-N 3.03Å; L763-L771 HydrophobicContact CD1-CD1 4.31Å; L763-L771 HydrophobicContact CD1-CD2 3.76Å
764	S	76.2	Confident	81.8	Confident	109 Å²	109	77.6 Å²	77.6	76%	0.762	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	127	177.3	56.3	0	0	0	0	112.2	Q762	Q762-S764 PolarHBondContact O-N 2.83Å
765	G	70.1	Confident	82.2	Confident	61 Å²	61	74.7 Å²	74.7	63%	0.629	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.6	-9.8	178.2	0	0	0	0	0	115.5	L763	L763-G765 PolarHBondContact O-N 2.94Å
766	Y	73.9	Confident	82.5	Confident	113 Å²	113	73.3 Å²	73.3	44%	0.443	40%	0.399	S	S	.	.			trans	-100.9	87.9	178.6	-68.1	-87.7	0	0	0	111.4	L763 L771	L763-Y766 HydrophobicContact CB-CD2 4.01Å; L763-Y766 PolarHBondContact O-N 3.03Å; Y766-L771 HydrophobicContact CD1-CD1 3.49Å; Y766-L771 VanDerWaalsContact CD1-CD1 3.49Å; Y766-L771 HydrophobicContact CD2-CD1 4.44Å; Y766-L771 HydrophobicContact CE1-CD1 3.69Å; Y766-L771 HydrophobicContact CG-CD1 3.89Å
767	H	78.6	Confident	82.6	Confident	128 Å²	128	72 Å²	72	59%	0.593	39%	0.391	S	S	*	.			trans	-109.1	9.9	-177.8	-62	-62.3	0	0	0	114.7	Y701	Y701-H767 WeakPolarHBondContact O-CA 3.39Å; Y701-H767 PolarHBondContact O-ND1 2.95Å
768	D	84.2	Confident	82.4	Confident	95 Å²	95	74.7 Å²	74.7	51%	0.508	41%	0.406	S	S	.	.	S	Bend	trans	-95.4	156.9	175.4	-161.6	-16.7	0	0	0	110.8	W703 Q770	W703-D768 PolarHBondContact NE1-O 2.89Å; D768-Q770 PolarHBondContact O-N 3.32Å
769	S	87	Confident	82.2	Confident	18 Å²	18	69.9 Å²	69.9	13%	0.126	39%	0.385	C	S	.	.	S	Bend	trans	-50.9	-15.3	164.4	62.3	0	0	0	0	115.1	C688	C688-S769 PolarHBondContact N-O 3.4Å
770	Q	90	Very high	82.3	Confident	77 Å²	77	70.7 Å²	70.7	36%	0.36	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	129.3	-175.9	-37.5	-163.5	14.5	0	0	111.9	I685 L686 F687 D768	I685-Q770 HydrophobicContact CG2-CB 4.39Å; L686-Q770 WeakPolarHBondContact O-CA 3.49Å; F687-Q770 HydrophobicContact CD2-CG 3.77Å; F687-Q770 HydrophobicContact CE2-CG 3.96Å; D768-Q770 PolarHBondContact O-N 3.32Å
771	L	88.9	Confident	82.2	Confident	2 Å²	2	71.2 Å²	71.2	1%	0.01	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	106.5	169.8	174.6	61.1	0	0	0	109.7	L686 W703 L763 Y766 L773 Y784	L686-L771 HydrophobicContact CB-CB 4.34Å; L686-L771 HydrophobicContact CD1-CD2 4.43Å; L686-L771 PolarHBondContact N-O 2.03Å; L686-L771 PolarHBondContact O-N 2.84Å; W703-L771 HydrophobicContact CB-CD2 4.15Å; W703-L771 HydrophobicContact CD2-CB 3.62Å; W703-L771 HydrophobicContact CD2-CD2 3.84Å; W703-L771 HydrophobicContact CD2-CG 4.34Å; W703-L771 HydrophobicContact CE3-CB 4Å; W703-L771 HydrophobicContact CE3-CD2 3.71Å; W703-L771 HydrophobicContact CG-CB 4.04Å; W703-L771 HydrophobicContact CG-CD2 4.05Å; W703-L771 HydrophobicContact CH2-CB 4.18Å; W703-L771 HydrophobicContact CZ2-CB 3.82Å; W703-L771 HydrophobicContact CZ3-CB 4.27Å; W703-L771 HydrophobicContact CZ3-CD2 4.37Å; L763-L771 HydrophobicContact CD1-CD1 4.31Å; L763-L771 HydrophobicContact CD1-CD2 3.76Å; Y766-L771 HydrophobicContact CD1-CD1 3.49Å; Y766-L771 VanDerWaalsContact CD1-CD1 3.49Å; Y766-L771 HydrophobicContact CD2-CD1 4.44Å; Y766-L771 HydrophobicContact CE1-CD1 3.69Å; Y766-L771 HydrophobicContact CG-CD1 3.89Å; L771-L773 HydrophobicContact CD1-CD2 4.11Å; L771-L773 HydrophobicContact CD2-CD2 4.26Å; L771-L773 HydrophobicContact CG-CD2 3.97Å; L771-L773 HydrophobicContact CG-CG 4.19Å; L771-Y784 HydrophobicContact CD2-CD1 3.83Å; L771-Y784 HydrophobicContact CD2-CE1 4.02Å
772	N	89.1	Confident	82.3	Confident	84 Å²	84	68.1 Å²	68.1	45%	0.449	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	109.6	-178.9	-68	-26.7	0	0	0	110.8	I685	I685-N772 VanDerWaalsContact CG1-OD1 3.31Å; I685-N772 WeakPolarHBondContact CG1-OD1 3.22Å; I685-N772 WeakPolarHBondContact CG2-OD1 3.11Å
773	L	86.5	Confident	82.4	Confident	19 Å²	19	65.3 Å²	65.3	10%	0.099	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	101.4	179.2	-58.2	175.7	0	0	0	109.7	S683 V684 L686 L771 I776 Y784 L801	S683-L773 CarbonylContact C-O 3.53Å; S683-L773 VanDerWaalsContact CA-O 3.31Å; S683-L773 WeakPolarHBondContact CA-O 3.35Å; V684-L773 PolarHBondContact N-O 3.37Å; V684-L773 PolarHBondContact O-N 2.78Å; L686-L773 HydrophobicContact CD1-CD1 4.21Å; L686-L773 HydrophobicContact CG-CD1 4.39Å; L771-L773 HydrophobicContact CD1-CD2 4.11Å; L771-L773 HydrophobicContact CD2-CD2 4.26Å; L771-L773 HydrophobicContact CG-CD2 3.97Å; L771-L773 HydrophobicContact CG-CG 4.19Å; L773-I776 HydrophobicContact CB-CD1 4.13Å; L773-I776 HydrophobicContact CD1-CD1 3.83Å; L773-Y784 HydrophobicContact CD1-CE1 3.94Å; L773-Y784 HydrophobicContact CD1-CE2 4.33Å; L773-Y784 HydrophobicContact CD2-CE1 4.4Å; L773-L801 HydrophobicContact CD1-CD2 3.67Å
774	T	83.9	Confident	82.8	Confident	107 Å²	107	64 Å²	64	66%	0.656	35%	0.354	S	S	*	.			trans	-86.7	141.4	-178	51.6	0	0	0	0	112.7	I776	T774-I776 PolarHBondContact O-N 2.86Å
775	N	81.3	Confident	83.5	Confident	94 Å²	94	58.8 Å²	58.8	50%	0.503	32%	0.318	S	S	.	.	S	Bend	trans	47.6	56.5	176.4	-170.5	2.4	0	0	0	113.6	R681 K777	R681-N775 WeakPolarHBondContact CA-OD1 3.42Å; R681-N775 VanDerWaalsContact CB-OD1 3.3Å; R681-N775 WeakPolarHBondContact CB-OD1 3.32Å; N775-K777 PolarHBondContact O-N 3.21Å
776	I	82.6	Confident	84.7	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.288	C	S	.	.			trans	-68.2	128.2	-163.7	-160.2	167.9	0	0	0	113.1	R681 Q682 V684 L773 T774 Q780 L801 L803	R681-I776 WeakPolarHBondContact CA-O 3.35Å; R681-I776 PolarHBondContact N-O 3.32Å; Q682-I776 WeakPolarHBondContact O-CG2 3.45Å; Q682-I776 PolarHBondContact O-N 2.88Å; V684-I776 HydrophobicContact CG2-CB 4.47Å; V684-I776 HydrophobicContact CG2-CD1 4.43Å; V684-I776 HydrophobicContact CG2-CG2 3.87Å; L773-I776 HydrophobicContact CB-CD1 4.13Å; L773-I776 HydrophobicContact CD1-CD1 3.83Å; T774-I776 PolarHBondContact O-N 2.86Å; I776-Q780 HydrophobicContact CD1-CB 4.23Å; I776-Q780 HydrophobicContact CG1-CB 3.78Å; I776-L801 HydrophobicContact CD1-CD2 3.44Å; I776-L801 VanDerWaalsContact CD1-CD2 3.44Å; I776-L801 HydrophobicContact CD1-CG 4.35Å; I776-L803 HydrophobicContact CD1-CD1 4.43Å; I776-L803 HydrophobicContact CD1-CD2 4.31Å; I776-L803 HydrophobicContact CG1-CD1 4.19Å; I776-L803 HydrophobicContact CG2-CD1 3.95Å; I776-L803 HydrophobicContact CG2-CD2 3.63Å; I776-L803 HydrophobicContact CG2-CG 4.48Å
777	K	82.1	Confident	85.6	Confident	133 Å²	133	52.9 Å²	52.9	58%	0.578	28%	0.278	S	S	*	.			trans	-87.6	153.8	-179.6	-60.8	176.6	-176.7	175	0	110.9	N775 S779 Q780 L803	N775-K777 PolarHBondContact O-N 3.21Å; K777-S779 PolarHBondContact O-N 2.99Å; K777-S779 VanDerWaalsContact O-N 3.11Å; K777-Q780 HydrophobicContact CB-CG 4.47Å; K777-Q780 WeakPolarHBondContact O-CB 3.35Å; K777-Q780 PolarHBondContact O-N 3.36Å; K777-L803 WeakPolarHBondContact O-CD1 3.34Å
778	L	78.3	Confident	86.2	Confident	76 Å²	76	46.8 Å²	46.8	40%	0.398	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-55.2	-29.6	174	-66.7	170.2	0	0	0	113	A680 Q780 A781 L803 Y805	A680-L778 HydrophobicContact CB-CD2 3.91Å; A680-L778 HydrophobicContact CB-CG 4.35Å; L778-Q780 PolarHBondContact O-N 3.26Å; L778-A781 PolarHBondContact O-N 3.3Å; L778-L803 HydrophobicContact CD2-CB 4.49Å; L778-Y805 HydrophobicContact CD2-CD1 3.4Å; L778-Y805 HydrophobicContact CD2-CE1 3.82Å; L778-Y805 HydrophobicContact CD2-CG 3.97Å
779	S	72.9	Confident	86.4	Confident	56 Å²	56	44.3 Å²	44.3	39%	0.392	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-72.8	-4	175	60.8	0	0	0	0	115	K777	K777-S779 PolarHBondContact O-N 2.99Å; K777-S779 VanDerWaalsContact O-N 3.11Å
780	Q	81.1	Confident	86.3	Confident	68 Å²	68	44.5 Å²	44.5	32%	0.318	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-108.6	2.8	176.5	-61.6	170	-83.1	0	0	112.1	I776 K777 L778 Y784	I776-Q780 HydrophobicContact CD1-CB 4.23Å; I776-Q780 HydrophobicContact CG1-CB 3.78Å; K777-Q780 HydrophobicContact CB-CG 4.47Å; K777-Q780 WeakPolarHBondContact O-CB 3.35Å; K777-Q780 PolarHBondContact O-N 3.36Å; L778-Q780 PolarHBondContact O-N 3.26Å; Q780-Y784 WeakPolarHBondContact O-CE2 3.39Å; Q780-Y784 PolarHBondContact O-OH 2.72Å
781	A	83	Confident	85.9	Confident	24 Å²	24	46.4 Å²	46.4	20%	0.198	26%	0.257	C	S	.	.			trans	-67.8	146.8	166.5	0	0	0	0	0	110.5	L778 L801 L803	L778-A781 PolarHBondContact O-N 3.3Å; A781-L801 WeakPolarHBondContact CA-O 3.44Å; A781-L803 HydrophobicContact CB-CD1 3.99Å; A781-L803 HydrophobicContact CB-CG 4.04Å
782	G	86.8	Confident	85.5	Confident	18 Å²	18	47.1 Å²	47.1	19%	0.186	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	139.4	-161.7	178.3	0	0	0	0	0	114	L801	G782-L801 PolarHBondContact N-O 2.76Å; G782-L801 VanDerWaalsContact N-O 3.11Å; G782-L801 PolarHBondContact O-N 3.36Å
783	W	89.2	Confident	85.3	Confident	49 Å²	49	44.8 Å²	44.8	19%	0.186	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	124.5	-176.2	-68.2	101.1	0	0	0	112.7	A706 Q753 R754 P755 M760 L798 H799 H800	A706-W783 HydrophobicContact CB-CB 3.98Å; A706-W783 PolarHBondContact N-O 2.99Å; Q753-W783 PolarHBondContact O-NE1 3.37Å; R754-W783 HydrophobicContact CB-CH2 4.16Å; R754-W783 HydrophobicContact CB-CZ2 3.97Å; R754-W783 HydrophobicContact CG-CH2 4.07Å; R754-W783 HydrophobicContact CG-CZ2 4.27Å; R754-W783 HydrophobicContact CG-CZ3 4.32Å; P755-W783 VanDerWaalsContact CD-CG 3.46Å; P755-W783 HydrophobicContact CG-CB 3.81Å; P755-W783 HydrophobicContact CG-CD2 4.32Å; P755-W783 HydrophobicContact CG-CG 3.75Å; M760-W783 HydrophobicContact CE-CB 4.24Å; M760-W783 VanDerWaalsContact CE-O 3.29Å; M760-W783 WeakPolarHBondContact CE-O 3.38Å; W783-L798 HydrophobicContact CE3-CB 4.13Å; W783-L798 HydrophobicContact CZ3-CB 4.25Å; W783-H799 WeakPolarHBondContact CA-O 3.44Å; W783-H800 AromaticContact CD1-CD2 3.98Å; W783-H800 HydrophobicContact CD2-CB 4.01Å; W783-H800 AromaticContact CE2-CD2 3.81Å; W783-H800 HydrophobicContact CE3-CB 3.86Å; W783-H800 HydrophobicContact CH2-CB 4.02Å; W783-H800 HydrophobicContact CZ2-CB 4.17Å; W783-H800 HydrophobicContact CZ3-CB 3.86Å; W783-H800 AromaticContact NE1-CD2 3.78Å
784	Y	92.5	Very high	85.3	Confident	12 Å²	12	46.7 Å²	46.7	5%	0.047	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	145.5	167.2	-74	-96.9	0	0	0	109.8	L686 F704 V705 L771 L773 Q780 L798 H799 L801	L686-Y784 HydrophobicContact CD1-CD1 3.96Å; L686-Y784 HydrophobicContact CD1-CD2 4.13Å; L686-Y784 HydrophobicContact CD1-CG 3.68Å; F704-Y784 CarbonylContact O-C 3.59Å; F704-Y784 WeakPolarHBondContact O-CA 3.5Å; V705-Y784 HydrophobicContact CB-CD1 4.4Å; V705-Y784 HydrophobicContact CB-CE1 4.32Å; V705-Y784 HydrophobicContact CG2-CD1 4.28Å; V705-Y784 HydrophobicContact CG2-CE1 3.96Å; V705-Y784 HydrophobicContact CG2-CE2 4.48Å; L771-Y784 HydrophobicContact CD2-CD1 3.83Å; L771-Y784 HydrophobicContact CD2-CE1 4.02Å; L773-Y784 HydrophobicContact CD1-CE1 3.94Å; L773-Y784 HydrophobicContact CD1-CE2 4.33Å; L773-Y784 HydrophobicContact CD2-CE1 4.4Å; Q780-Y784 WeakPolarHBondContact O-CE2 3.39Å; Q780-Y784 PolarHBondContact O-OH 2.72Å; Y784-L798 WeakPolarHBondContact O-CA 3.26Å; Y784-H799 PolarHBondContact N-O 2.88Å; Y784-H799 PolarHBondContact O-N 2.93Å; Y784-L801 HydrophobicContact CD2-CB 3.81Å; Y784-L801 HydrophobicContact CD2-CD2 4.06Å; Y784-L801 HydrophobicContact CE2-CB 3.98Å; Y784-L801 HydrophobicContact CE2-CD2 3.65Å; Y784-L801 HydrophobicContact CE2-CG 4.42Å
785	G	92.4	Very high	85.7	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	152.2	175.4	0	0	0	0	0	111.8	W703 F704 A797	W703-G785 CarbonylContact C-O 3.56Å; W703-G785 WeakPolarHBondContact CA-O 3.44Å; F704-G785 PolarHBondContact N-O 3.3Å; F704-G785 PolarHBondContact O-N 2.87Å; G785-A797 VanDerWaalsContact CA-O 3.29Å; G785-A797 WeakPolarHBondContact CA-O 3.49Å
786	C	94	Very high	86.2	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	126.9	168	176.9	0	0	0	0	108.2	I671 C688 A702 W703 H796 A797	I671-C786 HydrophobicContact CD1-CB 3.76Å; I671-C786 HydrophobicContact CG1-CB 4Å; C688-C786 HydrophobicContact CB-CB 3.77Å; C688-C786 WeakPolarHBondContact CB-SG 3.07Å; C688-C786 WeakPolarHBondContact SG-CB 3.26Å; C688-C786 CovalentContact SG-SG 2.03Å; C688-C786 PolarHBondContact SG-SG 3.39Å; A702-C786 CarbonylContact O-C 3.58Å; A702-C786 WeakPolarHBondContact O-CA 3.35Å; W703-C786 HydrophobicContact CD2-CB 4.3Å; W703-C786 HydrophobicContact CE3-CB 4.03Å; W703-C786 HydrophobicContact CH2-CB 4.32Å; W703-C786 HydrophobicContact CZ3-CB 4.04Å; C786-H796 CarbonylContact O-C 3.48Å; C786-H796 VanDerWaalsContact O-CA 3.24Å; C786-H796 WeakPolarHBondContact O-CA 3.36Å; C786-A797 PolarHBondContact N-O 3.38Å; C786-A797 PolarHBondContact O-N 3.37Å
787	E	92.7	Very high	86.7	Confident	50 Å²	50	44 Å²	44	23%	0.234	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	140.9	163.6	-173	176	-163.7	0	0	108.9	Y701 A702 F704 F757 S794 S795 H796	Y701-E787 WeakPolarHBondContact CA-O 3.47Å; A702-E787 PolarHBondContact N-O 2.94Å; A702-E787 PolarHBondContact O-N 3.03Å; F704-E787 HydrophobicContact CE2-CB 3.82Å; F757-E787 HydrophobicContact CE1-CB 4.26Å; F757-E787 HydrophobicContact CZ-CB 3.92Å; E787-S794 WeakPolarHBondContact OE1-CB 3.49Å; E787-S794 PolarHBondContact OE1-OG 3.13Å; E787-S795 WeakPolarHBondContact CA-O 3.45Å; E787-S795 WeakPolarHBondContact CG-O 3.18Å; E787-H796 HydrophobicContact CB-CB 4.48Å
788	V	91.8	Very high	87.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	123.1	166.1	-172.8	0	0	0	0	108.7	P667 I669 A690 L699 T700 Y701 S794 S795	P667-V788 HydrophobicContact CG-CB 4.11Å; P667-V788 HydrophobicContact CG-CG1 3.94Å; I669-V788 HydrophobicContact CD1-CB 3.6Å; I669-V788 HydrophobicContact CD1-CG2 3.66Å; I669-V788 HydrophobicContact CG1-CB 4.08Å; I669-V788 HydrophobicContact CG1-CG2 3.96Å; I669-V788 HydrophobicContact CG2-CG2 4.46Å; A690-V788 HydrophobicContact CB-CG1 4.41Å; L699-V788 HydrophobicContact CB-CG1 3.96Å; L699-V788 HydrophobicContact CD1-CG1 4.4Å; L699-V788 HydrophobicContact CD2-CG1 4.34Å; L699-V788 HydrophobicContact CG-CG1 4.47Å; T700-V788 CarbonylContact O-C 3.49Å; T700-V788 VanDerWaalsContact O-CA 3.23Å; T700-V788 WeakPolarHBondContact O-CA 3.27Å; T700-V788 WeakPolarHBondContact O-CG1 3.3Å; Y701-V788 HydrophobicContact CD1-CB 4.48Å; Y701-V788 HydrophobicContact CD1-CG1 4.32Å; Y701-V788 HydrophobicContact CD1-CG2 3.41Å; Y701-V788 VanDerWaalsContact CD1-CG2 3.41Å; Y701-V788 HydrophobicContact CE1-CG1 4.13Å; Y701-V788 HydrophobicContact CE1-CG2 3.57Å; Y701-V788 HydrophobicContact CG-CG2 4.24Å; V788-S794 WeakPolarHBondContact O-CA 3.23Å; V788-S795 PolarHBondContact N-O 3.3Å; V788-S795 PolarHBondContact O-N 3.12Å
789	S	88.2	Confident	87.8	Confident	44 Å²	44	37 Å²	37	31%	0.308	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	145.8	-177.8	94.6	0	0	0	0	112.4	T700	T700-S789 PolarHBondContact N-O 3.48Å; T700-S789 PolarHBondContact O-N 2.92Å; T700-S789 PolarHBondContact OG1-O 2.94Å; T700-S789 PolarHBondContact OG1-OG 3.35Å
790	G	84.6	Confident	88.6	Confident	22 Å²	22	37.6 Å²	37.6	23%	0.227	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	-171.8	173.9	0	0	0	0	0	111.2	G792 G793	G790-G792 PolarHBondContact O-N 2.93Å; G790-G792 VanDerWaalsContact O-N 3.11Å; G790-G793 PolarHBondContact N-O 3.31Å; G790-G793 PolarHBondContact O-N 3.47Å
791	I	82.3	Confident	89	Confident	117 Å²	117	34.4 Å²	34.4	60%	0.6	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-24.5	-173.5	-50.7	-179.3	0	0	0	112.5	L664 P695 G793	L664-I791 HydrophobicContact CD1-CG2 4.25Å; P695-I791 HydrophobicContact CG-CB 4.34Å; P695-I791 HydrophobicContact CG-CD1 4.12Å; P695-I791 HydrophobicContact CG-CG1 4.39Å; I791-G793 VanDerWaalsContact C-N 3.33Å
792	G	79.7	Confident	89	Confident	17 Å²	17	36.4 Å²	36.4	18%	0.175	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	4.8	173.4	0	0	0	0	0	116.2	P666 G790	P666-G792 VanDerWaalsContact CD-O 3.3Å; P666-G792 WeakPolarHBondContact CD-O 3.38Å; G790-G792 PolarHBondContact O-N 2.93Å; G790-G792 VanDerWaalsContact O-N 3.11Å
793	G	84.9	Confident	89	Confident	35 Å²	35	35.7 Å²	35.7	36%	0.361	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	109.2	-175.8	-174.7	0	0	0	0	0	112.9	G790 I791	G790-G793 PolarHBondContact N-O 3.31Å; G790-G793 PolarHBondContact O-N 3.47Å; I791-G793 VanDerWaalsContact C-N 3.33Å
794	S	88.2	Confident	88.9	Confident	58 Å²	58	35.6 Å²	35.6	41%	0.406	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	156.9	171.4	72.7	0	0	0	0	112.9	E787 V788	E787-S794 WeakPolarHBondContact OE1-CB 3.49Å; E787-S794 PolarHBondContact OE1-OG 3.13Å; V788-S794 WeakPolarHBondContact O-CA 3.23Å
795	S	91.2	Very high	88.6	Confident	31 Å²	31	37.2 Å²	37.2	22%	0.217	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	161	167.1	-77.1	0	0	0	0	108.1	P667 I669 E787 V788	P667-S795 WeakPolarHBondContact O-CB 3.37Å; P667-S795 PolarHBondContact O-OG 2.77Å; I669-S795 VanDerWaalsContact CD1-CB 3.4Å; I669-S795 WeakPolarHBondContact CD1-O 2.99Å; E787-S795 WeakPolarHBondContact CA-O 3.45Å; E787-S795 WeakPolarHBondContact CG-O 3.18Å; V788-S795 PolarHBondContact N-O 3.3Å; V788-S795 PolarHBondContact O-N 3.12Å
796	H	92.8	Very high	88.2	Confident	103 Å²	103	41.8 Å²	41.8	48%	0.477	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	157.1	170.1	64.8	-106.4	0	0	0	113.2	F757 C786 E787	F757-H796 HydrophobicContact CD1-CB 4.47Å; F757-H796 HydrophobicContact CD2-CB 3.83Å; F757-H796 AromaticContact CD2-CD2 3.63Å; F757-H796 AromaticContact CD2-CG 3.66Å; F757-H796 HydrophobicContact CE1-CB 4.19Å; F757-H796 HydrophobicContact CE2-CB 3.53Å; F757-H796 AromaticContact CE2-CG 3.92Å; F757-H796 HydrophobicContact CG-CB 4.31Å; F757-H796 AromaticContact CG-CG 3.89Å; F757-H796 HydrophobicContact CZ-CB 3.72Å; C786-H796 CarbonylContact O-C 3.48Å; C786-H796 VanDerWaalsContact O-CA 3.24Å; C786-H796 WeakPolarHBondContact O-CA 3.36Å; E787-H796 HydrophobicContact CB-CB 4.48Å
797	A	92.6	Very high	87.8	Confident	11 Å²	11	41.8 Å²	41.8	9%	0.091	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	152.4	171.9	0	0	0	0	0	110.7	I669 I671 G785 C786	I669-A797 HydrophobicContact CB-CB 4.05Å; I669-A797 HydrophobicContact CG2-CB 3.69Å; I671-A797 HydrophobicContact CD1-CB 4.04Å; I671-A797 WeakPolarHBondContact CD1-O 3.2Å; I671-A797 HydrophobicContact CG1-CB 4.05Å; G785-A797 VanDerWaalsContact CA-O 3.29Å; G785-A797 WeakPolarHBondContact CA-O 3.49Å; C786-A797 PolarHBondContact N-O 3.38Å; C786-A797 PolarHBondContact O-N 3.37Å
798	L	92.3	Very high	87.3	Confident	24 Å²	24	42.4 Å²	42.4	13%	0.126	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	140.5	176	-66.9	-175.4	0	0	0	110.8	R754 P755 F757 M760 W783 Y784	R754-L798 HydrophobicContact CG-CD1 3.92Å; P755-L798 HydrophobicContact CG-CD1 4.46Å; P755-L798 WeakPolarHBondContact O-CD1 3.4Å; F757-L798 HydrophobicContact CD2-CD2 3.71Å; F757-L798 HydrophobicContact CD2-CG 4.37Å; F757-L798 HydrophobicContact CE2-CD2 4.04Å; M760-L798 HydrophobicContact CE-CD2 4.02Å; M760-L798 HydrophobicContact SD-CD2 3.45Å; M760-L798 WeakPolarHBondContact SD-CD2 3.47Å; W783-L798 HydrophobicContact CE3-CB 4.13Å; W783-L798 HydrophobicContact CZ3-CB 4.25Å; Y784-L798 WeakPolarHBondContact O-CA 3.26Å
799	H	91.1	Very high	86.9	Confident	38 Å²	38	45.7 Å²	45.7	18%	0.176	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	132.1	179.8	-176.4	100.8	0	0	0	109.9	I671 S673 W783 Y784	I671-H799 HydrophobicContact CB-CB 3.88Å; I671-H799 HydrophobicContact CD1-CB 4.08Å; I671-H799 HydrophobicContact CG2-CB 3.76Å; I671-H799 PolarHBondContact O-ND1 3.14Å; S673-H799 PolarHBondContact OG-CE1 2.87Å; S673-H799 VanDerWaalsContact OG-CE1 3.28Å; S673-H799 PolarHBondContact OG-NE2 3.17Å; W783-H799 WeakPolarHBondContact CA-O 3.44Å; Y784-H799 PolarHBondContact N-O 2.88Å; Y784-H799 PolarHBondContact O-N 2.93Å
800	H	89.3	Confident	86.5	Confident	68 Å²	68	45.5 Å²	45.5	32%	0.315	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	106.3	174.1	-176.5	-82.2	0	0	0	109.6	W783 D802	W783-H800 AromaticContact CD1-CD2 3.98Å; W783-H800 HydrophobicContact CD2-CB 4.01Å; W783-H800 AromaticContact CE2-CD2 3.81Å; W783-H800 HydrophobicContact CE3-CB 3.86Å; W783-H800 HydrophobicContact CH2-CB 4.02Å; W783-H800 HydrophobicContact CZ2-CB 4.17Å; W783-H800 HydrophobicContact CZ3-CB 3.86Å; W783-H800 AromaticContact NE1-CD2 3.78Å; H800-D802 PolarHBondContact O-N 3.35Å; H800-D802 VanDerWaalsContact O-N 3.08Å
801	L	88.7	Confident	86	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	90.7	177.2	-177.3	52.8	0	0	0	109.6	P678 V684 L686 L773 I776 A781 G782 Y784 L803	P678-L801 HydrophobicContact CB-CD1 4.45Å; P678-L801 HydrophobicContact CG-CD1 3.52Å; V684-L801 HydrophobicContact CG1-CD1 4.2Å; L686-L801 HydrophobicContact CD1-CD2 4.45Å; L686-L801 HydrophobicContact CD2-CD1 4.44Å; L773-L801 HydrophobicContact CD1-CD2 3.67Å; I776-L801 HydrophobicContact CD1-CD2 3.44Å; I776-L801 VanDerWaalsContact CD1-CD2 3.44Å; I776-L801 HydrophobicContact CD1-CG 4.35Å; A781-L801 WeakPolarHBondContact CA-O 3.44Å; G782-L801 PolarHBondContact N-O 2.76Å; G782-L801 VanDerWaalsContact N-O 3.11Å; G782-L801 PolarHBondContact O-N 3.36Å; Y784-L801 HydrophobicContact CD2-CB 3.81Å; Y784-L801 HydrophobicContact CD2-CD2 4.06Å; Y784-L801 HydrophobicContact CE2-CB 3.98Å; Y784-L801 HydrophobicContact CE2-CD2 3.65Å; Y784-L801 HydrophobicContact CE2-CG 4.42Å; L801-L803 HydrophobicContact CD1-CD2 4.39Å; L801-L803 HydrophobicContact CG-CD2 4.39Å
802	D	84.3	Confident	85.7	Confident	66 Å²	66	59.6 Å²	59.6	35%	0.353	29%	0.291	S	S	.	.			trans	-84.1	139.8	171.2	-171.8	30.7	0	0	0	111.2	P678 H800 N834	P678-D802 WeakPolarHBondContact CG-O 3.28Å; H800-D802 PolarHBondContact O-N 3.35Å; H800-D802 VanDerWaalsContact O-N 3.08Å; D802-N834 PolarHBondContact OD1-ND2 3.33Å; D802-N834 PolarHBondContact OD2-ND2 2.87Å
803	L	87.1	Confident	85.9	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.01	29%	0.287	C	S	.	.			trans	-115.7	125.2	-173.7	-67.7	-178.1	0	0	0	111.5	P678 I776 K777 L778 A781 L801 Y805 N834	P678-L803 HydrophobicContact CB-CD2 4.09Å; P678-L803 HydrophobicContact CG-CD2 4.07Å; I776-L803 HydrophobicContact CD1-CD1 4.43Å; I776-L803 HydrophobicContact CD1-CD2 4.31Å; I776-L803 HydrophobicContact CG1-CD1 4.19Å; I776-L803 HydrophobicContact CG2-CD1 3.95Å; I776-L803 HydrophobicContact CG2-CD2 3.63Å; I776-L803 HydrophobicContact CG2-CG 4.48Å; K777-L803 WeakPolarHBondContact O-CD1 3.34Å; L778-L803 HydrophobicContact CD2-CB 4.49Å; A781-L803 HydrophobicContact CB-CD1 3.99Å; A781-L803 HydrophobicContact CB-CG 4.04Å; L801-L803 HydrophobicContact CD1-CD2 4.39Å; L801-L803 HydrophobicContact CG-CD2 4.39Å; L803-Y805 VanDerWaalsContact O-CD1 3.29Å; L803-Y805 WeakPolarHBondContact O-CD1 3.47Å; L803-N834 PolarHBondContact O-ND2 3.35Å
804	Y	86.7	Confident	85.7	Confident	47 Å²	47	64.5 Å²	64.5	18%	0.184	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-80.9	131.9	177.8	-75.4	-104.8	0	0	0	110.2	Q677 P678 I679 A680	Q677-Y804 HydrophobicContact CB-CD2 4.06Å; Q677-Y804 HydrophobicContact CB-CE2 3.82Å; Q677-Y804 HydrophobicContact CG-CE2 3.8Å; Q677-Y804 PolarHBondContact NE2-OH 2.89Å; P678-Y804 PolarHBondContact O-N 3.18Å; I679-Y804 CarbonylContact C-O 3.59Å; I679-Y804 WeakPolarHBondContact CA-O 3.32Å; A680-Y804 PolarHBondContact N-O 2.96Å
805	Y	85.7	Confident	85.6	Confident	47 Å²	47	63.9 Å²	63.9	18%	0.184	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	142.3	-179.9	59.2	-92	0	0	0	114	L778 L803 V808 D832 A833 N834 H955 L957	L778-Y805 HydrophobicContact CD2-CD1 3.4Å; L778-Y805 HydrophobicContact CD2-CE1 3.82Å; L778-Y805 HydrophobicContact CD2-CG 3.97Å; L803-Y805 VanDerWaalsContact O-CD1 3.29Å; L803-Y805 WeakPolarHBondContact O-CD1 3.47Å; Y805-V808 HydrophobicContact CD2-CG2 4.11Å; Y805-V808 HydrophobicContact CE2-CG2 4.47Å; Y805-D832 PolarHBondContact OH-OD1 3.15Å; Y805-A833 VanDerWaalsContact CE2-CA 3.44Å; Y805-N834 HydrophobicContact CD1-CB 3.66Å; Y805-N834 HydrophobicContact CE1-CB 3.4Å; Y805-N834 HydrophobicContact CG-CB 4.35Å; Y805-N834 PolarHBondContact N-O 3.18Å; Y805-N834 PolarHBondContact O-N 3.07Å; Y805-H955 PolarHBondContact O-CE1 2.73Å; Y805-L957 VanDerWaalsContact C-CD1 3.47Å
806	Q	84.7	Confident	85.1	Confident	95 Å²	95	67.8 Å²	67.8	44%	0.444	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	153.8	176.4	57.6	158	-18	0	0	111.8	V808 L957	Q806-V808 WeakPolarHBondContact O-CG2 3.38Å; Q806-V808 PolarHBondContact O-N 2.92Å; Q806-L957 HydrophobicContact CB-CB 4.39Å
807	P	84.7	Confident	84.7	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-41.5	125.8	178.4	-36.7	38.4	0	0	0	115.3	V831 D832 A833 A838 V953 H955 K960 F962	P807-V831 HydrophobicContact CB-CG1 3.72Å; P807-V831 HydrophobicContact CG-CG1 4.46Å; P807-D832 CarbonylContact C-O 3.59Å; P807-D832 WeakPolarHBondContact CA-O 3.49Å; P807-A833 HydrophobicContact CG-CB 4.27Å; P807-A838 HydrophobicContact CG-CB 4.43Å; P807-V953 HydrophobicContact CB-CG1 4.18Å; P807-V953 HydrophobicContact CG-CG1 3.83Å; P807-H955 HydrophobicContact CG-CB 3.73Å; P807-K960 WeakPolarHBondContact O-CD 3.23Å; P807-K960 WeakPolarHBondContact O-CE 3.4Å; P807-K960 PolarHBondContact O-NZ 3.49Å; P807-F962 HydrophobicContact CB-CE2 4.34Å; P807-F962 HydrophobicContact CB-CZ 4.22Å
808	V	83.4	Confident	84	Confident	63 Å²	63	69.7 Å²	69.7	38%	0.382	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	134.5	175.9	-174.5	0	0	0	0	108.9	Y805 Q806 N810 V831 D832	Y805-V808 HydrophobicContact CD2-CG2 4.11Å; Y805-V808 HydrophobicContact CE2-CG2 4.47Å; Q806-V808 WeakPolarHBondContact O-CG2 3.38Å; Q806-V808 PolarHBondContact O-N 2.92Å; V808-N810 PolarHBondContact O-N 3.11Å; V808-V831 WeakPolarHBondContact O-CA 3.2Å; V808-D832 PolarHBondContact N-O 2.84Å; V808-D832 PolarHBondContact O-N 2.86Å
809	M	82.6	Confident	83.4	Confident	70 Å²	70	68.7 Å²	68.7	35%	0.345	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	121.8	174.4	-173.1	-171.5	-67.2	0	0	109.4	T813 T815 L829 F962	M809-T813 HydrophobicContact CE-CG2 4.22Å; M809-T813 HydrophobicContact CG-CG2 3.89Å; M809-T813 HydrophobicContact SD-CG2 3.7Å; M809-T815 HydrophobicContact CE-CG2 3.81Å; M809-T815 HydrophobicContact SD-CG2 4.1Å; M809-L829 HydrophobicContact CG-CD1 4.41Å; M809-F962 HydrophobicContact CB-CD1 4.22Å; M809-F962 HydrophobicContact CB-CE1 3.84Å; M809-F962 HydrophobicContact CE-CB 4.23Å; M809-F962 HydrophobicContact CE-CD1 3.57Å; M809-F962 HydrophobicContact CE-CE1 4.33Å; M809-F962 HydrophobicContact CE-CG 4.28Å
810	N	80	Confident	82.6	Confident	40 Å²	40	71.7 Å²	71.7	21%	0.214	33%	0.329	C	S	.	.			trans	-73.4	140.4	173.2	-173.1	-74	0	0	0	110	V808 R812 T813 Y830	V808-N810 PolarHBondContact O-N 3.11Å; N810-R812 PolarHBondContact O-N 2.91Å; N810-R812 WeakPolarHBondContact OD1-CB 3.5Å; N810-R812 WeakPolarHBondContact OD1-CG 3.41Å; N810-R812 PolarHBondContact OD1-N 2.9Å; N810-R812 VanDerWaalsContact OD1-N 3.14Å; N810-T813 WeakPolarHBondContact O-CB 3.27Å; N810-T813 PolarHBondContact O-N 3.29Å; N810-T813 PolarHBondContact O-OG1 2.9Å; N810-T813 VanDerWaalsContact O-OG1 3.05Å; N810-Y830 VanDerWaalsContact CB-O 3.31Å; N810-Y830 WeakPolarHBondContact CB-O 3.44Å; N810-Y830 PolarHBondContact N-O 2.99Å
811	R	73.7	Confident	81.7	Confident	239 Å²	239	73 Å²	73	90%	0.902	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-14.8	-178.1	-64.8	-174.7	-177.8	179.1	1.5	114.9	T813	R811-T813 VanDerWaalsContact C-N 3.31Å
812	R	76.4	Confident	80.9	Confident	195 Å²	195	75 Å²	75	74%	0.736	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-11.5	174.6	-64	175.4	-174.6	170.8	4	114.4	N810 Y830	N810-R812 PolarHBondContact O-N 2.91Å; N810-R812 WeakPolarHBondContact OD1-CB 3.5Å; N810-R812 WeakPolarHBondContact OD1-CG 3.41Å; N810-R812 PolarHBondContact OD1-N 2.9Å; N810-R812 VanDerWaalsContact OD1-N 3.14Å; R812-Y830 HydrophobicContact CB-CD2 4.15Å; R812-Y830 HydrophobicContact CB-CG 4.35Å
813	T	82.9	Confident	80.5	Confident	16 Å²	16	75.9 Å²	75.9	10%	0.098	36%	0.361	C	S	.	.			trans	-73.1	123.8	-179	-58.6	0	0	0	0	111.4	M809 N810 R811 T815 L829 Y830 F964	M809-T813 HydrophobicContact CE-CG2 4.22Å; M809-T813 HydrophobicContact CG-CG2 3.89Å; M809-T813 HydrophobicContact SD-CG2 3.7Å; N810-T813 WeakPolarHBondContact O-CB 3.27Å; N810-T813 PolarHBondContact O-N 3.29Å; N810-T813 PolarHBondContact O-OG1 2.9Å; N810-T813 VanDerWaalsContact O-OG1 3.05Å; R811-T813 VanDerWaalsContact C-N 3.31Å; T813-T815 HydrophobicContact CG2-CG2 4.38Å; T813-L829 HydrophobicContact CG2-CD1 3.96Å; T813-Y830 PolarHBondContact OG1-N 2.85Å; T813-Y830 PolarHBondContact OG1-O 3.33Å; T813-Y830 VanDerWaalsContact OG1-O 3.14Å; T813-F964 HydrophobicContact CG2-CE1 3.76Å; T813-F964 HydrophobicContact CG2-CZ 3.6Å
814	Q	82.1	Confident	80.3	Confident	140 Å²	140	79.2 Å²	79.2	65%	0.654	38%	0.384	S	S	*	.			trans	-99.2	109.8	173.8	-67.6	-177.4	-6.1	0	0	110.2	F964	Q814-F964 WeakPolarHBondContact O-CD1 3.38Å; Q814-F964 VanDerWaalsContact O-CE1 3.28Å; Q814-F964 WeakPolarHBondContact O-CE1 3.43Å
815	T	84.2	Confident	80.3	Confident	44 Å²	44	77.8 Å²	77.8	27%	0.27	38%	0.38	S	S	.	.			trans	-83.1	-25.8	-177.7	48.9	0	0	0	0	113.7	M809 T813 T963 F964 H965	M809-T815 HydrophobicContact CE-CG2 3.81Å; M809-T815 HydrophobicContact SD-CG2 4.1Å; T813-T815 HydrophobicContact CG2-CG2 4.38Å; T815-T963 WeakPolarHBondContact CG2-O 3.5Å; T815-F964 CarbonylContact O-C 3.55Å; T815-F964 WeakPolarHBondContact O-CA 3.42Å; T815-H965 PolarHBondContact O-N 3.15Å
816	H	82.1	Confident	80.3	Confident	113 Å²	113	78.1 Å²	78.1	52%	0.523	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	122.6	175.1	-67.5	-111.7	0	0	0	109.9	H965 I967	H816-H965 AromaticContact CE1-CD2 3.47Å; H816-H965 PolarHBondContact CE1-CD2 3.14Å; H816-H965 VanDerWaalsContact CE1-CD2 3.47Å; H816-H965 AromaticContact ND1-CD2 3.93Å; H816-H965 AromaticContact NE2-CD2 3.68Å; H816-I967 HydrophobicContact CB-CD1 4.45Å
817	V	83.3	Confident	80.4	Confident	22 Å²	22	73.6 Å²	73.6	13%	0.133	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	124.8	-178.5	-166.7	0	0	0	0	110	V819 V825 L827 H965 I967	V817-V819 HydrophobicContact CG1-CG2 4.05Å; V817-V825 HydrophobicContact CG1-CG2 3.56Å; V817-L827 HydrophobicContact CB-CD2 3.97Å; V817-L827 HydrophobicContact CG2-CD2 3.64Å; V817-H965 PolarHBondContact N-O 3.47Å; V817-I967 PolarHBondContact O-N 2.65Å
818	M	79	Confident	80.5	Confident	133 Å²	133	74.6 Å²	74.6	66%	0.655	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	125	-175.5	-73.5	-179.1	-81.4	0	0	111.3	I967	M818-I967 WeakPolarHBondContact CA-O 3.38Å; M818-I967 HydrophobicContact CG-CB 4.06Å; M818-I967 HydrophobicContact CG-CG2 4.23Å
819	V	79.3	Confident	80.7	Confident	3 Å²	3	71.6 Å²	71.6	2%	0.018	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	148.5	-166.5	-170.7	0	0	0	0	111.6	V817 E823 V825 V941 F946 L966 I967 K969	V817-V819 HydrophobicContact CG1-CG2 4.05Å; V819-E823 HydrophobicContact CG1-CB 3.72Å; V819-E823 HydrophobicContact CG1-CG 3.92Å; V819-E823 WeakPolarHBondContact CG1-OE2 3.46Å; V819-V825 HydrophobicContact CG1-CB 4.2Å; V819-V825 HydrophobicContact CG1-CG1 4.46Å; V819-V825 HydrophobicContact CG2-CB 3.78Å; V819-V825 HydrophobicContact CG2-CG1 4.04Å; V819-V825 HydrophobicContact CG2-CG2 3.64Å; V819-V941 HydrophobicContact CG1-CB 4.16Å; V819-V941 HydrophobicContact CG1-CG1 4.45Å; V819-V941 HydrophobicContact CG1-CG2 3.92Å; V819-F946 HydrophobicContact CB-CE1 4.48Å; V819-L966 HydrophobicContact CB-CD1 3.98Å; V819-L966 HydrophobicContact CG2-CD1 3.43Å; V819-L966 VanDerWaalsContact CG2-CD1 3.43Å; V819-I967 PolarHBondContact N-O 2.84Å; V819-K969 WeakPolarHBondContact O-CB 3.1Å; V819-K969 PolarHBondContact O-N 2.87Å
820	Q	74.3	Confident	80.9	Confident	100 Å²	100	72 Å²	72	47%	0.467	35%	0.354	S	S	.	.			trans	-88	160.1	173	-67.2	-172.7	-31.8	0	0	112.6	G822 E823 K969	Q820-G822 PolarHBondContact O-N 2.94Å; Q820-E823 HydrophobicContact CB-CB 4.37Å; Q820-E823 PolarHBondContact N-OE2 2.85Å; Q820-E823 WeakPolarHBondContact O-CB 3.22Å; Q820-E823 PolarHBondContact O-N 3.5Å; Q820-K969 HydrophobicContact CG-CB 4.1Å; Q820-K969 HydrophobicContact CG-CD 3.68Å; Q820-K969 HydrophobicContact CG-CG 4.46Å
821	L	71.1	Confident	81	Confident	95 Å²	95	70.1 Å²	70.1	50%	0.497	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	128.6	173.7	-75.8	162.1	0	0	0	110	E823 S943 F946	L821-E823 VanDerWaalsContact C-N 3.34Å; L821-S943 VanDerWaalsContact CD2-N 3.34Å; L821-F946 HydrophobicContact CD2-CE2 3.74Å; L821-F946 HydrophobicContact CD2-CZ 4.4Å; L821-F946 HydrophobicContact CG-CE2 4.12Å
822	G	70.7	Confident	81.5	Confident	44 Å²	44	61.5 Å²	61.5	45%	0.454	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.5	-12	-177.7	0	0	0	0	0	115.4	Q820 V941	Q820-G822 PolarHBondContact O-N 2.94Å; G822-V941 PolarHBondContact N-O 3.05Å
823	E	77.1	Confident	81.9	Confident	86 Å²	86	52.6 Å²	52.6	40%	0.402	28%	0.284	S	S	.	.			trans	-74.7	148.5	178.3	-175.9	174.2	-153	0	0	111.1	V819 Q820 L821 V941	V819-E823 HydrophobicContact CG1-CB 3.72Å; V819-E823 HydrophobicContact CG1-CG 3.92Å; V819-E823 WeakPolarHBondContact CG1-OE2 3.46Å; Q820-E823 HydrophobicContact CB-CB 4.37Å; Q820-E823 PolarHBondContact N-OE2 2.85Å; Q820-E823 WeakPolarHBondContact O-CB 3.22Å; Q820-E823 PolarHBondContact O-N 3.5Å; L821-E823 VanDerWaalsContact C-N 3.34Å; E823-V941 WeakPolarHBondContact O-CB 3.44Å; E823-V941 WeakPolarHBondContact O-CG2 3.4Å; E823-V941 PolarHBondContact O-N 3.02Å
824	S	82.6	Confident	81.9	Confident	72 Å²	72	53 Å²	53	50%	0.503	29%	0.286	S	S	.	.			trans	-96	125.9	178.1	75.4	0	0	0	0	110.9	F938 T939	S824-F938 CarbonylContact C-O 3.6Å; S824-F938 VanDerWaalsContact CA-O 3.3Å; S824-F938 WeakPolarHBondContact CA-O 3.41Å; S824-F938 WeakPolarHBondContact CB-O 3.07Å; S824-T939 VanDerWaalsContact CB-O 3.29Å; S824-T939 WeakPolarHBondContact CB-O 3.27Å
825	V	85.7	Confident	81.8	Confident	17 Å²	17	47.1 Å²	47.1	10%	0.103	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	162.5	-178.7	71.4	0	0	0	0	112	V817 V819 F938 V941 L966	V817-V825 HydrophobicContact CG1-CG2 3.56Å; V819-V825 HydrophobicContact CG1-CB 4.2Å; V819-V825 HydrophobicContact CG1-CG1 4.46Å; V819-V825 HydrophobicContact CG2-CB 3.78Å; V819-V825 HydrophobicContact CG2-CG1 4.04Å; V819-V825 HydrophobicContact CG2-CG2 3.64Å; V825-F938 HydrophobicContact CG1-CB 3.89Å; V825-F938 HydrophobicContact CG1-CD2 3.61Å; V825-F938 HydrophobicContact CG1-CE2 4.42Å; V825-F938 HydrophobicContact CG1-CG 3.93Å; V825-F938 PolarHBondContact N-O 2.89Å; V825-F938 PolarHBondContact O-N 3.37Å; V825-V941 HydrophobicContact CG1-CG2 3.63Å; V825-L966 HydrophobicContact CG1-CD1 4.02Å; V825-L966 HydrophobicContact CG1-CD2 4.28Å
826	T	85.5	Confident	81.5	Confident	54 Å²	54	48.7 Å²	48.7	33%	0.331	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	120.4	167.2	-56.4	0	0	0	0	109.4	F935 L936 R937	T826-F935 HydrophobicContact CG2-CB 3.8Å; T826-F935 HydrophobicContact CG2-CD1 3.82Å; T826-F935 HydrophobicContact CG2-CG 4.23Å; T826-L936 CarbonylContact C-O 3.56Å; T826-L936 WeakPolarHBondContact CA-O 3.3Å; T826-R937 HydrophobicContact CG2-CB 4.14Å; T826-R937 WeakPolarHBondContact OG1-CG 3.2Å
827	L	88.2	Confident	81.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	129.3	164.5	-53.3	179.1	0	0	0	107.2	V817 W842 F935 L936 F938 Y949 F964	V817-L827 HydrophobicContact CB-CD2 3.97Å; V817-L827 HydrophobicContact CG2-CD2 3.64Å; L827-W842 HydrophobicContact CB-CH2 3.92Å; L827-W842 HydrophobicContact CB-CZ3 4.2Å; L827-W842 HydrophobicContact CD1-CZ3 4.04Å; L827-F935 CarbonylContact O-C 3.51Å; L827-F935 VanDerWaalsContact O-CA 3.29Å; L827-F935 WeakPolarHBondContact O-CA 3.44Å; L827-L936 HydrophobicContact CB-CB 4.29Å; L827-L936 HydrophobicContact CD1-CD2 4.28Å; L827-L936 PolarHBondContact N-O 2.78Å; L827-L936 PolarHBondContact O-N 2.84Å; L827-F938 HydrophobicContact CD1-CE2 4.19Å; L827-F938 HydrophobicContact CG-CE2 4.15Å; L827-Y949 HydrophobicContact CD1-CD2 4.06Å; L827-Y949 HydrophobicContact CD1-CG 4.11Å; L827-F964 HydrophobicContact CB-CD1 4.14Å; L827-F964 HydrophobicContact CD1-CB 3.87Å; L827-F964 HydrophobicContact CD1-CG 4.36Å; L827-F964 HydrophobicContact CD2-CD1 4.48Å
828	A	86.8	Confident	81.1	Confident	20 Å²	20	49 Å²	49	17%	0.165	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	105.5	-173	0	0	0	0	0	110.7	Y830 F935	A828-Y830 HydrophobicContact CB-CD2 4.41Å; A828-Y830 HydrophobicContact CB-CE2 3.66Å; A828-F935 HydrophobicContact CB-CD1 3.73Å; A828-F935 HydrophobicContact CB-CE1 3.77Å
829	L	87.9	Confident	81.2	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	120.3	172	177.7	59.2	0	0	0	109.3	M809 T813 V831 W842 T933 F934 C951 V953 F962 F964	M809-L829 HydrophobicContact CG-CD1 4.41Å; T813-L829 HydrophobicContact CG2-CD1 3.96Å; L829-V831 HydrophobicContact CD1-CG2 3.72Å; L829-V831 HydrophobicContact CD2-CG2 4Å; L829-V831 HydrophobicContact CG-CG2 3.69Å; L829-W842 HydrophobicContact CB-CZ2 4.37Å; L829-T933 WeakPolarHBondContact O-CA 3.35Å; L829-F934 HydrophobicContact CB-CB 4.28Å; L829-F934 HydrophobicContact CD2-CD2 3.93Å; L829-F934 HydrophobicContact CG-CD2 4.29Å; L829-F934 PolarHBondContact N-O 3.12Å; L829-F934 PolarHBondContact O-N 2.84Å; L829-C951 HydrophobicContact CD2-CB 3.87Å; L829-C951 VanDerWaalsContact CD2-SG 3.55Å; L829-V953 HydrophobicContact CD2-CG2 3.78Å; L829-F962 HydrophobicContact CD1-CB 4.04Å; L829-F962 HydrophobicContact CD1-CD1 4.38Å; L829-F962 HydrophobicContact CD1-CD2 3.98Å; L829-F962 HydrophobicContact CD1-CE2 4.48Å; L829-F962 HydrophobicContact CD1-CG 3.88Å; L829-F962 HydrophobicContact CD2-CB 4.18Å; L829-F962 HydrophobicContact CD2-CD2 3.51Å; L829-F962 HydrophobicContact CD2-CE2 4.16Å; L829-F962 HydrophobicContact CD2-CG 4.1Å; L829-F962 HydrophobicContact CG-CD2 4.39Å; L829-F964 HydrophobicContact CB-CE2 4.13Å; L829-F964 HydrophobicContact CB-CZ 3.71Å; L829-F964 HydrophobicContact CD1-CE2 4.32Å; L829-F964 HydrophobicContact CD1-CZ 4.02Å; L829-F964 HydrophobicContact CG-CZ 4.38Å
830	Y	86.2	Confident	81.4	Confident	79 Å²	79	49.4 Å²	49.4	31%	0.31	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	123.2	171.2	-63.4	-91.1	0	0	0	108.6	N810 R812 T813 A828 T933	N810-Y830 VanDerWaalsContact CB-O 3.31Å; N810-Y830 WeakPolarHBondContact CB-O 3.44Å; N810-Y830 PolarHBondContact N-O 2.99Å; R812-Y830 HydrophobicContact CB-CD2 4.15Å; R812-Y830 HydrophobicContact CB-CG 4.35Å; T813-Y830 PolarHBondContact OG1-N 2.85Å; T813-Y830 PolarHBondContact OG1-O 3.33Å; T813-Y830 VanDerWaalsContact OG1-O 3.14Å; A828-Y830 HydrophobicContact CB-CD2 4.41Å; A828-Y830 HydrophobicContact CB-CE2 3.66Å; Y830-T933 HydrophobicContact CD1-CG2 3.51Å; Y830-T933 HydrophobicContact CE1-CG2 3.89Å; Y830-T933 HydrophobicContact CG-CG2 4.42Å
831	V	83	Confident	81.8	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	146.7	-171.7	158.4	0	0	0	0	111.2	P807 V808 L829 N931 L932 F962	P807-V831 HydrophobicContact CB-CG1 3.72Å; P807-V831 HydrophobicContact CG-CG1 4.46Å; V808-V831 WeakPolarHBondContact O-CA 3.2Å; L829-V831 HydrophobicContact CD1-CG2 3.72Å; L829-V831 HydrophobicContact CD2-CG2 4Å; L829-V831 HydrophobicContact CG-CG2 3.69Å; V831-N931 CarbonylContact O-C 3.54Å; V831-N931 WeakPolarHBondContact O-CA 3.32Å; V831-L932 HydrophobicContact CB-CB 4.28Å; V831-L932 HydrophobicContact CG1-CB 4.2Å; V831-L932 HydrophobicContact CG1-CD1 4.37Å; V831-L932 PolarHBondContact N-O 2.71Å; V831-L932 PolarHBondContact O-N 2.97Å; V831-F962 HydrophobicContact CG2-CE2 3.85Å; V831-F962 HydrophobicContact CG2-CZ 4.04Å
832	D	83.6	Confident	82.4	Confident	58 Å²	58	42.7 Å²	42.7	31%	0.31	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	134	175.2	-166.7	-18.9	0	0	0	108.5	Y805 P807 V808	Y805-D832 PolarHBondContact OH-OD1 3.15Å; P807-D832 CarbonylContact C-O 3.59Å; P807-D832 WeakPolarHBondContact CA-O 3.49Å; V808-D832 PolarHBondContact N-O 2.84Å; V808-D832 PolarHBondContact O-N 2.86Å
833	A	83.8	Confident	82.9	Confident	9 Å²	9	41.2 Å²	41.2	7%	0.074	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	146.2	-175	0	0	0	0	0	111	Y805 P807 P835 P836 L932	Y805-A833 VanDerWaalsContact CE2-CA 3.44Å; P807-A833 HydrophobicContact CG-CB 4.27Å; A833-P835 CarbonylContact C-O 3.55Å; A833-P835 CarbonylContact O-C 3.25Å; A833-P836 WeakPolarHBondContact O-CA 3.26Å; A833-L932 HydrophobicContact CB-CD1 4.08Å
834	N	84	Confident	83	Confident	25 Å²	25	38.9 Å²	38.9	13%	0.134	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	118.1	168.4	-166.5	25.3	0	0	0	110.2	D802 L803 Y805	D802-N834 PolarHBondContact OD1-ND2 3.33Å; D802-N834 PolarHBondContact OD2-ND2 2.87Å; L803-N834 PolarHBondContact O-ND2 3.35Å; Y805-N834 HydrophobicContact CD1-CB 3.66Å; Y805-N834 HydrophobicContact CE1-CB 3.4Å; Y805-N834 HydrophobicContact CG-CB 4.35Å; Y805-N834 PolarHBondContact N-O 3.18Å; Y805-N834 PolarHBondContact O-N 3.07Å
835	P	80.3	Confident	82.7	Confident	16 Å²	16	38.7 Å²	38.7	10%	0.104	20%	0.2	C	C	.	.	S	Bend	cis	-66.2	157.9	2.1	30.4	-38.9	0	0	0	114.4	A833 W837 H955 Q956	A833-P835 CarbonylContact C-O 3.55Å; A833-P835 CarbonylContact O-C 3.25Å; P835-W837 VanDerWaalsContact CG-NE1 3.27Å; P835-W837 PolarHBondContact O-N 3.38Å; P835-H955 PolarHBondContact O-NE2 2.63Å; P835-Q956 VanDerWaalsContact CG-CD 3.46Å; P835-Q956 HydrophobicContact CG-CG 3.92Å
836	P	77.9	Confident	81.3	Confident	76 Å²	76	42.4 Å²	42.4	49%	0.494	22%	0.22	S	C	.	.	S	Bend	trans	-79.4	48.8	-175.5	34.2	-38.2	0	0	0	113.1	A833	A833-P836 WeakPolarHBondContact O-CA 3.26Å
837	W	78.4	Confident	79.5	Confident	126 Å²	126	44.4 Å²	44.4	48%	0.477	23%	0.232	S	C	.	.			trans	-139.5	133	172.3	67.5	-99.3	0	0	0	110.8	P835 H955 Q956	P835-W837 VanDerWaalsContact CG-NE1 3.27Å; P835-W837 PolarHBondContact O-N 3.38Å; W837-H955 PolarHBondContact O-CD2 3.25Å; W837-Q956 HydrophobicContact CH2-CB 3.73Å; W837-Q956 HydrophobicContact CH2-CG 4.23Å; W837-Q956 HydrophobicContact CZ2-CB 3.64Å; W837-Q956 HydrophobicContact CZ2-CG 3.75Å
838	A	79	Confident	77	Confident	15 Å²	15	53.4 Å²	53.4	12%	0.124	27%	0.271	C	S	.	.			trans	-154.8	150.3	169.3	0	0	0	0	0	109.7	P807 L932 F934 V953 R954 H955	P807-A838 HydrophobicContact CG-CB 4.43Å; A838-L932 HydrophobicContact CB-CD1 3.62Å; A838-F934 HydrophobicContact CB-CZ 4.49Å; A838-F934 WeakPolarHBondContact O-CZ 3.44Å; A838-V953 HydrophobicContact CB-CG1 3.56Å; A838-R954 WeakPolarHBondContact CA-O 3.35Å; A838-R954 WeakPolarHBondContact CB-O 3.4Å; A838-H955 HydrophobicContact CB-CB 4.37Å
839	E	81	Confident	74.4	Confident	123 Å²	123	61.3 Å²	61.3	58%	0.575	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.7	156.4	173	-59.7	176.6	158.5	0	0	109.6	V953 R954	E839-V953 CarbonylContact O-C 3.5Å; E839-V953 VanDerWaalsContact O-CA 3.24Å; E839-V953 WeakPolarHBondContact O-CA 3.43Å; E839-V953 WeakPolarHBondContact O-CG1 3.16Å; E839-R954 HydrophobicContact CB-CB 4.4Å; E839-R954 PolarHBondContact N-O 3.19Å; E839-R954 PolarHBondContact O-N 3.04Å
840	A	83.6	Confident	71.6	Confident	23 Å²	23	68.4 Å²	68.4	19%	0.19	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	131.7	179.6	0	0	0	0	0	113.3	F934 Q952 V953	A840-F934 HydrophobicContact CB-CB 4.23Å; A840-F934 HydrophobicContact CB-CD1 3.33Å; A840-F934 HydrophobicContact CB-CD2 3.92Å; A840-F934 HydrophobicContact CB-CE1 3.49Å; A840-F934 VanDerWaalsContact CB-CE1 3.49Å; A840-F934 HydrophobicContact CB-CE2 4.05Å; A840-F934 HydrophobicContact CB-CG 3.55Å; A840-F934 HydrophobicContact CB-CZ 3.85Å; A840-Q952 WeakPolarHBondContact CA-O 3.45Å; A840-V953 HydrophobicContact CB-CG2 3.98Å
841	E	81.5	Confident	68.9	Low	41 Å²	41	73.9 Å²	73.9	19%	0.192	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	135.3	177.4	-64.6	171.9	127.2	0	0	109.9	F843 C951 Q952 R954	E841-F843 HydrophobicContact CB-CD2 4.49Å; E841-F843 HydrophobicContact CB-CE2 3.58Å; E841-F843 HydrophobicContact CB-CZ 3.88Å; E841-C951 CarbonylContact O-C 3.57Å; E841-C951 WeakPolarHBondContact O-CA 3.35Å; E841-Q952 PolarHBondContact N-O 3.42Å; E841-Q952 PolarHBondContact O-N 2.8Å; E841-R954 IonicContact OE1-CZ 3.77Å; E841-R954 IonicContact OE1-NH2 2.73Å; E841-R954 PolarHBondContact OE1-NH2 3.26Å; E841-R954 IonicContact OE2-CZ 2.72Å; E841-R954 IonicContact OE2-NE 2.73Å; E841-R954 PolarHBondContact OE2-NE 3.12Å; E841-R954 IonicContact OE2-NH2 3.18Å; E841-R954 PolarHBondContact OE2-NH2 2.75Å
842	W	83.4	Confident	66.3	Low	12 Å²	12	79.4 Å²	79.4	5%	0.045	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	131.4	176.5	-72.2	88.3	0	0	0	111.3	L827 L829 F934 L936 V950 C951 F964	L827-W842 HydrophobicContact CB-CH2 3.92Å; L827-W842 HydrophobicContact CB-CZ3 4.2Å; L827-W842 HydrophobicContact CD1-CZ3 4.04Å; L829-W842 HydrophobicContact CB-CZ2 4.37Å; W842-F934 HydrophobicContact CZ2-CB 4.48Å; W842-L936 HydrophobicContact CB-CD1 4.12Å; W842-L936 HydrophobicContact CB-CD2 4.35Å; W842-L936 HydrophobicContact CD2-CB 3.73Å; W842-L936 HydrophobicContact CD2-CD1 4.45Å; W842-L936 HydrophobicContact CD2-CD2 4.13Å; W842-L936 HydrophobicContact CD2-CG 4.32Å; W842-L936 HydrophobicContact CE3-CB 3.9Å; W842-L936 HydrophobicContact CE3-CD2 3.83Å; W842-L936 HydrophobicContact CE3-CG 4.42Å; W842-L936 HydrophobicContact CG-CB 4.23Å; W842-L936 HydrophobicContact CG-CD1 4.09Å; W842-L936 HydrophobicContact CG-CD2 4.39Å; W842-L936 HydrophobicContact CG-CG 4.48Å; W842-L936 HydrophobicContact CH2-CB 4.2Å; W842-L936 HydrophobicContact CZ2-CB 4.05Å; W842-L936 HydrophobicContact CZ3-CB 4.12Å; W842-L936 HydrophobicContact CZ3-CD2 4.45Å; W842-V950 WeakPolarHBondContact CA-O 3.25Å; W842-C951 HydrophobicContact CD2-CB 3.86Å; W842-C951 VanDerWaalsContact CE2-SG 3.53Å; W842-C951 HydrophobicContact CE3-CB 3.82Å; W842-C951 HydrophobicContact CH2-CB 3.91Å; W842-C951 HydrophobicContact CZ2-CB 3.92Å; W842-C951 HydrophobicContact CZ3-CB 3.86Å; W842-F964 AromaticContact CH2-CD2 3.71Å; W842-F964 HydrophobicContact CH2-CD2 3.71Å; W842-F964 AromaticContact CH2-CE2 3.61Å; W842-F964 HydrophobicContact CH2-CE2 3.61Å; W842-F964 HydrophobicContact CH2-CG 4.24Å; W842-F964 HydrophobicContact CH2-CZ 4.05Å; W842-F964 AromaticContact CZ3-CD2 3.56Å; W842-F964 HydrophobicContact CZ3-CD2 3.56Å; W842-F964 AromaticContact CZ3-CE2 3.94Å; W842-F964 HydrophobicContact CZ3-CE2 3.94Å; W842-F964 HydrophobicContact CZ3-CG 4.06Å
843	F	81.4	Confident	63.6	Low	13 Å²	13	79.5 Å²	79.5	6%	0.057	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	142.1	177.7	-60.6	-85.4	0	0	0	110.5	E841 R894 Y949 V950 Q952	E841-F843 HydrophobicContact CB-CD2 4.49Å; E841-F843 HydrophobicContact CB-CE2 3.58Å; E841-F843 HydrophobicContact CB-CZ 3.88Å; F843-R894 HydrophobicContact CD1-CG 4.21Å; F843-R894 HydrophobicContact CE1-CG 4.41Å; F843-Y949 CarbonylContact O-C 3.59Å; F843-Y949 VanDerWaalsContact O-CA 3.27Å; F843-Y949 WeakPolarHBondContact O-CA 3.34Å; F843-V950 PolarHBondContact N-O 3.09Å; F843-V950 PolarHBondContact O-N 2.79Å; F843-Q952 HydrophobicContact CD2-CB 4.16Å; F843-Q952 HydrophobicContact CE2-CB 3.74Å
844	Q	80.5	Confident	60.9	Low	37 Å²	37	88.9 Å²	88.9	17%	0.173	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	125.9	167.1	-172.9	169.4	-8.1	0	0	109.7	V944 Y949	Q844-V944 PolarHBondContact NE2-O 2.9Å; Q844-Y949 HydrophobicContact CB-CD1 3.94Å; Q844-Y949 HydrophobicContact CB-CE1 3.57Å; Q844-Y949 HydrophobicContact CG-CD1 4.2Å; Q844-Y949 HydrophobicContact CG-CE1 3.63Å; Q844-Y949 PolarHBondContact NE2-OH 3.07Å; Q844-Y949 PolarHBondContact OE1-OH 2.81Å
845	I	75.7	Confident	58.2	Low	68 Å²	68	96.1 Å²	96.1	35%	0.349	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	103.4	172.8	-59.3	-177.7	0	0	0	108.2	T847 T948 V950	I845-T847 PolarHBondContact O-N 3.2Å; I845-T847 VanDerWaalsContact O-N 3.12Å; I845-T948 HydrophobicContact CB-CG2 4.39Å; I845-T948 HydrophobicContact CD1-CG2 4.43Å; I845-T948 PolarHBondContact N-O 3.06Å; I845-V950 HydrophobicContact CD1-CG2 3.57Å; I845-V950 HydrophobicContact CG1-CG2 4.31Å
846	N	55.1	Low	55.8	Low	95 Å²	95	103.5 Å²	103.5	51%	0.508	54%	0.536	S	S	.	.			trans	-71.1	102.1	170.9	-71.9	-16.3	0	0	0	109.5	F848	N846-F848 PolarHBondContact O-N 2.97Å; N846-F848 VanDerWaalsContact O-N 3.11Å
847	T	47.5	Very low	53.5	Low	97 Å²	97	106 Å²	106	60%	0.595	55%	0.545	S	S	*	.			trans	-68.9	103.8	167	52.8	0	0	0	0	108.9	I845 K849	I845-T847 PolarHBondContact O-N 3.2Å; I845-T847 VanDerWaalsContact O-N 3.12Å; T847-K849 PolarHBondContact O-N 2.84Å
848	F	37.1	Very low	51.2	Low	188 Å²	188	105.7 Å²	105.7	83%	0.825	56%	0.562	S	S	*	*			trans	-62	99.2	169.7	-91	-96.5	0	0	0	109.6	N846 D850	N846-F848 PolarHBondContact O-N 2.97Å; N846-F848 VanDerWaalsContact O-N 3.11Å; F848-D850 PolarHBondContact O-N 3.23Å
849	K	31.8	Very low	48.8	Very low	187 Å²	187	113.5 Å²	113.5	81%	0.813	60%	0.596	S	S	*	*			trans	-81.2	92.7	154	-82.2	-169.6	170.7	-169.4	0	107	T847	T847-K849 PolarHBondContact O-N 2.84Å
850	D	29.5	Very low	46.3	Very low	148 Å²	148	115.9 Å²	115.9	79%	0.791	61%	0.608	S	S	*	*			trans	176.9	78.6	149.8	-89	-21	0	0	0	109.9	F848	F848-D850 PolarHBondContact O-N 3.23Å
851	E	29.5	Very low	43.6	Very low	194 Å²	194	126 Å²	126	91%	0.907	64%	0.643	S	S	*	*			trans	-163.3	46.4	152.8	-122.6	173.5	-148.5	0	0	113	G853	E851-G853 PolarHBondContact O-N 2.82Å
852	A	26.9	Very low	41.1	Very low	116 Å²	116	130 Å²	130	96%	0.959	67%	0.669	S	S	*	*			trans	-80.8	63.5	174.5	0	0	0	0	0	111.7
853	G	28	Very low	38.5	Very low	61 Å²	61	136.3 Å²	136.3	63%	0.629	70%	0.699	S	S	*	*			trans	171.4	59.5	179.7	0	0	0	0	0	119.8	E851	E851-G853 PolarHBondContact O-N 2.82Å
854	K	27.9	Very low	35.9	Very low	206 Å²	206	141.6 Å²	141.6	90%	0.896	74%	0.735	S	S	*	*			trans	178.6	96.5	144.1	-100.5	157	-174.9	177.2	0	113.1
855	M	27.1	Very low	33.3	Very low	176 Å²	176	147.5 Å²	147.5	87%	0.867	76%	0.762	S	S	*	*				178.4	131.6	108.7	-91.9	-158.6	74.5	0	0	109
856	H	29.4	Very low	30.9	Very low	171 Å²	171	148.8 Å²	148.8	79%	0.792	78%	0.783	S	S	*	*			trans	-107.7	146	171.7	-129.9	-84	0	0	0	108
857	N	28.9	Very low	29.6	Very low	129 Å²	129	154.9 Å²	154.9	69%	0.69	80%	0.801	S	S	*	*			trans	70.6	143.6	175.1	-44.2	-5.3	0	0	0	112.9
858	S	30.6	Very low	28.6	Very low	119 Å²	119	159.6 Å²	159.6	83%	0.832	81%	0.813	S	S	*	*			cis	-97.6	151.2	15.1	53.3	0	0	0	0	116
859	E	28.5	Very low	27.9	Very low	180 Å²	180	159.3 Å²	159.3	84%	0.841	82%	0.815	S	S	*	*			trans	-80.9	156.9	171.9	-56.5	164.3	135	0	0	111.7
860	Q	27.4	Very low	28.3	Very low	173 Å²	173	155.7 Å²	155.7	81%	0.808	81%	0.81	S	S	*	*				166.2	97.8	120.3	-176	171	27.8	0	0	110.8
861	Y	27.4	Very low	28.2	Very low	236 Å²	236	154.2 Å²	154.2	93%	0.925	81%	0.809	S	S	*	*			trans	-156	150.9	141.6	-118.5	-77.6	0	0	0	109.8
862	V	29.8	Very low	27.9	Very low	124 Å²	124	152.9 Å²	152.9	75%	0.752	80%	0.802	S	S	*	*			trans	-107.9	138.5	-161.6	172	0	0	0	0	112.1
863	E	28.6	Very low	28	Very low	144 Å²	144	152.6 Å²	152.6	67%	0.673	78%	0.784	S	S	*	*			trans	-73.8	145.5	170.9	-177.9	-170	155.6	0	0	111.7	Q865	E863-Q865 WeakPolarHBondContact OE1-CG 3.4Å
864	P	27.7	Very low	27.9	Very low	124 Å²	124	157.2 Å²	157.2	81%	0.805	79%	0.794	S	S	*	*			trans	-129	146.6	141.2	35.8	-26.6	0	0	0	113.9
865	Q	24.7	Very low	27.9	Very low	161 Å²	161	155.5 Å²	155.5	75%	0.752	78%	0.783	S	S	*	*			trans	-88.3	148.3	-172.7	-61.8	163.8	-17.2	0	0	113	E863	E863-Q865 WeakPolarHBondContact OE1-CG 3.4Å
866	A	25.3	Very low	27.8	Very low	95 Å²	95	150.1 Å²	150.1	79%	0.785	77%	0.772	S	S	*	*			trans	-157.5	96.8	159.2	0	0	0	0	0	113.8
867	Y	27.1	Very low	27.6	Very low	223 Å²	223	151.2 Å²	151.2	88%	0.875	77%	0.771	S	S	*	*			trans	29.2	129.4	141.1	-75.9	-88.3	0	0	0	123.6
868	F	26.8	Very low	27.6	Very low	196 Å²	196	150.2 Å²	150.2	86%	0.86	77%	0.771	S	S	*	*			trans	-71.8	156.8	140.8	-69.7	-118.3	0	0	0	108.3
869	E	22.6	Very low	27.3	Very low	183 Å²	183	154 Å²	154	86%	0.855	78%	0.776	S	S	*	*			cis	-144.8	176.3	39.2	-99	-165.8	126.8	0	0	112.7
870	P	40.7	Very low	27.3	Very low	110 Å²	110	149.4 Å²	149.4	71%	0.714	76%	0.764	S	S	*	*			trans	-95.4	168.2	-162.6	40.2	-38.7	0	0	0	115.3
871	P	28.2	Very low	27.4	Very low	118 Å²	118	148.9 Å²	148.9	77%	0.766	76%	0.755	S	S	*	*				-151.1	159.1	95.8	39.6	-22.4	0	0	0	118.1
872	Q	23.5	Very low	27.3	Very low	166 Å²	166	144.3 Å²	144.3	78%	0.776	75%	0.747	S	S	*	*			trans	53.8	130.1	145.4	-66.7	-72.4	-28.3	0	0	123.5
873	I	28.1	Very low	27	Very low	110 Å²	110	143.7 Å²	143.7	56%	0.564	75%	0.748	S	S	*	*			trans	45	111.9	153.6	-56.3	162.3	0	0	0	120
874	N	26.6	Very low	26.7	Very low	157 Å²	157	146.6 Å²	146.6	84%	0.84	75%	0.753	S	S	*	*				-156.5	150.2	127.3	-151.8	-23.3	0	0	0	111.3	G876	N874-G876 PolarHBondContact O-N 2.93Å; N874-G876 VanDerWaalsContact O-N 3.16Å
875	Y	27.3	Very low	26.5	Very low	171 Å²	171	145.4 Å²	145.4	67%	0.671	75%	0.745	S	S	*	*			trans	-75	102.6	-178.1	-79.9	-91.7	0	0	0	112.5	D720	D720-Y875 WeakPolarHBondContact CB-OH 2.99Å; D720-Y875 VanDerWaalsContact CG-OH 3.3Å; D720-Y875 WeakPolarHBondContact OD2-CE2 2.99Å; D720-Y875 PolarHBondContact OD2-OH 2.94Å
876	G	24.8	Very low	26.5	Very low	62 Å²	62	149.4 Å²	149.4	64%	0.639	75%	0.754	S	S	*	*			trans	-128.8	90.6	177.2	0	0	0	0	0	113.2	N874 P878	N874-G876 PolarHBondContact O-N 2.93Å; N874-G876 VanDerWaalsContact O-N 3.16Å; G876-P878 VanDerWaalsContact O-CD 3.23Å; G876-P878 WeakPolarHBondContact O-CD 3.38Å
877	Y	25.3	Very low	26.5	Very low	195 Å²	195	150.7 Å²	150.7	77%	0.765	75%	0.751	S	S	*	*			trans	-61.7	119.1	154.6	-110.7	-80.2	0	0	0	107.6	L715 Q879	L715-Y877 WeakPolarHBondContact CD2-OH 3.31Å; Y877-Q879 PolarHBondContact O-N 2.85Å
878	P	28.7	Very low	26.4	Very low	107 Å²	107	150.8 Å²	150.8	70%	0.695	75%	0.75	S	S	*	*			trans	-64.2	107.3	-175.6	-25.4	36.7	0	0	0	111.9	G876 S880	G876-P878 VanDerWaalsContact O-CD 3.23Å; G876-P878 WeakPolarHBondContact O-CD 3.38Å; P878-S880 PolarHBondContact O-N 2.86Å
879	Q	25.4	Very low	26.5	Very low	200 Å²	200	153.1 Å²	153.1	94%	0.935	75%	0.753	S	S	*	*			trans	-75.5	65.4	169.9	-70.7	-171.3	-7.7	0	0	110.5	Y877	Y877-Q879 PolarHBondContact O-N 2.85Å
880	S	27.3	Very low	26.6	Very low	83 Å²	83	148.7 Å²	148.7	58%	0.58	74%	0.738	S	S	*	*			trans	-162.6	96.1	167.3	44	0	0	0	0	111.2	P878	P878-S880 PolarHBondContact O-N 2.86Å
881	Y	29.9	Very low	26	Very low	161 Å²	161	150.8 Å²	150.8	63%	0.631	74%	0.742	S	S	*	*			trans	-116.4	27.4	153.9	-98.2	-76.6	0	0	0	110.4
882	D	24.5	Very low	26.1	Very low	141 Å²	141	152.7 Å²	152.7	75%	0.754	74%	0.739	S	S	*	*			trans	-85.7	152.6	162.9	-70	-66.1	0	0	0	109.5
883	S	24	Very low	26.5	Very low	110 Å²	110	151.3 Å²	151.3	77%	0.769	74%	0.737	S	S	*	*			trans	56.5	65.6	-170.2	68.9	0	0	0	0	114.9	P885	S883-P885 WeakPolarHBondContact O-CD 3.39Å
884	W	23.5	Very low	26.6	Very low	205 Å²	205	151.8 Å²	151.8	78%	0.777	73%	0.731	S	S	*	*				-68.1	116.9	129.6	-85.2	35.4	0	0	0	106.3
885	P	22.9	Very low	26.8	Very low	100 Å²	100	151.7 Å²	151.7	65%	0.649	72%	0.724	S	S	*	*			trans	-58.5	145.3	172.6	-21	33.3	0	0	0	109	S883 V887	S883-P885 WeakPolarHBondContact O-CD 3.39Å; P885-V887 PolarHBondContact O-N 2.9Å
886	R	25.2	Very low	27	Very low	245 Å²	245	151.1 Å²	151.1	93%	0.925	73%	0.727	S	S	*	*			trans	-65.8	85.5	157.1	-74.6	-176.7	-177.6	160.6	0.9	107.2	R888	R886-R888 PolarHBondContact O-N 2.89Å
887	V	25.1	Very low	27.7	Very low	121 Å²	121	149 Å²	149	73%	0.733	70%	0.703	S	S	*	*			trans	-54.1	109.7	168.5	178.6	0	0	0	0	105.7	P885 R889	P885-V887 PolarHBondContact O-N 2.9Å; V887-R889 PolarHBondContact O-N 2.77Å
888	R	24.8	Very low	28.4	Very low	226 Å²	226	144.5 Å²	144.5	85%	0.853	69%	0.689	S	S	*	*			trans	-53.6	136.1	174.6	-73.2	-176.3	176.1	-175.5	-0.6	106.7	R886 T890	R886-R888 PolarHBondContact O-N 2.89Å; R888-T890 PolarHBondContact O-N 2.83Å
889	R	27.6	Very low	29.1	Very low	244 Å²	244	141.9 Å²	141.9	92%	0.921	67%	0.668	S	S	*	*			trans	-61.6	88.8	172.4	-70.2	-178.8	-179.8	169.8	-0.9	108.9	V887 I891	V887-R889 PolarHBondContact O-N 2.77Å; R889-I891 PolarHBondContact O-N 2.94Å
890	T	25.5	Very low	29.9	Very low	90 Å²	90	135.5 Å²	135.5	55%	0.552	65%	0.646	S	S	*	*			trans	-58.5	133.4	155.1	42.2	0	0	0	0	106.7	R888 F892	R888-T890 PolarHBondContact O-N 2.83Å; T890-F892 PolarHBondContact O-N 2.92Å; T890-F892 VanDerWaalsContact OG1-CE2 3.23Å; T890-F892 WeakPolarHBondContact OG1-CE2 3.25Å
891	I	27.5	Very low	30.5	Very low	154 Å²	154	136.1 Å²	136.1	79%	0.79	65%	0.646	S	S	*	*			trans	-75.8	81.9	-179.1	-56.4	174.9	0	0	0	107.5	R889 N893	R889-I891 PolarHBondContact O-N 2.94Å; I891-N893 PolarHBondContact O-N 2.85Å
892	F	31.1	Very low	30.8	Very low	158 Å²	158	132.3 Å²	132.3	69%	0.693	64%	0.643	S	S	*	*			trans	-62.5	118.5	157.2	-66.9	-76.4	0	0	0	106.8	T890 R894	T890-F892 PolarHBondContact O-N 2.92Å; T890-F892 VanDerWaalsContact OG1-CE2 3.23Å; T890-F892 WeakPolarHBondContact OG1-CE2 3.25Å; F892-R894 PolarHBondContact O-N 3.46Å
893	N	31.1	Very low	31.1	Very low	138 Å²	138	131.3 Å²	131.3	74%	0.738	64%	0.638	S	S	*	*			trans	-67.3	81.4	170.5	-78.8	-20.1	0	0	0	109	I891 F895	I891-N893 PolarHBondContact O-N 2.85Å; N893-F895 VanDerWaalsContact C-N 3.3Å; N893-F895 PolarHBondContact O-N 2.79Å
894	R	30.7	Very low	31.6	Very low	120 Å²	120	135.5 Å²	135.5	45%	0.453	64%	0.643	S	S	.	*			trans	-65.7	88.1	174.2	-179.2	-171.9	-92.8	-150.3	-5.5	107.7	F843 F892 E896 E961	F843-R894 HydrophobicContact CD1-CG 4.21Å; F843-R894 HydrophobicContact CE1-CG 4.41Å; F892-R894 PolarHBondContact O-N 3.46Å; R894-E896 PolarHBondContact O-N 2.82Å; R894-E896 VanDerWaalsContact O-N 3.11Å; R894-E961 IonicContact NH2-OE1 3.57Å
895	F	31.5	Very low	31.7	Very low	154 Å²	154	131.7 Å²	131.7	68%	0.675	65%	0.647	S	S	*	*			trans	-57.2	114.8	171	-98	-86.8	0	0	0	109.4	N893 S897	N893-F895 VanDerWaalsContact C-N 3.3Å; N893-F895 PolarHBondContact O-N 2.79Å; F895-S897 PolarHBondContact O-N 3.42Å; F895-S897 PolarHBondContact O-OG 3.26Å
896	E	31.3	Very low	32.1	Very low	159 Å²	159	131 Å²	131	74%	0.743	66%	0.659	S	S	*	*			trans	-63	100.4	-179.6	-69.9	-174.9	147.4	0	0	110.3	R894	R894-E896 PolarHBondContact O-N 2.82Å; R894-E896 VanDerWaalsContact O-N 3.11Å
897	S	39.1	Very low	32.2	Very low	18 Å²	18	127.7 Å²	127.7	13%	0.126	65%	0.653	C	S	.	*			trans	-135.5	57.9	-179.2	43.5	0	0	0	0	108.6	F895 L899	F895-S897 PolarHBondContact O-N 3.42Å; F895-S897 PolarHBondContact O-OG 3.26Å; S897-L899 PolarHBondContact O-N 3.26Å
898	H	40.6	Very low	32.4	Very low	101 Å²	101	131 Å²	131	47%	0.468	66%	0.661	S	S	.	*			trans	-64.2	127.1	-177.3	-65.7	-101.7	0	0	0	110.9
899	L	43.2	Very low	32.6	Very low	51 Å²	51	126.2 Å²	126.2	27%	0.267	65%	0.652	S	S	.	*	B	Isolated β-bridge	trans	-106.2	89.1	155.5	-87.6	75.5	0	0	0	107.6	S897 I920 A922 L936	S897-L899 PolarHBondContact O-N 3.26Å; L899-I920 HydrophobicContact CD2-CG2 4.24Å; L899-A922 HydrophobicContact CB-CB 4.12Å; L899-A922 HydrophobicContact CD2-CB 4.39Å; L899-L936 HydrophobicContact CD2-CD1 4.47Å
900	S	41.1	Very low	32.5	Very low	67 Å²	67	122.3 Å²	122.3	47%	0.469	65%	0.649	S	S	.	*			trans	-75.4	150.1	166.9	-177.6	0	0	0	0	110.3	S902	S900-S902 WeakPolarHBondContact CB-OG 3.2Å; S900-S902 PolarHBondContact O-N 3.3Å; S900-S902 PolarHBondContact OG-N 3.17Å; S900-S902 PolarHBondContact OG-OG 2.67Å
901	T	40.5	Very low	32.5	Very low	96 Å²	96	128.9 Å²	128.9	59%	0.589	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	4.6	172.5	39.5	0	0	0	0	114.2
902	S	37.2	Very low	32.7	Very low	81 Å²	81	130.5 Å²	130.5	57%	0.566	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-25	-173.2	50.4	0	0	0	0	116.2	S900	S900-S902 WeakPolarHBondContact CB-OG 3.2Å; S900-S902 PolarHBondContact O-N 3.3Å; S900-S902 PolarHBondContact OG-N 3.17Å; S900-S902 PolarHBondContact OG-OG 2.67Å
903	D	30.1	Very low	32.6	Very low	120 Å²	120	127.1 Å²	127.1	64%	0.642	66%	0.664	S	S	*	*			trans	-108	84.5	-151.9	-60.5	-11	0	0	0	114.2
904	F	33.7	Very low	33.1	Very low	198 Å²	198	123.4 Å²	123.4	87%	0.868	64%	0.643	S	S	*	*			trans	-148.8	76.5	166.3	-100.5	-68.7	0	0	0	114.6
905	S	27	Very low	33.6	Very low	124 Å²	124	121.2 Å²	121.2	87%	0.867	66%	0.658	S	S	*	*	S	Bend	trans	-155.7	123	156	64	0	0	0	0	111.9
906	G	30.1	Very low	34.1	Very low	87 Å²	87	120.3 Å²	120.3	90%	0.897	66%	0.656	S	S	*	*			trans	109.4	146.1	176.8	0	0	0	0	0	114.2
907	E	27.3	Very low	35.3	Very low	174 Å²	174	116.1 Å²	116.1	81%	0.813	63%	0.633	S	S	*	*			trans	-136.3	122.4	-175.7	173.8	177.6	-137.2	0	0	110.3
908	Q	30.5	Very low	36.1	Very low	192 Å²	192	123.6 Å²	123.6	90%	0.897	66%	0.663	S	S	*	*			trans	-170.5	167.8	144.6	-107.6	169.1	47.8	0	0	111.5
909	N	27.4	Very low	37.5	Very low	125 Å²	125	119.7 Å²	119.7	67%	0.668	65%	0.646	S	S	*	*			trans	-109.9	136.1	-159.2	-57.7	-84.7	0	0	0	113.8
910	L	25.9	Very low	39	Very low	162 Å²	162	118.1 Å²	118.1	85%	0.848	64%	0.638	S	S	*	*				-170.8	158	117.1	-131.2	69.2	0	0	0	114.2
911	R	26.7	Very low	40.8	Very low	227 Å²	227	119.1 Å²	119.1	86%	0.857	63%	0.634	S	S	*	*	S	Bend	trans	66.4	159.4	175.1	-71	-173	169.1	-171.1	-3.4	116.7
912	Q	31	Very low	42.5	Very low	188 Å²	188	115.8 Å²	115.8	88%	0.879	62%	0.616	S	S	*	*			trans	-99.7	121.6	-160	-67.9	165.3	-58.7	0	0	112.6
913	S	28.7	Very low	44.3	Very low	87 Å²	87	115 Å²	115	61%	0.608	61%	0.61	S	S	*	*			trans	-146.2	175.8	158.1	72.9	0	0	0	0	108.7	G915	S913-G915 PolarHBondContact O-N 2.63Å; S913-G915 VanDerWaalsContact O-N 3.08Å
914	I	42.3	Very low	46.3	Very low	61 Å²	61	112.4 Å²	112.4	31%	0.313	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-72.4	-2.1	-168.4	-76.7	174.2	0	0	0	114.6	Q916 R917	I914-Q916 PolarHBondContact O-N 3.05Å; I914-R917 PolarHBondContact O-N 2.9Å; I914-R917 VanDerWaalsContact O-N 3.15Å
915	G	41.1	Very low	47.7	Very low	73 Å²	73	104.3 Å²	104.3	75%	0.753	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-58.7	-4.9	169.1	0	0	0	0	0	115.9	S913	S913-G915 PolarHBondContact O-N 2.63Å; S913-G915 VanDerWaalsContact O-N 3.08Å
916	Q	42.3	Very low	49.2	Very low	136 Å²	136	104.7 Å²	104.7	64%	0.636	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-96.5	-2.1	175.3	-67.6	-166.9	-18.7	0	0	115.5	I914 K918	I914-Q916 PolarHBondContact O-N 3.05Å; Q916-K918 VanDerWaalsContact C-N 3.27Å; Q916-K918 PolarHBondContact O-N 2.85Å
917	R	54.8	Low	50.3	Low	70 Å²	70	101.8 Å²	101.8	26%	0.264	54%	0.542	S	S	.	.			trans	-74.8	76.6	173.1	-71.3	-161.8	-170.9	-169.5	11.5	111.3	I914 N919 I920 V944 D945	I914-R917 PolarHBondContact O-N 2.9Å; I914-R917 VanDerWaalsContact O-N 3.15Å; R917-N919 PolarHBondContact O-N 3.43Å; R917-I920 HydrophobicContact CB-CD1 4.43Å; R917-I920 HydrophobicContact CB-CG1 4.46Å; R917-I920 PolarHBondContact O-N 3.26Å; R917-V944 PolarHBondContact NH1-O 3.04Å; R917-D945 IonicContact CZ-OD1 3.25Å; R917-D945 IonicContact NH1-OD1 3.11Å; R917-D945 PolarHBondContact NH1-OD1 3.33Å
918	K	57.7	Low	51.1	Low	175 Å²	175	101 Å²	101	76%	0.761	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	0.6	173.4	-64.7	-170.6	177.8	-174.2	0	115.3	Q916 F921	Q916-K918 VanDerWaalsContact C-N 3.27Å; Q916-K918 PolarHBondContact O-N 2.85Å; K918-F921 VanDerWaalsContact O-CE2 3.3Å; K918-F921 WeakPolarHBondContact O-CE2 3.43Å; K918-F921 WeakPolarHBondContact O-CZ 3.43Å
919	N	68.1	Low	52	Low	19 Å²	19	99 Å²	99	10%	0.102	53%	0.527	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-21.3	175	-72.7	57.8	0	0	0	113.5	R917 F938 T939 E940 K942	R917-N919 PolarHBondContact O-N 3.43Å; N919-F938 CarbonylContact O-C 3.59Å; N919-F938 VanDerWaalsContact O-CA 3.29Å; N919-F938 WeakPolarHBondContact O-CA 3.47Å; N919-T939 WeakPolarHBondContact CA-OG1 3.43Å; N919-T939 PolarHBondContact O-N 2.93Å; N919-T939 PolarHBondContact O-OG1 2.8Å; N919-E940 WeakPolarHBondContact ND2-CB 3.37Å; N919-E940 PolarHBondContact ND2-O 2.79Å; N919-E940 PolarHBondContact ND2-OE2 2.73Å; N919-K942 VanDerWaalsContact CG-NZ 3.26Å; N919-K942 WeakPolarHBondContact ND2-CE 3.42Å; N919-K942 PolarHBondContact ND2-NZ 2.96Å; N919-K942 PolarHBondContact OD1-NZ 3.07Å
920	I	75.5	Confident	53.1	Low	18 Å²	18	94.8 Å²	94.8	9%	0.092	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	130.9	-167.1	-49	178.9	0	0	0	110.5	L899 R917 L936 R937 F938	L899-I920 HydrophobicContact CD2-CG2 4.24Å; R917-I920 HydrophobicContact CB-CD1 4.43Å; R917-I920 HydrophobicContact CB-CG1 4.46Å; R917-I920 PolarHBondContact O-N 3.26Å; I920-L936 HydrophobicContact CG2-CD1 3.67Å; I920-L936 HydrophobicContact CG2-CG 4.01Å; I920-R937 CarbonylContact C-O 3.58Å; I920-R937 WeakPolarHBondContact CA-O 3.47Å; I920-F938 HydrophobicContact CD1-CD1 3.95Å; I920-F938 HydrophobicContact CD1-CE1 3.68Å; I920-F938 HydrophobicContact CG1-CD1 3.77Å; I920-F938 HydrophobicContact CG1-CE1 3.98Å; I920-F938 HydrophobicContact CG2-CD1 4.47Å; I920-F938 HydrophobicContact CG2-CE1 4.3Å; I920-F938 HydrophobicContact CG2-CZ 4.46Å
921	F	78.5	Confident	54.9	Low	89 Å²	89	89.1 Å²	89.1	39%	0.39	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	126.4	-178.9	-59.3	-88.1	0	0	0	110.9	K918 R937 T939	K918-F921 VanDerWaalsContact O-CE2 3.3Å; K918-F921 WeakPolarHBondContact O-CE2 3.43Å; K918-F921 WeakPolarHBondContact O-CZ 3.43Å; F921-R937 PolarHBondContact N-O 3.33Å; F921-R937 PolarHBondContact O-N 3.38Å; F921-T939 HydrophobicContact CD2-CG2 4.06Å; F921-T939 HydrophobicContact CE2-CG2 3.79Å
922	A	77.2	Confident	57.4	Low	26 Å²	26	79 Å²	79	22%	0.215	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	144.3	167.8	0	0	0	0	0	110.2	L899 F935 L936	L899-A922 HydrophobicContact CB-CB 4.12Å; L899-A922 HydrophobicContact CD2-CB 4.39Å; A922-F935 CarbonylContact C-O 3.56Å; A922-F935 WeakPolarHBondContact CA-O 3.33Å; A922-L936 HydrophobicContact CB-CD1 4.2Å
923	S	74.4	Confident	59.8	Low	63 Å²	63	70.6 Å²	70.6	44%	0.441	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	126.5	176.2	177.9	0	0	0	0	109.9	F935	S923-F935 PolarHBondContact N-O 2.91Å; S923-F935 PolarHBondContact O-N 3.08Å
924	S	73	Confident	62.6	Low	66 Å²	66	66.9 Å²	66.9	46%	0.462	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	164.9	160.7	53.1	0	0	0	0	110.5	T933	S924-T933 CarbonylContact C-O 3.45Å; S924-T933 WeakPolarHBondContact CA-O 3.35Å
925	G	62.4	Low	64.6	Low	29 Å²	29	65.4 Å²	65.4	30%	0.299	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	138.5	172.4	0	0	0	0	0	111.4	T933	G925-T933 PolarHBondContact N-O 2.89Å; G925-T933 PolarHBondContact O-N 2.02Å; G925-T933 PolarHBondContact O-OG1 2.84Å
926	T	58.5	Low	66.7	Low	131 Å²	131	62.1 Å²	62.1	80%	0.804	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	124.4	174	41.2	0	0	0	0	110.3
927	G	53.3	Low	68.7	Low	27 Å²	27	61.7 Å²	61.7	28%	0.278	33%	0.331	S	S	.	.			trans	-75.6	156.8	172	0	0	0	0	0	112.1	Y929 G930 N931	G927-Y929 PolarHBondContact O-N 3.08Å; G927-G930 PolarHBondContact O-N 3.4Å; G927-N931 WeakPolarHBondContact CA-O 3.36Å; G927-N931 PolarHBondContact N-O 2.82Å
928	L	44.2	Very low	70.2	Confident	157 Å²	157	58.3 Å²	58.3	82%	0.822	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	7.4	-179.2	-88.2	150.9	0	0	0	116.6	S748	S748-L928 PolarHBondContact OG-O 3.25Å; S748-L928 VanDerWaalsContact OG-O 3.13Å
929	Y	48.2	Very low	71.3	Confident	149 Å²	149	53.4 Å²	53.4	58%	0.584	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.3	9.8	-169	-68.4	-95	0	0	0	112.4	S748 G927 N931	S748-Y929 VanDerWaalsContact CB-CE1 3.4Å; S748-Y929 WeakPolarHBondContact OG-CE1 3.49Å; G927-Y929 PolarHBondContact O-N 3.08Å; Y929-N931 WeakPolarHBondContact CB-OD1 3.23Å; Y929-N931 PolarHBondContact O-N 2.71Å; Y929-N931 PolarHBondContact O-OD1 2.94Å
930	G	51.9	Low	71.7	Confident	38 Å²	38	56.4 Å²	56.4	39%	0.392	32%	0.316	S	S	.	.	S	Bend	trans	85.7	-17.5	-171.3	0	0	0	0	0	114.1	G927 L932	G927-G930 PolarHBondContact O-N 3.4Å; G930-L932 PolarHBondContact O-N 3.19Å
931	N	64.1	Low	71.9	Confident	43 Å²	43	55.6 Å²	55.6	23%	0.23	31%	0.312	C	S	.	.			trans	-52.3	125.2	174.6	-58.4	55.7	0	0	0	111.5	V831 G927 Y929	V831-N931 CarbonylContact O-C 3.54Å; V831-N931 WeakPolarHBondContact O-CA 3.32Å; G927-N931 WeakPolarHBondContact CA-O 3.36Å; G927-N931 PolarHBondContact N-O 2.82Å; Y929-N931 WeakPolarHBondContact CB-OD1 3.23Å; Y929-N931 PolarHBondContact O-N 2.71Å; Y929-N931 PolarHBondContact O-OD1 2.94Å
932	L	77.4	Confident	71.9	Confident	13 Å²	13	55.3 Å²	55.3	7%	0.068	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	133.3	-179	-63.1	164.3	0	0	0	109.3	V831 A833 A838 G930 F934	V831-L932 HydrophobicContact CB-CB 4.28Å; V831-L932 HydrophobicContact CG1-CB 4.2Å; V831-L932 HydrophobicContact CG1-CD1 4.37Å; V831-L932 PolarHBondContact N-O 2.71Å; V831-L932 PolarHBondContact O-N 2.97Å; A833-L932 HydrophobicContact CB-CD1 4.08Å; A838-L932 HydrophobicContact CB-CD1 3.62Å; G930-L932 PolarHBondContact O-N 3.19Å; L932-F934 HydrophobicContact CB-CE2 3.89Å; L932-F934 HydrophobicContact CB-CZ 3.98Å
933	T	82.7	Confident	71.5	Confident	12 Å²	12	58.2 Å²	58.2	7%	0.074	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	136	177.7	67.6	0	0	0	0	111.2	L829 Y830 S924 G925 F935	L829-T933 WeakPolarHBondContact O-CA 3.35Å; Y830-T933 HydrophobicContact CD1-CG2 3.51Å; Y830-T933 HydrophobicContact CE1-CG2 3.89Å; Y830-T933 HydrophobicContact CG-CG2 4.42Å; S924-T933 CarbonylContact C-O 3.45Å; S924-T933 WeakPolarHBondContact CA-O 3.35Å; G925-T933 PolarHBondContact N-O 2.89Å; G925-T933 PolarHBondContact O-N 2.02Å; G925-T933 PolarHBondContact O-OG1 2.84Å; T933-F935 VanDerWaalsContact OG1-CE2 3.31Å; T933-F935 WeakPolarHBondContact OG1-CE2 3.39Å
934	F	86.2	Confident	71.4	Confident	9 Å²	9	59.2 Å²	59.2	4%	0.039	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	128.6	-179	-50.5	-76.2	0	0	0	109.2	L829 A838 A840 W842 L932 V953	L829-F934 HydrophobicContact CB-CB 4.28Å; L829-F934 HydrophobicContact CD2-CD2 3.93Å; L829-F934 HydrophobicContact CG-CD2 4.29Å; L829-F934 PolarHBondContact N-O 3.12Å; L829-F934 PolarHBondContact O-N 2.84Å; A838-F934 HydrophobicContact CB-CZ 4.49Å; A838-F934 WeakPolarHBondContact O-CZ 3.44Å; A840-F934 HydrophobicContact CB-CB 4.23Å; A840-F934 HydrophobicContact CB-CD1 3.33Å; A840-F934 HydrophobicContact CB-CD2 3.92Å; A840-F934 HydrophobicContact CB-CE1 3.49Å; A840-F934 VanDerWaalsContact CB-CE1 3.49Å; A840-F934 HydrophobicContact CB-CE2 4.05Å; A840-F934 HydrophobicContact CB-CG 3.55Å; A840-F934 HydrophobicContact CB-CZ 3.85Å; W842-F934 HydrophobicContact CZ2-CB 4.48Å; L932-F934 HydrophobicContact CB-CE2 3.89Å; L932-F934 HydrophobicContact CB-CZ 3.98Å; F934-V953 HydrophobicContact CD2-CG2 4.26Å; F934-V953 HydrophobicContact CE2-CG1 4.23Å; F934-V953 HydrophobicContact CE2-CG2 4.11Å
935	F	85.1	Confident	71.7	Confident	31 Å²	31	56.1 Å²	56.1	14%	0.136	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	135.4	-173.4	-57.5	-77.5	0	0	0	110.4	T826 L827 A828 A922 S923 T933	T826-F935 HydrophobicContact CG2-CB 3.8Å; T826-F935 HydrophobicContact CG2-CD1 3.82Å; T826-F935 HydrophobicContact CG2-CG 4.23Å; L827-F935 CarbonylContact O-C 3.51Å; L827-F935 VanDerWaalsContact O-CA 3.29Å; L827-F935 WeakPolarHBondContact O-CA 3.44Å; A828-F935 HydrophobicContact CB-CD1 3.73Å; A828-F935 HydrophobicContact CB-CE1 3.77Å; A922-F935 CarbonylContact C-O 3.56Å; A922-F935 WeakPolarHBondContact CA-O 3.33Å; S923-F935 PolarHBondContact N-O 2.91Å; S923-F935 PolarHBondContact O-N 3.08Å; T933-F935 VanDerWaalsContact OG1-CE2 3.31Å; T933-F935 WeakPolarHBondContact OG1-CE2 3.39Å
936	L	86.2	Confident	72.6	Confident	4 Å²	4	56.6 Å²	56.6	2%	0.021	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	106.8	163.4	-169.7	68.1	0	0	0	108.5	T826 L827 W842 L899 I920 A922 F938 Y949	T826-L936 CarbonylContact C-O 3.56Å; T826-L936 WeakPolarHBondContact CA-O 3.3Å; L827-L936 HydrophobicContact CB-CB 4.29Å; L827-L936 HydrophobicContact CD1-CD2 4.28Å; L827-L936 PolarHBondContact N-O 2.78Å; L827-L936 PolarHBondContact O-N 2.84Å; W842-L936 HydrophobicContact CB-CD1 4.12Å; W842-L936 HydrophobicContact CB-CD2 4.35Å; W842-L936 HydrophobicContact CD2-CB 3.73Å; W842-L936 HydrophobicContact CD2-CD1 4.45Å; W842-L936 HydrophobicContact CD2-CD2 4.13Å; W842-L936 HydrophobicContact CD2-CG 4.32Å; W842-L936 HydrophobicContact CE3-CB 3.9Å; W842-L936 HydrophobicContact CE3-CD2 3.83Å; W842-L936 HydrophobicContact CE3-CG 4.42Å; W842-L936 HydrophobicContact CG-CB 4.23Å; W842-L936 HydrophobicContact CG-CD1 4.09Å; W842-L936 HydrophobicContact CG-CD2 4.39Å; W842-L936 HydrophobicContact CG-CG 4.48Å; W842-L936 HydrophobicContact CH2-CB 4.2Å; W842-L936 HydrophobicContact CZ2-CB 4.05Å; W842-L936 HydrophobicContact CZ3-CB 4.12Å; W842-L936 HydrophobicContact CZ3-CD2 4.45Å; L899-L936 HydrophobicContact CD2-CD1 4.47Å; I920-L936 HydrophobicContact CG2-CD1 3.67Å; I920-L936 HydrophobicContact CG2-CG 4.01Å; A922-L936 HydrophobicContact CB-CD1 4.2Å; L936-F938 HydrophobicContact CB-CE2 4.46Å; L936-F938 HydrophobicContact CD2-CE2 3.95Å; L936-F938 HydrophobicContact CD2-CZ 3.84Å; L936-F938 HydrophobicContact CG-CE2 3.91Å; L936-F938 HydrophobicContact CG-CZ 4.2Å; L936-Y949 HydrophobicContact CD2-CD1 3.56Å; L936-Y949 HydrophobicContact CD2-CE1 3.9Å; L936-Y949 HydrophobicContact CD2-CG 4.13Å
937	R	83.2	Confident	73.7	Confident	126 Å²	126	51.2 Å²	51.2	48%	0.475	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	128.6	-171.9	-178.5	166.1	-167.9	-165.8	4.5	111.7	T826 I920 F921	T826-R937 HydrophobicContact CG2-CB 4.14Å; T826-R937 WeakPolarHBondContact OG1-CG 3.2Å; I920-R937 CarbonylContact C-O 3.58Å; I920-R937 WeakPolarHBondContact CA-O 3.47Å; F921-R937 PolarHBondContact N-O 3.33Å; F921-R937 PolarHBondContact O-N 3.38Å
938	F	86.4	Confident	75.1	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	120.9	175.6	-56.7	-109.9	0	0	0	107.7	S824 V825 L827 N919 I920 L936 E940 V941 D945 Y949 L966	S824-F938 CarbonylContact C-O 3.6Å; S824-F938 VanDerWaalsContact CA-O 3.3Å; S824-F938 WeakPolarHBondContact CA-O 3.41Å; S824-F938 WeakPolarHBondContact CB-O 3.07Å; V825-F938 HydrophobicContact CG1-CB 3.89Å; V825-F938 HydrophobicContact CG1-CD2 3.61Å; V825-F938 HydrophobicContact CG1-CE2 4.42Å; V825-F938 HydrophobicContact CG1-CG 3.93Å; V825-F938 PolarHBondContact N-O 2.89Å; V825-F938 PolarHBondContact O-N 3.37Å; L827-F938 HydrophobicContact CD1-CE2 4.19Å; L827-F938 HydrophobicContact CG-CE2 4.15Å; N919-F938 CarbonylContact O-C 3.59Å; N919-F938 VanDerWaalsContact O-CA 3.29Å; N919-F938 WeakPolarHBondContact O-CA 3.47Å; I920-F938 HydrophobicContact CD1-CD1 3.95Å; I920-F938 HydrophobicContact CD1-CE1 3.68Å; I920-F938 HydrophobicContact CG1-CD1 3.77Å; I920-F938 HydrophobicContact CG1-CE1 3.98Å; I920-F938 HydrophobicContact CG2-CD1 4.47Å; I920-F938 HydrophobicContact CG2-CE1 4.3Å; I920-F938 HydrophobicContact CG2-CZ 4.46Å; L936-F938 HydrophobicContact CB-CE2 4.46Å; L936-F938 HydrophobicContact CD2-CE2 3.95Å; L936-F938 HydrophobicContact CD2-CZ 3.84Å; L936-F938 HydrophobicContact CG-CE2 3.91Å; L936-F938 HydrophobicContact CG-CZ 4.2Å; F938-E940 VanDerWaalsContact C-N 3.33Å; F938-V941 HydrophobicContact CB-CG2 3.71Å; F938-V941 HydrophobicContact CD1-CG2 4.29Å; F938-V941 HydrophobicContact CG-CG2 4.11Å; F938-D945 HydrophobicContact CD1-CB 4.05Å; F938-D945 HydrophobicContact CE1-CB 3.95Å; F938-Y949 HydrophobicContact CE1-CE2 4.31Å; F938-Y949 AromaticContact CE1-CZ 3.89Å; F938-Y949 HydrophobicContact CZ-CD2 4.45Å; F938-Y949 HydrophobicContact CZ-CE1 4.07Å; F938-Y949 AromaticContact CZ-CE2 3.83Å; F938-Y949 HydrophobicContact CZ-CE2 3.83Å; F938-Y949 AromaticContact CZ-CZ 3.62Å; F938-L966 HydrophobicContact CD1-CD2 4.06Å; F938-L966 HydrophobicContact CD2-CD2 4.31Å; F938-L966 HydrophobicContact CE1-CD2 3.7Å; F938-L966 HydrophobicContact CE2-CD2 3.99Å; F938-L966 HydrophobicContact CG-CD2 4.36Å; F938-L966 HydrophobicContact CZ-CD2 3.67Å
939	T	79.8	Confident	77.2	Confident	71 Å²	71	43.9 Å²	43.9	44%	0.436	23%	0.232	S	C	.	.	S	Bend	trans	-76.1	-24.9	178.9	61	0	0	0	0	112.9	S824 N919 F921	S824-T939 VanDerWaalsContact CB-O 3.29Å; S824-T939 WeakPolarHBondContact CB-O 3.27Å; N919-T939 WeakPolarHBondContact CA-OG1 3.43Å; N919-T939 PolarHBondContact O-N 2.93Å; N919-T939 PolarHBondContact O-OG1 2.8Å; F921-T939 HydrophobicContact CD2-CG2 4.06Å; F921-T939 HydrophobicContact CE2-CG2 3.79Å
940	E	77.6	Confident	79.1	Confident	83 Å²	83	37.2 Å²	37.2	39%	0.388	21%	0.206	S	C	.	.	S	Bend	trans	-162	112.1	-177.8	167.9	-157.2	-139.9	0	0	105.8	N919 F938 K942	N919-E940 WeakPolarHBondContact ND2-CB 3.37Å; N919-E940 PolarHBondContact ND2-O 2.79Å; N919-E940 PolarHBondContact ND2-OE2 2.73Å; F938-E940 VanDerWaalsContact C-N 3.33Å; E940-K942 PolarHBondContact O-N 3.07Å; E940-K942 WeakPolarHBondContact OE2-CE 3.39Å; E940-K942 IonicContact OE2-NZ 2.63Å; E940-K942 PolarHBondContact OE2-NZ 2.98Å
941	V	79.9	Confident	80.8	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.006	19%	0.187	C	C	.	.			trans	-78.6	118.7	-178.6	169.3	0	0	0	0	111.2	V819 G822 E823 V825 F938 D945 F946 L966	V819-V941 HydrophobicContact CG1-CB 4.16Å; V819-V941 HydrophobicContact CG1-CG1 4.45Å; V819-V941 HydrophobicContact CG1-CG2 3.92Å; G822-V941 PolarHBondContact N-O 3.05Å; E823-V941 WeakPolarHBondContact O-CB 3.44Å; E823-V941 WeakPolarHBondContact O-CG2 3.4Å; E823-V941 PolarHBondContact O-N 3.02Å; V825-V941 HydrophobicContact CG1-CG2 3.63Å; F938-V941 HydrophobicContact CB-CG2 3.71Å; F938-V941 HydrophobicContact CD1-CG2 4.29Å; F938-V941 HydrophobicContact CG-CG2 4.11Å; V941-D945 HydrophobicContact CG1-CB 4.29Å; V941-F946 HydrophobicContact CG1-CD1 4.25Å; V941-F946 HydrophobicContact CG1-CE1 3.59Å; V941-F946 HydrophobicContact CG1-CE2 4.18Å; V941-F946 HydrophobicContact CG1-CZ 3.55Å; V941-L966 HydrophobicContact CG1-CD2 4.43Å; V941-L966 HydrophobicContact CG2-CD2 4.26Å
942	K	77	Confident	81.9	Confident	82 Å²	82	34.5 Å²	34.5	36%	0.357	18%	0.182	S	C	.	.			trans	-93.4	163.8	176	-72.3	165.6	171.6	152	0	111.2	N919 E940 V944 D945	N919-K942 VanDerWaalsContact CG-NZ 3.26Å; N919-K942 WeakPolarHBondContact ND2-CE 3.42Å; N919-K942 PolarHBondContact ND2-NZ 2.96Å; N919-K942 PolarHBondContact OD1-NZ 3.07Å; E940-K942 PolarHBondContact O-N 3.07Å; E940-K942 WeakPolarHBondContact OE2-CE 3.39Å; E940-K942 IonicContact OE2-NZ 2.63Å; E940-K942 PolarHBondContact OE2-NZ 2.98Å; K942-V944 HydrophobicContact CB-CG2 4.03Å; K942-V944 PolarHBondContact O-N 2.87Å; K942-V944 VanDerWaalsContact O-N 3.11Å; K942-D945 WeakPolarHBondContact CB-OD2 3.49Å; K942-D945 PolarHBondContact N-OD2 3.5Å; K942-D945 WeakPolarHBondContact O-CB 3.41Å; K942-D945 PolarHBondContact O-N 2.76Å
943	S	69	Low	82.4	Confident	88 Å²	88	33.9 Å²	33.9	62%	0.615	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-26.6	177	48.6	0	0	0	0	113.7	L821	L821-S943 VanDerWaalsContact CD2-N 3.34Å
944	V	73.6	Confident	82.3	Confident	83 Å²	83	38.2 Å²	38.2	50%	0.503	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	0.4	178.1	-62.5	0	0	0	0	114.3	Q844 R917 K942	Q844-V944 PolarHBondContact NE2-O 2.9Å; R917-V944 PolarHBondContact NH1-O 3.04Å; K942-V944 HydrophobicContact CB-CG2 4.03Å; K942-V944 PolarHBondContact O-N 2.87Å; K942-V944 VanDerWaalsContact O-N 3.11Å
945	D	78.9	Confident	82.3	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.005	20%	0.195	C	C	.	.	S	Bend	trans	-98.9	-11.5	176.8	-58.4	-30.6	0	0	0	112	R917 F938 V941 K942 Y949 L966	R917-D945 IonicContact CZ-OD1 3.25Å; R917-D945 IonicContact NH1-OD1 3.11Å; R917-D945 PolarHBondContact NH1-OD1 3.33Å; F938-D945 HydrophobicContact CD1-CB 4.05Å; F938-D945 HydrophobicContact CE1-CB 3.95Å; V941-D945 HydrophobicContact CG1-CB 4.29Å; K942-D945 WeakPolarHBondContact CB-OD2 3.49Å; K942-D945 PolarHBondContact N-OD2 3.5Å; K942-D945 WeakPolarHBondContact O-CB 3.41Å; K942-D945 PolarHBondContact O-N 2.76Å; D945-Y949 WeakPolarHBondContact O-CE2 3.31Å; D945-Y949 PolarHBondContact O-OH 2.8Å; D945-Y949 VanDerWaalsContact O-OH 3.05Å; D945-L966 WeakPolarHBondContact O-CD2 3.2Å
946	F	80.1	Confident	82.1	Confident	39 Å²	39	41.3 Å²	41.3	17%	0.171	21%	0.209	C	C	.	.			trans	-73.1	133.8	173.5	-63.3	-61.4	0	0	0	111.2	V819 L821 V941 L966 K968	V819-F946 HydrophobicContact CB-CE1 4.48Å; L821-F946 HydrophobicContact CD2-CE2 3.74Å; L821-F946 HydrophobicContact CD2-CZ 4.4Å; L821-F946 HydrophobicContact CG-CE2 4.12Å; V941-F946 HydrophobicContact CG1-CD1 4.25Å; V941-F946 HydrophobicContact CG1-CE1 3.59Å; V941-F946 HydrophobicContact CG1-CE2 4.18Å; V941-F946 HydrophobicContact CG1-CZ 3.55Å; F946-L966 WeakPolarHBondContact CA-O 3.3Å; F946-L966 HydrophobicContact CD1-CG 4.11Å; F946-K968 HydrophobicContact CD1-CB 3.88Å; F946-K968 VanDerWaalsContact CD1-N 3.27Å; F946-K968 HydrophobicContact CD2-CB 3.83Å; F946-K968 HydrophobicContact CD2-CD 4.42Å; F946-K968 HydrophobicContact CD2-CG 4.23Å; F946-K968 HydrophobicContact CE1-CB 3.86Å; F946-K968 HydrophobicContact CE1-CG 4.37Å; F946-K968 HydrophobicContact CE2-CB 3.79Å; F946-K968 HydrophobicContact CE2-CD 4.11Å; F946-K968 HydrophobicContact CE2-CG 3.76Å; F946-K968 HydrophobicContact CG-CB 3.88Å; F946-K968 HydrophobicContact CZ-CB 3.81Å; F946-K968 HydrophobicContact CZ-CG 3.85Å
947	G	82.4	Confident	81.9	Confident	18 Å²	18	43.9 Å²	43.9	19%	0.186	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	157.1	-166.9	-176.3	0	0	0	0	0	113.6	L966	G947-L966 PolarHBondContact N-O 2.93Å; G947-L966 PolarHBondContact O-N 2.91Å
948	T	83.7	Confident	81.8	Confident	25 Å²	25	39.3 Å²	39.3	15%	0.153	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	135.1	177	-61.3	0	0	0	0	109.8	I845 T963 F964 H965	I845-T948 HydrophobicContact CB-CG2 4.39Å; I845-T948 HydrophobicContact CD1-CG2 4.43Å; I845-T948 PolarHBondContact N-O 3.06Å; T948-T963 HydrophobicContact CG2-CG2 3.55Å; T948-F964 WeakPolarHBondContact CA-O 3.4Å; T948-H965 PolarHBondContact OG1-CE1 2.96Å; T948-H965 PolarHBondContact OG1-ND1 2.63Å
949	Y	87	Confident	81.6	Confident	6 Å²	6	43.4 Å²	43.4	2%	0.024	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	145.2	174.6	-71	-87.1	0	0	0	109.5	L827 F843 Q844 L936 F938 D945 F964 L966	L827-Y949 HydrophobicContact CD1-CD2 4.06Å; L827-Y949 HydrophobicContact CD1-CG 4.11Å; F843-Y949 CarbonylContact O-C 3.59Å; F843-Y949 VanDerWaalsContact O-CA 3.27Å; F843-Y949 WeakPolarHBondContact O-CA 3.34Å; Q844-Y949 HydrophobicContact CB-CD1 3.94Å; Q844-Y949 HydrophobicContact CB-CE1 3.57Å; Q844-Y949 HydrophobicContact CG-CD1 4.2Å; Q844-Y949 HydrophobicContact CG-CE1 3.63Å; Q844-Y949 PolarHBondContact NE2-OH 3.07Å; Q844-Y949 PolarHBondContact OE1-OH 2.81Å; L936-Y949 HydrophobicContact CD2-CD1 3.56Å; L936-Y949 HydrophobicContact CD2-CE1 3.9Å; L936-Y949 HydrophobicContact CD2-CG 4.13Å; F938-Y949 HydrophobicContact CE1-CE2 4.31Å; F938-Y949 AromaticContact CE1-CZ 3.89Å; F938-Y949 HydrophobicContact CZ-CD2 4.45Å; F938-Y949 HydrophobicContact CZ-CE1 4.07Å; F938-Y949 AromaticContact CZ-CE2 3.83Å; F938-Y949 HydrophobicContact CZ-CE2 3.83Å; F938-Y949 AromaticContact CZ-CZ 3.62Å; D945-Y949 WeakPolarHBondContact O-CE2 3.31Å; D945-Y949 PolarHBondContact O-OH 2.8Å; D945-Y949 VanDerWaalsContact O-OH 3.05Å; Y949-F964 PolarHBondContact N-O 3.48Å; Y949-F964 PolarHBondContact O-N 3.19Å; Y949-F964 VanDerWaalsContact O-O 3.1Å; Y949-L966 HydrophobicContact CD2-CB 4.15Å; Y949-L966 HydrophobicContact CE2-CB 3.98Å; Y949-L966 HydrophobicContact CE2-CD2 4.27Å
950	V	87.6	Confident	81.8	Confident	8 Å²	8	42.1 Å²	42.1	5%	0.048	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	126.7	175.1	173.2	0	0	0	0	109.2	W842 F843 I845 E961 T963	W842-V950 WeakPolarHBondContact CA-O 3.25Å; F843-V950 PolarHBondContact N-O 3.09Å; F843-V950 PolarHBondContact O-N 2.79Å; I845-V950 HydrophobicContact CD1-CG2 3.57Å; I845-V950 HydrophobicContact CG1-CG2 4.31Å; V950-E961 HydrophobicContact CG1-CB 3.78Å; V950-E961 HydrophobicContact CG1-CG 3.94Å; V950-T963 HydrophobicContact CG2-CG2 4.22Å
951	C	87.5	Confident	82.3	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	108.8	169.9	-167.7	0	0	0	0	108.6	L829 E841 W842 E961 F962 F964	L829-C951 HydrophobicContact CD2-CB 3.87Å; L829-C951 VanDerWaalsContact CD2-SG 3.55Å; E841-C951 CarbonylContact O-C 3.57Å; E841-C951 WeakPolarHBondContact O-CA 3.35Å; W842-C951 HydrophobicContact CD2-CB 3.86Å; W842-C951 VanDerWaalsContact CE2-SG 3.53Å; W842-C951 HydrophobicContact CE3-CB 3.82Å; W842-C951 HydrophobicContact CH2-CB 3.91Å; W842-C951 HydrophobicContact CZ2-CB 3.92Å; W842-C951 HydrophobicContact CZ3-CB 3.86Å; C951-E961 WeakPolarHBondContact O-CA 3.36Å; C951-F962 PolarHBondContact N-O 3.28Å; C951-F962 PolarHBondContact O-N 2.66Å; C951-F964 HydrophobicContact CB-CE2 4.3Å
952	Q	88.7	Confident	82.7	Confident	25 Å²	25	43.7 Å²	43.7	12%	0.117	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	105.6	177.4	-172	170.5	47.4	0	0	108.5	A840 E841 F843 V959 E961	A840-Q952 WeakPolarHBondContact CA-O 3.45Å; E841-Q952 PolarHBondContact N-O 3.42Å; E841-Q952 PolarHBondContact O-N 2.8Å; F843-Q952 HydrophobicContact CD2-CB 4.16Å; F843-Q952 HydrophobicContact CE2-CB 3.74Å; Q952-V959 HydrophobicContact CG-CG1 3.39Å; Q952-E961 HydrophobicContact CB-CG 4.06Å; Q952-E961 HydrophobicContact CG-CG 3.86Å; Q952-E961 PolarHBondContact NE2-OE1 2.88Å
953	V	86.5	Confident	83.2	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	124.3	-178.8	179.9	0	0	0	0	109.7	P807 L829 A838 E839 A840 F934 V959 K960 F962	P807-V953 HydrophobicContact CB-CG1 4.18Å; P807-V953 HydrophobicContact CG-CG1 3.83Å; L829-V953 HydrophobicContact CD2-CG2 3.78Å; A838-V953 HydrophobicContact CB-CG1 3.56Å; E839-V953 CarbonylContact O-C 3.5Å; E839-V953 VanDerWaalsContact O-CA 3.24Å; E839-V953 WeakPolarHBondContact O-CA 3.43Å; E839-V953 WeakPolarHBondContact O-CG1 3.16Å; A840-V953 HydrophobicContact CB-CG2 3.98Å; F934-V953 HydrophobicContact CD2-CG2 4.26Å; F934-V953 HydrophobicContact CE2-CG1 4.23Å; F934-V953 HydrophobicContact CE2-CG2 4.11Å; V953-V959 CarbonylContact O-C 3.45Å; V953-V959 WeakPolarHBondContact O-CA 3.18Å; V953-K960 PolarHBondContact N-O 2.81Å; V953-K960 PolarHBondContact O-N 2.85Å; V953-F962 HydrophobicContact CB-CD2 4.4Å; V953-F962 HydrophobicContact CB-CE2 4.05Å; V953-F962 HydrophobicContact CG2-CD2 3.74Å; V953-F962 HydrophobicContact CG2-CE2 3.72Å
954	R	82	Confident	84.1	Confident	102 Å²	102	38.6 Å²	38.6	39%	0.385	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	125.2	179.5	-53.1	-179.5	-179.1	-168.2	1.4	110	A838 E839 E841 V959	A838-R954 WeakPolarHBondContact CA-O 3.35Å; A838-R954 WeakPolarHBondContact CB-O 3.4Å; E839-R954 HydrophobicContact CB-CB 4.4Å; E839-R954 PolarHBondContact N-O 3.19Å; E839-R954 PolarHBondContact O-N 3.04Å; E841-R954 IonicContact OE1-CZ 3.77Å; E841-R954 IonicContact OE1-NH2 2.73Å; E841-R954 PolarHBondContact OE1-NH2 3.26Å; E841-R954 IonicContact OE2-CZ 2.72Å; E841-R954 IonicContact OE2-NE 2.73Å; E841-R954 PolarHBondContact OE2-NE 3.12Å; E841-R954 IonicContact OE2-NH2 3.18Å; E841-R954 PolarHBondContact OE2-NH2 2.75Å; R954-V959 HydrophobicContact CB-CG2 4.33Å; R954-V959 HydrophobicContact CG-CG1 4.23Å; R954-V959 HydrophobicContact CG-CG2 4.09Å
955	H	85.3	Confident	84.6	Confident	13 Å²	13	37.1 Å²	37.1	6%	0.06	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	158.6	179.9	-177.6	-105.8	0	0	0	109.6	Y805 P807 P835 W837 A838 L957 G958	Y805-H955 PolarHBondContact O-CE1 2.73Å; P807-H955 HydrophobicContact CG-CB 3.73Å; P835-H955 PolarHBondContact O-NE2 2.63Å; W837-H955 PolarHBondContact O-CD2 3.25Å; A838-H955 HydrophobicContact CB-CB 4.37Å; H955-L957 PolarHBondContact ND1-N 2.85Å; H955-L957 PolarHBondContact O-N 2.96Å; H955-G958 PolarHBondContact N-O 2.93Å; H955-G958 CarbonylContact O-C 3.57Å; H955-G958 PolarHBondContact O-N 2.92Å
956	Q	80.7	Confident	84.8	Confident	92 Å²	92	37.2 Å²	37.2	43%	0.43	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-24	177.9	51	165.3	61.6	0	0	114.6	P835 W837	P835-Q956 VanDerWaalsContact CG-CD 3.46Å; P835-Q956 HydrophobicContact CG-CG 3.92Å; W837-Q956 HydrophobicContact CH2-CB 3.73Å; W837-Q956 HydrophobicContact CH2-CG 4.23Å; W837-Q956 HydrophobicContact CZ2-CB 3.64Å; W837-Q956 HydrophobicContact CZ2-CG 3.75Å
957	L	82	Confident	84.8	Confident	59 Å²	59	38.5 Å²	38.5	31%	0.309	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-1	177.5	-57.4	175.2	0	0	0	114.1	I679 Y805 Q806 H955	I679-L957 HydrophobicContact CD1-CD2 3.92Å; I679-L957 HydrophobicContact CG1-CD2 4.23Å; Y805-L957 VanDerWaalsContact C-CD1 3.47Å; Q806-L957 HydrophobicContact CB-CB 4.39Å; H955-L957 PolarHBondContact ND1-N 2.85Å; H955-L957 PolarHBondContact O-N 2.96Å
958	G	81.2	Confident	84.3	Confident	30 Å²	30	43.5 Å²	43.5	31%	0.309	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	143.5	176.4	179.2	0	0	0	0	0	114.5	H955	H955-G958 PolarHBondContact N-O 2.93Å; H955-G958 CarbonylContact O-C 3.57Å; H955-G958 PolarHBondContact O-N 2.92Å
959	V	83.6	Confident	83.6	Confident	86 Å²	86	47.2 Å²	47.2	52%	0.521	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	134.3	177.1	-176.4	0	0	0	0	109.2	Q952 V953 R954	Q952-V959 HydrophobicContact CG-CG1 3.39Å; V953-V959 CarbonylContact O-C 3.45Å; V953-V959 WeakPolarHBondContact O-CA 3.18Å; R954-V959 HydrophobicContact CB-CG2 4.33Å; R954-V959 HydrophobicContact CG-CG1 4.23Å; R954-V959 HydrophobicContact CG-CG2 4.09Å
960	K	84	Confident	81.8	Confident	44 Å²	44	50.9 Å²	50.9	19%	0.191	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	134.9	-176.3	-169.9	173	-176.4	167.3	0	111.5	P807 V953 F962	P807-K960 WeakPolarHBondContact O-CD 3.23Å; P807-K960 WeakPolarHBondContact O-CE 3.4Å; P807-K960 PolarHBondContact O-NZ 3.49Å; V953-K960 PolarHBondContact N-O 2.81Å; V953-K960 PolarHBondContact O-N 2.85Å; K960-F962 HydrophobicContact CD-CE1 4.11Å; K960-F962 HydrophobicContact CD-CE2 4.47Å; K960-F962 HydrophobicContact CD-CZ 3.75Å; K960-F962 HydrophobicContact CG-CE1 4.32Å; K960-F962 HydrophobicContact CG-CE2 4.37Å; K960-F962 HydrophobicContact CG-CZ 4.03Å
961	E	87	Confident	79.6	Confident	106 Å²	106	54.9 Å²	54.9	50%	0.495	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	137.4	-175.8	-71.4	177.1	-174.3	0	0	111.4	R894 V950 C951 Q952	R894-E961 IonicContact NH2-OE1 3.57Å; V950-E961 HydrophobicContact CG1-CB 3.78Å; V950-E961 HydrophobicContact CG1-CG 3.94Å; C951-E961 WeakPolarHBondContact O-CA 3.36Å; Q952-E961 HydrophobicContact CB-CG 4.06Å; Q952-E961 HydrophobicContact CG-CG 3.86Å; Q952-E961 PolarHBondContact NE2-OE1 2.88Å
962	F	88.2	Confident	77.4	Confident	10 Å²	10	57.8 Å²	57.8	4%	0.044	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	114.9	178.1	-59.3	-72.4	0	0	0	109.7	P807 M809 L829 V831 C951 V953 K960 F964	P807-F962 HydrophobicContact CB-CE2 4.34Å; P807-F962 HydrophobicContact CB-CZ 4.22Å; M809-F962 HydrophobicContact CB-CD1 4.22Å; M809-F962 HydrophobicContact CB-CE1 3.84Å; M809-F962 HydrophobicContact CE-CB 4.23Å; M809-F962 HydrophobicContact CE-CD1 3.57Å; M809-F962 HydrophobicContact CE-CE1 4.33Å; M809-F962 HydrophobicContact CE-CG 4.28Å; L829-F962 HydrophobicContact CD1-CB 4.04Å; L829-F962 HydrophobicContact CD1-CD1 4.38Å; L829-F962 HydrophobicContact CD1-CD2 3.98Å; L829-F962 HydrophobicContact CD1-CE2 4.48Å; L829-F962 HydrophobicContact CD1-CG 3.88Å; L829-F962 HydrophobicContact CD2-CB 4.18Å; L829-F962 HydrophobicContact CD2-CD2 3.51Å; L829-F962 HydrophobicContact CD2-CE2 4.16Å; L829-F962 HydrophobicContact CD2-CG 4.1Å; L829-F962 HydrophobicContact CG-CD2 4.39Å; V831-F962 HydrophobicContact CG2-CE2 3.85Å; V831-F962 HydrophobicContact CG2-CZ 4.04Å; C951-F962 PolarHBondContact N-O 3.28Å; C951-F962 PolarHBondContact O-N 2.66Å; V953-F962 HydrophobicContact CB-CD2 4.4Å; V953-F962 HydrophobicContact CB-CE2 4.05Å; V953-F962 HydrophobicContact CG2-CD2 3.74Å; V953-F962 HydrophobicContact CG2-CE2 3.72Å; K960-F962 HydrophobicContact CD-CE1 4.11Å; K960-F962 HydrophobicContact CD-CE2 4.47Å; K960-F962 HydrophobicContact CD-CZ 3.75Å; K960-F962 HydrophobicContact CG-CE1 4.32Å; K960-F962 HydrophobicContact CG-CE2 4.37Å; K960-F962 HydrophobicContact CG-CZ 4.03Å; F962-F964 HydrophobicContact CB-CE2 4.12Å; F962-F964 WeakPolarHBondContact O-CD2 3.24Å
963	T	87.3	Confident	75.4	Confident	63 Å²	63	60.5 Å²	60.5	39%	0.387	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	138.4	-176	-49.2	0	0	0	0	111.9	T815 T948 V950	T815-T963 WeakPolarHBondContact CG2-O 3.5Å; T948-T963 HydrophobicContact CG2-CG2 3.55Å; V950-T963 HydrophobicContact CG2-CG2 4.22Å
964	F	88.1	Confident	73.8	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	149.2	174.6	-67.6	-99.7	0	0	0	110.1	T813 Q814 T815 L827 L829 W842 T948 Y949 C951 F962	T813-F964 HydrophobicContact CG2-CE1 3.76Å; T813-F964 HydrophobicContact CG2-CZ 3.6Å; Q814-F964 WeakPolarHBondContact O-CD1 3.38Å; Q814-F964 VanDerWaalsContact O-CE1 3.28Å; Q814-F964 WeakPolarHBondContact O-CE1 3.43Å; T815-F964 CarbonylContact O-C 3.55Å; T815-F964 WeakPolarHBondContact O-CA 3.42Å; L827-F964 HydrophobicContact CB-CD1 4.14Å; L827-F964 HydrophobicContact CD1-CB 3.87Å; L827-F964 HydrophobicContact CD1-CG 4.36Å; L827-F964 HydrophobicContact CD2-CD1 4.48Å; L829-F964 HydrophobicContact CB-CE2 4.13Å; L829-F964 HydrophobicContact CB-CZ 3.71Å; L829-F964 HydrophobicContact CD1-CE2 4.32Å; L829-F964 HydrophobicContact CD1-CZ 4.02Å; L829-F964 HydrophobicContact CG-CZ 4.38Å; W842-F964 AromaticContact CH2-CD2 3.71Å; W842-F964 HydrophobicContact CH2-CD2 3.71Å; W842-F964 AromaticContact CH2-CE2 3.61Å; W842-F964 HydrophobicContact CH2-CE2 3.61Å; W842-F964 HydrophobicContact CH2-CG 4.24Å; W842-F964 HydrophobicContact CH2-CZ 4.05Å; W842-F964 AromaticContact CZ3-CD2 3.56Å; W842-F964 HydrophobicContact CZ3-CD2 3.56Å; W842-F964 AromaticContact CZ3-CE2 3.94Å; W842-F964 HydrophobicContact CZ3-CE2 3.94Å; W842-F964 HydrophobicContact CZ3-CG 4.06Å; T948-F964 WeakPolarHBondContact CA-O 3.4Å; Y949-F964 PolarHBondContact N-O 3.48Å; Y949-F964 PolarHBondContact O-N 3.19Å; Y949-F964 VanDerWaalsContact O-O 3.1Å; C951-F964 HydrophobicContact CB-CE2 4.3Å; F962-F964 HydrophobicContact CB-CE2 4.12Å; F962-F964 WeakPolarHBondContact O-CD2 3.24Å
965	H	83.8	Confident	72.8	Confident	53 Å²	53	60.2 Å²	60.2	25%	0.245	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	115.9	176.7	-59.4	-73.1	0	0	0	110.1	T815 H816 V817 T948 I967	T815-H965 PolarHBondContact O-N 3.15Å; H816-H965 AromaticContact CE1-CD2 3.47Å; H816-H965 PolarHBondContact CE1-CD2 3.14Å; H816-H965 VanDerWaalsContact CE1-CD2 3.47Å; H816-H965 AromaticContact ND1-CD2 3.93Å; H816-H965 AromaticContact NE2-CD2 3.68Å; V817-H965 PolarHBondContact N-O 3.47Å; T948-H965 PolarHBondContact OG1-CE1 2.96Å; T948-H965 PolarHBondContact OG1-ND1 2.63Å; H965-I967 HydrophobicContact CB-CD1 4.17Å; H965-I967 HydrophobicContact CB-CG1 4.02Å
966	L	84.6	Confident	71.5	Confident	2 Å²	2	63 Å²	63	1%	0.01	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	102	172.3	-178.6	51.8	0	0	0	108.3	V819 V825 F938 V941 D945 F946 G947 Y949	V819-L966 HydrophobicContact CB-CD1 3.98Å; V819-L966 HydrophobicContact CG2-CD1 3.43Å; V819-L966 VanDerWaalsContact CG2-CD1 3.43Å; V825-L966 HydrophobicContact CG1-CD1 4.02Å; V825-L966 HydrophobicContact CG1-CD2 4.28Å; F938-L966 HydrophobicContact CD1-CD2 4.06Å; F938-L966 HydrophobicContact CD2-CD2 4.31Å; F938-L966 HydrophobicContact CE1-CD2 3.7Å; F938-L966 HydrophobicContact CE2-CD2 3.99Å; F938-L966 HydrophobicContact CG-CD2 4.36Å; F938-L966 HydrophobicContact CZ-CD2 3.67Å; V941-L966 HydrophobicContact CG1-CD2 4.43Å; V941-L966 HydrophobicContact CG2-CD2 4.26Å; D945-L966 WeakPolarHBondContact O-CD2 3.2Å; F946-L966 WeakPolarHBondContact CA-O 3.3Å; F946-L966 HydrophobicContact CD1-CG 4.11Å; G947-L966 PolarHBondContact N-O 2.93Å; G947-L966 PolarHBondContact O-N 2.91Å; Y949-L966 HydrophobicContact CD2-CB 4.15Å; Y949-L966 HydrophobicContact CE2-CB 3.98Å; Y949-L966 HydrophobicContact CE2-CD2 4.27Å
967	I	79.8	Confident	70.5	Confident	67 Å²	67	63.6 Å²	63.6	34%	0.344	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	130.9	-168.4	-59.4	173	0	0	0	109.3	H816 V817 M818 V819 H965 K969	H816-I967 HydrophobicContact CB-CD1 4.45Å; V817-I967 PolarHBondContact O-N 2.65Å; M818-I967 WeakPolarHBondContact CA-O 3.38Å; M818-I967 HydrophobicContact CG-CB 4.06Å; M818-I967 HydrophobicContact CG-CG2 4.23Å; V819-I967 PolarHBondContact N-O 2.84Å; H965-I967 HydrophobicContact CB-CD1 4.17Å; H965-I967 HydrophobicContact CB-CG1 4.02Å; I967-K969 PolarHBondContact O-N 3.12Å; I967-K969 VanDerWaalsContact O-N 3.12Å
968	K	71.9	Confident	69.4	Low	123 Å²	123	70 Å²	70	54%	0.535	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	115.6	171.1	-175	179.6	178.7	-174.8	0	108.9	F946 A970	F946-K968 HydrophobicContact CD1-CB 3.88Å; F946-K968 VanDerWaalsContact CD1-N 3.27Å; F946-K968 HydrophobicContact CD2-CB 3.83Å; F946-K968 HydrophobicContact CD2-CD 4.42Å; F946-K968 HydrophobicContact CD2-CG 4.23Å; F946-K968 HydrophobicContact CE1-CB 3.86Å; F946-K968 HydrophobicContact CE1-CG 4.37Å; F946-K968 HydrophobicContact CE2-CB 3.79Å; F946-K968 HydrophobicContact CE2-CD 4.11Å; F946-K968 HydrophobicContact CE2-CG 3.76Å; F946-K968 HydrophobicContact CG-CB 3.88Å; F946-K968 HydrophobicContact CZ-CB 3.81Å; F946-K968 HydrophobicContact CZ-CG 3.85Å; K968-A970 PolarHBondContact O-N 2.94Å; K968-A970 VanDerWaalsContact O-N 3.07Å
969	K	68.4	Low	68.8	Low	103 Å²	103	70.1 Å²	70.1	45%	0.448	40%	0.398	S	S	.	.			trans	-55.8	116.5	173.1	-166.7	-178.9	-173.2	-180	0	108.1	V819 Q820 I967 G971	V819-K969 WeakPolarHBondContact O-CB 3.1Å; V819-K969 PolarHBondContact O-N 2.87Å; Q820-K969 HydrophobicContact CG-CB 4.1Å; Q820-K969 HydrophobicContact CG-CD 3.68Å; Q820-K969 HydrophobicContact CG-CG 4.46Å; I967-K969 PolarHBondContact O-N 3.12Å; I967-K969 VanDerWaalsContact O-N 3.12Å; K969-G971 PolarHBondContact O-N 2.97Å
970	A	49	Very low	68.3	Low	82 Å²	82	66.6 Å²	66.6	68%	0.678	38%	0.377	S	S	*	.			trans	-62.1	136	-172.8	0	0	0	0	0	110.5	K968 A972	K968-A970 PolarHBondContact O-N 2.94Å; K968-A970 VanDerWaalsContact O-N 3.07Å; A970-A972 PolarHBondContact O-N 3.1Å
971	G	42.8	Very low	68	Low	92 Å²	92	69.4 Å²	69.4	95%	0.948	39%	0.391	S	S	*	.	S	Bend	trans	-76.8	67.7	178.2	0	0	0	0	0	111.8	K969	K969-G971 PolarHBondContact O-N 2.97Å
972	A	39.8	Very low	67.7	Low	61 Å²	61	65.2 Å²	65.2	50%	0.504	37%	0.372	S	S	.	.			trans	-125.3	159.1	171	0	0	0	0	0	109	A970	A970-A972 PolarHBondContact O-N 3.1Å
973	E	48.3	Very low	67.1	Low	82 Å²	82	67.2 Å²	67.2	38%	0.383	38%	0.383	S	S	.	.	S	Bend	trans	67.4	36.6	173	-54.3	172	-172	0	0	115.3	M1002	E973-M1002 VanDerWaalsContact CD-CE 3.42Å; E973-M1002 HydrophobicContact CG-CE 4.29Å; E973-M1002 WeakPolarHBondContact OE2-CE 3.4Å
974	V	52.1	Low	66.4	Low	89 Å²	89	68.3 Å²	68.3	54%	0.539	38%	0.383	S	S	.	.			trans	-131	119.8	168.8	-177.3	0	0	0	0	110
975	I	60.7	Low	65.4	Low	7 Å²	7	73.5 Å²	73.5	4%	0.036	41%	0.407	C	S	.	.			trans	-87.3	120.9	168.8	-60.5	175.5	0	0	0	107.6	I980 L1004 Q1109 T1111	I975-I980 HydrophobicContact CG2-CD1 4.21Å; I975-I980 HydrophobicContact CG2-CG1 4.11Å; I975-L1004 HydrophobicContact CD1-CD1 3.65Å; I975-L1004 HydrophobicContact CD1-CD2 4.16Å; I975-Q1109 PolarHBondContact O-NE2 2.71Å; I975-T1111 HydrophobicContact CB-CG2 4.32Å; I975-T1111 HydrophobicContact CG2-CG2 4.31Å
976	T	58.8	Low	64.7	Low	71 Å²	71	73.5 Å²	73.5	44%	0.436	42%	0.421	S	S	.	.			trans	-90.6	148.5	-176.9	43	0	0	0	0	112.1	E978 S979	T976-E978 VanDerWaalsContact C-N 3.25Å; T976-E978 PolarHBondContact O-N 3.29Å; T976-S979 PolarHBondContact O-N 2.91Å; T976-S979 PolarHBondContact O-OG 3.32Å; T976-S979 VanDerWaalsContact O-OG 3.05Å; T976-S979 WeakPolarHBondContact OG1-CB 3.47Å; T976-S979 PolarHBondContact OG1-OG 2.91Å
977	E	58.5	Low	64	Low	106 Å²	106	77.7 Å²	77.7	50%	0.495	45%	0.449	S	S	.	.	G	3₁₀ helix	trans	-56	-40.6	175.9	-167.2	177.5	163.2	0	0	112	S979 I980 S1112 V1114	E977-S979 PolarHBondContact O-N 2.81Å; E977-I980 PolarHBondContact O-N 2.82Å; E977-S1112 VanDerWaalsContact CD-CB 3.49Å; E977-S1112 WeakPolarHBondContact OE2-CB 3.32Å; E977-S1112 PolarHBondContact OE2-OG 2.94Å; E977-V1114 HydrophobicContact CG-CG2 3.93Å
978	E	60.4	Low	63.6	Low	192 Å²	192	76.7 Å²	76.7	90%	0.897	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-69	-9	177.6	-59.3	-167.7	140.9	0	0	114.9	T976	T976-E978 VanDerWaalsContact C-N 3.25Å; T976-E978 PolarHBondContact O-N 3.29Å
979	S	68	Low	64	Low	33 Å²	33	70.9 Å²	70.9	23%	0.231	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-103.4	7	175.9	68.2	0	0	0	0	113.8	T976 E977 F993 S994	T976-S979 PolarHBondContact O-N 2.91Å; T976-S979 PolarHBondContact O-OG 3.32Å; T976-S979 VanDerWaalsContact O-OG 3.05Å; T976-S979 WeakPolarHBondContact OG1-CB 3.47Å; T976-S979 PolarHBondContact OG1-OG 2.91Å; E977-S979 PolarHBondContact O-N 2.81Å; S979-F993 VanDerWaalsContact O-CA 3.3Å; S979-F993 WeakPolarHBondContact O-CA 3.49Å; S979-S994 PolarHBondContact OG-OG 2.95Å
980	I	73.1	Confident	64.6	Low	13 Å²	13	66 Å²	66	7%	0.067	40%	0.4	C	S	.	.			trans	-104.3	112.6	176.3	-59	163.8	0	0	0	109.1	I975 E977 I991 L992 F1099 T1111 V1114	I975-I980 HydrophobicContact CG2-CD1 4.21Å; I975-I980 HydrophobicContact CG2-CG1 4.11Å; E977-I980 PolarHBondContact O-N 2.82Å; I980-I991 HydrophobicContact CG2-CG2 4.12Å; I980-L992 WeakPolarHBondContact CA-O 3.24Å; I980-F1099 HydrophobicContact CD1-CD2 3.77Å; I980-F1099 HydrophobicContact CD1-CE2 4.28Å; I980-F1099 HydrophobicContact CG1-CD2 4.02Å; I980-F1099 HydrophobicContact CG1-CE2 4.08Å; I980-F1099 HydrophobicContact CG2-CE2 4.13Å; I980-T1111 HydrophobicContact CD1-CG2 4.16Å; I980-V1114 HydrophobicContact CB-CG2 4.05Å; I980-V1114 HydrophobicContact CD1-CG2 3.93Å; I980-V1114 HydrophobicContact CG2-CB 4.35Å; I980-V1114 HydrophobicContact CG2-CG1 4.31Å; I980-V1114 HydrophobicContact CG2-CG2 4.04Å
981	E	77.9	Confident	66.3	Low	103 Å²	103	62.1 Å²	62.1	48%	0.481	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126.4	-178.4	-178.7	176.7	-138.8	0	0	110.3	I983 I991 L992	E981-I983 HydrophobicContact CG-CD1 4.27Å; E981-I983 HydrophobicContact CG-CG1 3.89Å; E981-I991 CarbonylContact O-C 3.6Å; E981-I991 WeakPolarHBondContact O-CA 3.46Å; E981-L992 HydrophobicContact CB-CB 4.26Å; E981-L992 PolarHBondContact N-O 3.33Å; E981-L992 PolarHBondContact O-N 2.87Å
982	V	79.3	Confident	68.1	Low	17 Å²	17	60.6 Å²	60.6	10%	0.103	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	102.3	-175.6	-172.1	0	0	0	0	109.3	T989 I991 V1092 F1097 V1114 W1116	V982-T989 HydrophobicContact CG1-CG2 3.61Å; V982-I991 HydrophobicContact CG1-CG1 4.21Å; V982-I991 HydrophobicContact CG2-CG1 4.35Å; V982-V1092 HydrophobicContact CG1-CG2 4.09Å; V982-F1097 HydrophobicContact CG1-CD2 4.28Å; V982-F1097 HydrophobicContact CG1-CE2 3.97Å; V982-F1097 HydrophobicContact CG1-CZ 4.34Å; V982-F1097 HydrophobicContact CG2-CD2 3.95Å; V982-F1097 HydrophobicContact CG2-CE2 4.45Å; V982-F1097 HydrophobicContact CG2-CG 4.4Å; V982-V1114 HydrophobicContact CG2-CG1 4.23Å; V982-W1116 PolarHBondContact O-NE1 3.42Å
983	I	76.1	Confident	70.1	Confident	53 Å²	53	58 Å²	58	27%	0.272	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	129.7	-177.7	-44.7	-178.9	0	0	0	109.3	E981 H985 S990 L992	E981-I983 HydrophobicContact CG-CD1 4.27Å; E981-I983 HydrophobicContact CG-CG1 3.89Å; I983-H985 VanDerWaalsContact CG2-CE1 3.41Å; I983-H985 WeakPolarHBondContact CG2-CE1 3.3Å; I983-H985 WeakPolarHBondContact CG2-NE2 3.39Å; I983-S990 PolarHBondContact N-O 3.49Å; I983-S990 PolarHBondContact O-N 2.92Å; I983-S990 VanDerWaalsContact O-O 3.1Å; I983-L992 HydrophobicContact CD1-CD1 3.93Å
984	H	72.7	Confident	71.3	Confident	86 Å²	86	56.4 Å²	56.4	40%	0.398	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	119.4	-176.6	-173	58	0	0	0	110.3	G986 T989 V1092	H984-G986 PolarHBondContact CE1-O 3.15Å; H984-G986 PolarHBondContact NE2-O 2.92Å; H984-T989 PolarHBondContact ND1-OG1 2.89Å; H984-V1092 HydrophobicContact CB-CG1 4.31Å
985	H	66.6	Low	72	Confident	109 Å²	109	54.9 Å²	54.9	51%	0.505	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	75.4	-173.6	-69.9	-44.6	0	0	0	110.5	I983 P987 T988	I983-H985 VanDerWaalsContact CG2-CE1 3.41Å; I983-H985 WeakPolarHBondContact CG2-CE1 3.3Å; I983-H985 WeakPolarHBondContact CG2-NE2 3.39Å; H985-P987 WeakPolarHBondContact O-CD 3.36Å; H985-T988 CarbonylContact C-O 3.59Å; H985-T988 PolarHBondContact N-O 2.92Å; H985-T988 PolarHBondContact O-N 3Å; H985-T988 PolarHBondContact O-OG1 2.92Å
986	G	70.8	Confident	72.1	Confident	52 Å²	52	56.1 Å²	56.1	54%	0.536	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	-121.8	-177.2	0	0	0	0	0	111	H984 T988	H984-G986 PolarHBondContact CE1-O 3.15Å; H984-G986 PolarHBondContact NE2-O 2.92Å; G986-T988 VanDerWaalsContact C-N 3.32Å; G986-T988 PolarHBondContact O-N 3.46Å
987	P	69.7	Low	71.9	Confident	91 Å²	91	61.1 Å²	61.1	59%	0.591	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-22.5	-178.2	30.1	-35.1	0	0	0	113.9	H985	H985-P987 WeakPolarHBondContact O-CD 3.36Å
988	T	71.4	Confident	71.8	Confident	46 Å²	46	63.6 Å²	63.6	28%	0.282	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	145.2	-177.3	58.3	0	0	0	0	112.4	H985 G986	H985-T988 CarbonylContact C-O 3.59Å; H985-T988 PolarHBondContact N-O 2.92Å; H985-T988 PolarHBondContact O-N 3Å; H985-T988 PolarHBondContact O-OG1 2.92Å; G986-T988 VanDerWaalsContact C-N 3.32Å; G986-T988 PolarHBondContact O-N 3.46Å
989	T	80.6	Confident	71.4	Confident	1 Å²	1	59 Å²	59	1%	0.006	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	115.5	173.9	-57.8	0	0	0	0	108.6	V982 H984 I1086 L1088 V1092	V982-T989 HydrophobicContact CG1-CG2 3.61Å; H984-T989 PolarHBondContact ND1-OG1 2.89Å; T989-I1086 PolarHBondContact N-O 3.45Å; T989-I1086 PolarHBondContact O-N 3.2Å; T989-L1088 HydrophobicContact CG2-CD1 4.38Å; T989-V1092 HydrophobicContact CG2-CG2 3.89Å
990	S	80.8	Confident	70.7	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.007	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	129.5	175.3	-71.9	0	0	0	0	109.7	I983 K1083 M1084	I983-S990 PolarHBondContact N-O 3.49Å; I983-S990 PolarHBondContact O-N 2.92Å; I983-S990 VanDerWaalsContact O-O 3.1Å; S990-K1083 VanDerWaalsContact CB-CE 3.42Å; S990-K1083 WeakPolarHBondContact OG-CE 3.49Å; S990-K1083 PolarHBondContact OG-NZ 2.92Å; S990-K1083 VanDerWaalsContact OG-NZ 3.08Å; S990-M1084 CarbonylContact C-O 3.54Å; S990-M1084 WeakPolarHBondContact CA-O 3.39Å
991	I	83.3	Confident	69.8	Low	0 Å²	0	68.4 Å²	68.4	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	110.7	174.2	-62.6	165.3	0	0	0	107.2	I980 E981 V982 L1006 K1083 M1084 I1086 F1097 F1099	I980-I991 HydrophobicContact CG2-CG2 4.12Å; E981-I991 CarbonylContact O-C 3.6Å; E981-I991 WeakPolarHBondContact O-CA 3.46Å; V982-I991 HydrophobicContact CG1-CG1 4.21Å; V982-I991 HydrophobicContact CG2-CG1 4.35Å; I991-L1006 HydrophobicContact CD1-CD1 4.19Å; I991-L1006 HydrophobicContact CD1-CD2 3.5Å; I991-L1006 HydrophobicContact CD1-CG 4.48Å; I991-K1083 CarbonylContact O-C 3.6Å; I991-K1083 WeakPolarHBondContact O-CA 3.13Å; I991-M1084 PolarHBondContact N-O 3.48Å; I991-M1084 PolarHBondContact O-N 2.85Å; I991-I1086 HydrophobicContact CD1-CD1 3.75Å; I991-I1086 HydrophobicContact CD1-CG1 4.18Å; I991-F1097 HydrophobicContact CD1-CD1 3.73Å; I991-F1097 HydrophobicContact CD1-CE1 4.17Å; I991-F1097 HydrophobicContact CD1-CG 4.33Å; I991-F1099 HydrophobicContact CG2-CE2 4.05Å; I991-F1099 HydrophobicContact CG2-CZ 3.95Å
992	L	80.8	Confident	69.2	Low	60 Å²	60	65.6 Å²	65.6	31%	0.314	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	145.1	170.8	-83.9	72.7	0	0	0	109.4	I980 E981 I983 G1082 K1083	I980-L992 WeakPolarHBondContact CA-O 3.24Å; E981-L992 HydrophobicContact CB-CB 4.26Å; E981-L992 PolarHBondContact N-O 3.33Å; E981-L992 PolarHBondContact O-N 2.87Å; I983-L992 HydrophobicContact CD1-CD1 3.93Å; L992-G1082 CarbonylContact C-O 3.56Å; L992-G1082 VanDerWaalsContact CA-O 3.3Å; L992-G1082 WeakPolarHBondContact CA-O 3.36Å; L992-K1083 HydrophobicContact CD1-CD 4.36Å; L992-K1083 HydrophobicContact CD1-CG 4Å; L992-K1083 HydrophobicContact CG-CG 4.42Å
993	F	82.8	Confident	69	Low	7 Å²	7	69 Å²	69	3%	0.031	39%	0.391	C	S	.	.			trans	-153.6	150.3	177.2	62.2	-83.6	0	0	0	111.1	S979 P995 L1004 V1076 P1079 G1082 M1084 F1099	S979-F993 VanDerWaalsContact O-CA 3.3Å; S979-F993 WeakPolarHBondContact O-CA 3.49Å; F993-P995 WeakPolarHBondContact O-CD 3.21Å; F993-L1004 HydrophobicContact CD2-CD2 4.21Å; F993-L1004 HydrophobicContact CE2-CD2 3.68Å; F993-L1004 HydrophobicContact CZ-CD2 4.19Å; F993-V1076 HydrophobicContact CE1-CG1 4.39Å; F993-V1076 HydrophobicContact CZ-CG1 3.83Å; F993-P1079 VanDerWaalsContact CE2-O 3.32Å; F993-P1079 WeakPolarHBondContact CE2-O 3.42Å; F993-G1082 PolarHBondContact N-O 2.96Å; F993-G1082 CarbonylContact O-C 3.5Å; F993-G1082 WeakPolarHBondContact O-CA 3.16Å; F993-G1082 VanDerWaalsContact O-O 3.13Å; F993-M1084 HydrophobicContact CE1-CB 4.11Å; F993-F1099 HydrophobicContact CB-CE2 3.89Å; F993-F1099 HydrophobicContact CB-CZ 4.1Å; F993-F1099 HydrophobicContact CD1-CE1 4.37Å; F993-F1099 HydrophobicContact CD1-CE2 4.32Å; F993-F1099 AromaticContact CD1-CZ 3.67Å; F993-F1099 HydrophobicContact CD1-CZ 3.67Å; F993-F1099 HydrophobicContact CE1-CZ 4.28Å; F993-F1099 HydrophobicContact CG-CE2 4.17Å; F993-F1099 AromaticContact CG-CZ 3.88Å; F993-F1099 HydrophobicContact CG-CZ 3.88Å
994	S	72.4	Confident	69.3	Low	48 Å²	48	66.6 Å²	66.6	34%	0.336	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-69.2	118.9	176.1	53.1	0	0	0	0	111.9	S979	S979-S994 PolarHBondContact OG-OG 2.95Å
995	P	67.7	Low	69.8	Low	57 Å²	57	63.6 Å²	63.6	37%	0.37	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-72.7	142.3	-177	27.7	-34	0	0	0	113.1	F993 P1079 W1080	F993-P995 WeakPolarHBondContact O-CD 3.21Å; P995-P1079 WeakPolarHBondContact CB-O 3.49Å; P995-W1080 WeakPolarHBondContact CB-O 3.47Å
996	P	62.6	Low	70.8	Confident	33 Å²	33	58.4 Å²	58.4	21%	0.214	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-77.1	130.1	-178.5	30	-34	0	0	0	112.7	K998	P996-K998 PolarHBondContact O-N 2.82Å
997	L	53.9	Low	71.4	Confident	176 Å²	176	58.5 Å²	58.5	92%	0.921	33%	0.325	S	S	*	.	S	Bend	trans	-70.8	3.3	-170.2	-108.5	77.5	0	0	0	117.2
998	K	56.2	Low	72.2	Confident	158 Å²	158	54.3 Å²	54.3	69%	0.687	30%	0.298	S	S	*	.			trans	-141.8	116.8	177.4	-70.2	-172.5	177.2	-177	0	110.6	P996	P996-K998 PolarHBondContact O-N 2.82Å
999	S	52.2	Low	72.8	Confident	95 Å²	95	52.5 Å²	52.5	66%	0.664	29%	0.287	S	S	*	.			trans	-127.7	89.8	-167	60.4	0	0	0	0	113.1
1000	S	53.8	Low	72.6	Confident	112 Å²	112	57.5 Å²	57.5	78%	0.783	31%	0.306	S	S	*	.	S	Bend	trans	-147.8	-29.8	165.8	59.9	0	0	0	0	114.3
1001	L	54.4	Low	72	Confident	132 Å²	132	62.4 Å²	62.4	69%	0.691	32%	0.324	S	S	*	.	S	Bend	trans	-130	14.8	-172.8	-72.8	168	0	0	0	114.8
1002	M	65.5	Low	70.9	Confident	44 Å²	44	67 Å²	67	22%	0.217	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	130.4	-177.7	-61.4	-59.1	-172.3	0	0	111.8	E973 L1101 F1102 Q1103 L1108	E973-M1002 VanDerWaalsContact CD-CE 3.42Å; E973-M1002 HydrophobicContact CG-CE 4.29Å; E973-M1002 WeakPolarHBondContact OE2-CE 3.4Å; M1002-L1101 HydrophobicContact CB-CD1 4.26Å; M1002-F1102 CarbonylContact C-O 3.6Å; M1002-F1102 WeakPolarHBondContact CA-O 3.4Å; M1002-Q1103 HydrophobicContact CE-CB 4.27Å; M1002-Q1103 HydrophobicContact CE-CG 4.07Å; M1002-Q1103 HydrophobicContact SD-CB 3.68Å; M1002-Q1103 HydrophobicContact SD-CG 3.88Å; M1002-L1108 HydrophobicContact CE-CD1 3.8Å; M1002-L1108 HydrophobicContact SD-CD1 3.94Å
1003	K	74.3	Confident	69.4	Low	87 Å²	87	66.4 Å²	66.4	38%	0.378	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129.9	174	176.5	177.7	-175.2	169.7	0	110.1	I1005 Q1075 F1102	K1003-I1005 HydrophobicContact CG-CG1 4.37Å; K1003-Q1075 VanDerWaalsContact CE-CD 3.47Å; K1003-F1102 HydrophobicContact CB-CB 4.25Å; K1003-F1102 PolarHBondContact N-O 3.44Å; K1003-F1102 PolarHBondContact O-N 3.36Å
1004	L	82.3	Confident	67.4	Low	4 Å²	4	75.4 Å²	75.4	2%	0.021	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	130.1	178.8	-174.6	65.2	0	0	0	110.5	I975 F993 V1076 P1079 F1099 L1101	I975-L1004 HydrophobicContact CD1-CD1 3.65Å; I975-L1004 HydrophobicContact CD1-CD2 4.16Å; F993-L1004 HydrophobicContact CD2-CD2 4.21Å; F993-L1004 HydrophobicContact CE2-CD2 3.68Å; F993-L1004 HydrophobicContact CZ-CD2 4.19Å; L1004-V1076 HydrophobicContact CB-CB 4.22Å; L1004-V1076 HydrophobicContact CB-CG2 4.36Å; L1004-V1076 HydrophobicContact CD2-CB 4.16Å; L1004-V1076 HydrophobicContact CD2-CG1 4.25Å; L1004-V1076 HydrophobicContact CD2-CG2 3.98Å; L1004-V1076 HydrophobicContact CG-CB 4.2Å; L1004-V1076 HydrophobicContact CG-CG2 3.87Å; L1004-V1076 PolarHBondContact O-N 2.87Å; L1004-P1079 HydrophobicContact CB-CB 4.36Å; L1004-P1079 HydrophobicContact CB-CG 4.16Å; L1004-P1079 HydrophobicContact CD2-CB 4.09Å; L1004-F1099 HydrophobicContact CD1-CB 4.03Å; L1004-F1099 HydrophobicContact CD1-CD1 3.83Å; L1004-F1099 HydrophobicContact CD1-CG 4.25Å; L1004-F1099 HydrophobicContact CD2-CD1 4.17Å; L1004-F1099 HydrophobicContact CD2-CE1 4.3Å; L1004-F1099 HydrophobicContact CG-CD1 3.94Å; L1004-F1099 HydrophobicContact CG-CE1 4.44Å; L1004-L1101 HydrophobicContact CD1-CD1 4.37Å
1005	I	84.7	Confident	65.4	Low	22 Å²	22	82 Å²	82	11%	0.113	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	132.2	176.6	-51.9	179.6	0	0	0	108.6	K1003 D1073 F1099 L1100 F1102	K1003-I1005 HydrophobicContact CG-CG1 4.37Å; I1005-D1073 HydrophobicContact CG2-CB 3.98Å; I1005-F1099 CarbonylContact O-C 3.51Å; I1005-F1099 WeakPolarHBondContact O-CA 3.24Å; I1005-L1100 HydrophobicContact CB-CB 4.34Å; I1005-L1100 PolarHBondContact N-O 3.48Å; I1005-L1100 PolarHBondContact O-N 3.24Å; I1005-F1102 HydrophobicContact CD1-CD2 4.32Å; I1005-F1102 HydrophobicContact CD1-CE2 3.83Å; I1005-F1102 HydrophobicContact CG1-CE2 4.36Å
1006	L	86	Confident	63.7	Low	0 Å²	0	82.6 Å²	82.6	0%	0	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	118.8	166.9	171.4	67.7	0	0	0	108.4	I991 V1008 Y1074 V1076 M1084 I1086 F1097 F1099	I991-L1006 HydrophobicContact CD1-CD1 4.19Å; I991-L1006 HydrophobicContact CD1-CD2 3.5Å; I991-L1006 HydrophobicContact CD1-CG 4.48Å; L1006-V1008 HydrophobicContact CD2-CG2 4.18Å; L1006-V1008 HydrophobicContact CG-CG2 4Å; L1006-Y1074 PolarHBondContact N-O 2.97Å; L1006-Y1074 PolarHBondContact O-N 3.47Å; L1006-V1076 HydrophobicContact CB-CG2 4.39Å; L1006-M1084 HydrophobicContact CD2-CG 4.2Å; L1006-I1086 HydrophobicContact CD2-CD1 4.18Å; L1006-I1086 HydrophobicContact CD2-CG2 4.15Å; L1006-F1097 HydrophobicContact CD1-CB 4.32Å; L1006-F1099 HydrophobicContact CB-CD1 4.07Å; L1006-F1099 HydrophobicContact CB-CE1 3.78Å; L1006-F1099 HydrophobicContact CD1-CD1 4.31Å; L1006-F1099 HydrophobicContact CD1-CE1 4Å; L1006-F1099 HydrophobicContact CD1-CE2 4.35Å; L1006-F1099 HydrophobicContact CD1-CZ 4.03Å; L1006-F1099 HydrophobicContact CG-CE1 4.41Å
1007	R	84.9	Confident	62.1	Low	55 Å²	55	87.2 Å²	87.2	21%	0.208	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127.5	172.1	170.7	175.2	-69.1	160.7	-0.4	109.8	C1071 E1072 D1073 R1098 L1100	R1007-C1071 HydrophobicContact CG-CB 4.39Å; R1007-E1072 WeakPolarHBondContact CA-O 3.45Å; R1007-D1073 WeakPolarHBondContact CB-OD1 3.47Å; R1007-D1073 VanDerWaalsContact CG-OD1 3.25Å; R1007-D1073 WeakPolarHBondContact CG-OD1 3.09Å; R1007-D1073 IonicContact CZ-OD1 3.83Å; R1007-D1073 IonicContact CZ-OD2 2.92Å; R1007-D1073 IonicContact NE-OD1 2.71Å; R1007-D1073 PolarHBondContact NE-OD1 2.85Å; R1007-D1073 IonicContact NE-OD2 3.93Å; R1007-D1073 PolarHBondContact NE-OD2 3.25Å; R1007-D1073 IonicContact NH2-OD1 3.33Å; R1007-D1073 IonicContact NH2-OD2 2.86Å; R1007-D1073 PolarHBondContact NH2-OD2 2.9Å; R1007-R1098 HydrophobicContact CB-CG 4.08Å; R1007-R1098 HydrophobicContact CG-CG 4.3Å; R1007-R1098 PolarHBondContact N-O 3.17Å; R1007-R1098 WeakPolarHBondContact O-CG 3.17Å; R1007-R1098 PolarHBondContact O-N 3.24Å; R1007-L1100 HydrophobicContact CB-CD1 4.25Å
1008	V	86.3	Confident	61.1	Low	3 Å²	3	85.1 Å²	85.1	2%	0.018	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	124.6	-178.3	-172.4	0	0	0	0	108.1	L1006 C1071 E1072 Y1074 I1086 L1088 Y1095 N1096 F1097	L1006-V1008 HydrophobicContact CD2-CG2 4.18Å; L1006-V1008 HydrophobicContact CG-CG2 4Å; V1008-C1071 CarbonylContact O-C 3.58Å; V1008-C1071 VanDerWaalsContact O-CA 3.31Å; V1008-C1071 WeakPolarHBondContact O-CA 3.42Å; V1008-E1072 PolarHBondContact N-O 3.29Å; V1008-E1072 PolarHBondContact O-N 3.35Å; V1008-Y1074 HydrophobicContact CB-CE2 4.4Å; V1008-Y1074 HydrophobicContact CG2-CD2 3.88Å; V1008-Y1074 HydrophobicContact CG2-CE2 4.02Å; V1008-I1086 HydrophobicContact CG2-CD1 3.98Å; V1008-L1088 HydrophobicContact CG1-CD2 4.06Å; V1008-Y1095 HydrophobicContact CG1-CD1 3.68Å; V1008-Y1095 HydrophobicContact CG1-CE1 4.43Å; V1008-Y1095 HydrophobicContact CG1-CG 4.05Å; V1008-N1096 WeakPolarHBondContact CA-O 3.34Å; V1008-F1097 HydrophobicContact CB-CD1 4.48Å; V1008-F1097 HydrophobicContact CG1-CD1 3.98Å; V1008-F1097 HydrophobicContact CG1-CE1 3.69Å; V1008-F1097 HydrophobicContact CG2-CD1 3.95Å; V1008-F1097 HydrophobicContact CG2-CE1 4.23Å
1009	C	82.5	Confident	59.9	Low	7 Å²	7	85.2 Å²	85.2	5%	0.047	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	143.1	178.4	-54.2	0	0	0	0	111.7	G1070 C1071 Y1095 N1096 R1098	C1009-G1070 CarbonylContact C-O 3.57Å; C1009-G1070 VanDerWaalsContact CA-O 3.27Å; C1009-G1070 WeakPolarHBondContact CA-O 3.28Å; C1009-C1071 HydrophobicContact CB-CB 4.08Å; C1009-C1071 WeakPolarHBondContact CB-SG 3.24Å; C1009-C1071 WeakPolarHBondContact SG-CB 3.14Å; C1009-C1071 CovalentContact SG-SG 2.04Å; C1009-C1071 PolarHBondContact SG-SG 3.47Å; C1009-Y1095 CarbonylContact O-C 3.53Å; C1009-Y1095 VanDerWaalsContact O-CA 3.26Å; C1009-Y1095 WeakPolarHBondContact O-CA 3.32Å; C1009-N1096 WeakPolarHBondContact CB-OD1 3.41Å; C1009-N1096 PolarHBondContact N-O 3.43Å; C1009-N1096 VanDerWaalsContact N-O 3.09Å; C1009-N1096 PolarHBondContact O-N 2.9Å; C1009-R1098 PolarHBondContact SG-NH2 3.14Å
1010	R	76.8	Confident	58.8	Low	106 Å²	106	87.7 Å²	87.7	40%	0.4	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	139.8	171.7	-130.4	175.3	77.5	175.5	1.7	110	D1012 G1070 D1090 L1094 Y1095	R1010-D1012 IonicContact CZ-OD2 3.58Å; R1010-D1012 IonicContact NE-OD2 3.73Å; R1010-D1012 PolarHBondContact NE-OD2 2.92Å; R1010-D1012 IonicContact NH2-OD2 3.87Å; R1010-D1012 PolarHBondContact NH2-OD2 3.32Å; R1010-D1012 PolarHBondContact O-N 3.43Å; R1010-G1070 PolarHBondContact N-O 2.75Å; R1010-D1090 VanDerWaalsContact CD-OD2 3.25Å; R1010-D1090 WeakPolarHBondContact CD-OD2 3.35Å; R1010-D1090 IonicContact CZ-OD2 3.84Å; R1010-D1090 IonicContact NE-OD2 2.77Å; R1010-D1090 IonicContact NH1-OD2 2.76Å; R1010-D1090 PolarHBondContact NH1-OD2 3.37Å; R1010-L1094 WeakPolarHBondContact CA-O 3.36Å; R1010-L1094 HydrophobicContact CG-CB 4.29Å; R1010-L1094 WeakPolarHBondContact CG-O 3.24Å; R1010-Y1095 HydrophobicContact CB-CD1 4.28Å; R1010-Y1095 HydrophobicContact CB-CE1 4.33Å; R1010-Y1095 HydrophobicContact CG-CD1 3.95Å; R1010-Y1095 HydrophobicContact CG-CE1 3.87Å
1011	R	68.2	Low	57.6	Low	104 Å²	104	88.6 Å²	88.6	39%	0.392	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-15	-169.4	-67.7	172.2	-166	-174.3	8	114.5	A1013 Q1093 L1094 Y1095	R1011-A1013 VanDerWaalsContact C-N 3.35Å; R1011-A1013 PolarHBondContact O-N 3.31Å; R1011-Q1093 PolarHBondContact NE-O 3.41Å; R1011-Q1093 PolarHBondContact NH1-O 3.34Å; R1011-Q1093 PolarHBondContact NH2-O 3.42Å; R1011-Q1093 VanDerWaalsContact NH2-O 3.13Å; R1011-L1094 WeakPolarHBondContact CG-O 3.43Å; R1011-L1094 PolarHBondContact N-O 3.01Å; R1011-Y1095 VanDerWaalsContact CZ-O 3.3Å; R1011-Y1095 PolarHBondContact NE-O 2.99Å; R1011-Y1095 PolarHBondContact NH2-O 3.25Å
1012	D	59.8	Low	56.5	Low	97 Å²	97	87.5 Å²	87.5	52%	0.519	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-2.8	-169.1	-25.8	-46.2	0	0	0	114	R1010	R1010-D1012 IonicContact CZ-OD2 3.58Å; R1010-D1012 IonicContact NE-OD2 3.73Å; R1010-D1012 PolarHBondContact NE-OD2 2.92Å; R1010-D1012 IonicContact NH2-OD2 3.87Å; R1010-D1012 PolarHBondContact NH2-OD2 3.32Å; R1010-D1012 PolarHBondContact O-N 3.43Å
1013	A	50.2	Low	54.7	Low	47 Å²	47	91 Å²	91	39%	0.388	45%	0.453	S	S	.	.			trans	-78.6	134.8	-179.4	0	0	0	0	0	112.1	R1011	R1011-A1013 VanDerWaalsContact C-N 3.35Å; R1011-A1013 PolarHBondContact O-N 3.31Å
1014	F	40.5	Very low	52.6	Low	197 Å²	197	91.1 Å²	91.1	86%	0.864	45%	0.454	S	S	*	.			trans	78.5	71	178.3	-64.7	-85.5	0	0	0	118.2	G1016	F1014-G1016 PolarHBondContact O-N 3.05Å
1015	L	31.5	Very low	49.9	Very low	185 Å²	185	94.1 Å²	94.1	97%	0.969	48%	0.475	S	S	*	.			trans	-82.6	93.1	148.8	-108.6	162.7	0	0	0	109.9
1016	G	31.7	Very low	47.3	Very low	71 Å²	71	99.3 Å²	99.3	73%	0.732	51%	0.508	S	S	*	.			trans	-162.9	85.7	178.1	0	0	0	0	0	110.7	F1014	F1014-G1016 PolarHBondContact O-N 3.05Å
1017	N	28.1	Very low	44.4	Very low	129 Å²	129	103.4 Å²	103.4	69%	0.69	54%	0.537	S	S	*	.			trans	-136.9	162.3	-160.9	-161.3	-2.5	0	0	0	112.2
1018	H	34.2	Very low	41.5	Very low	133 Å²	133	109.8 Å²	109.8	62%	0.616	57%	0.566	S	S	*	*			trans	72.7	144.4	173.6	-62.1	-47	0	0	0	117.4
1019	K	29.9	Very low	38.6	Very low	160 Å²	160	118.4 Å²	118.4	70%	0.696	61%	0.606	S	S	*	*			cis	-142.2	146.8	1.8	-113.5	148.8	-176.5	-177.4	0	108.9
1020	Q	29.1	Very low	35.8	Very low	146 Å²	146	125.7 Å²	125.7	68%	0.682	64%	0.639	S	S	*	*				47.8	149.8	79.2	-39.7	179.3	-56.5	0	0	113.4
1021	I	29	Very low	33.5	Very low	132 Å²	132	129.5 Å²	129.5	68%	0.677	66%	0.659	S	S	*	*			cis	-159.8	171.5	9.5	-139.3	-177.8	0	0	0	106.9
1022	D	30.7	Very low	31.4	Very low	108 Å²	108	133 Å²	133	58%	0.578	68%	0.677	S	S	*	*			cis	-166	-177.8	16.1	-128.1	-4.7	0	0	0	107.3
1023	K	28.9	Very low	30	Very low	119 Å²	119	138.4 Å²	138.4	52%	0.517	69%	0.69	S	S	.	*			cis	-165.8	159.5	-21.9	-140.4	179	-149.1	73.6	0	109
1024	Q	29.9	Very low	28.9	Very low	88 Å²	88	143.1 Å²	143.1	41%	0.411	71%	0.709	S	S	.	*			trans	60.8	159.5	150.7	-80.5	-173.7	-8.7	0	0	121.7	A1141 V1145	Q1024-A1141 PolarHBondContact OE1-O 3.44Å; Q1024-V1145 HydrophobicContact CB-CG2 3.76Å
1025	S	25.1	Very low	28.3	Very low	67 Å²	67	141.1 Å²	141.1	47%	0.469	71%	0.705	S	S	.	*			cis	178.6	165.9	-43	53.1	0	0	0	0	110.2
1026	V	29.6	Very low	28	Very low	132 Å²	132	138 Å²	138	80%	0.8	70%	0.696	S	S	*	*			trans	75.2	129.5	171.2	-177	0	0	0	0	113.3
1027	S	24.9	Very low	27.7	Very low	85 Å²	85	141.7 Å²	141.7	59%	0.594	69%	0.694	S	S	*	*			cis	-162.4	153.6	-7.7	150.5	0	0	0	0	110.9
1028	K	24.1	Very low	27.6	Very low	189 Å²	189	142.9 Å²	142.9	82%	0.822	70%	0.696	S	S	*	*			trans	28.8	110.9	155	-59.3	169.4	-175.9	176.2	0	118.1
1029	Q	25.4	Very low	27.1	Very low	184 Å²	184	146.1 Å²	146.1	86%	0.86	71%	0.708	S	S	*	*				-176.4	179	92.7	-115	170.6	-14.7	0	0	112.1
1030	H	25.2	Very low	27	Very low	161 Å²	161	143.5 Å²	143.5	75%	0.745	71%	0.705	S	S	*	*			trans	-58	131.2	-172.9	-60.7	-75.2	0	0	0	114.2
1031	F	28.2	Very low	26.9	Very low	186 Å²	186	141.6 Å²	141.6	82%	0.816	71%	0.708	S	S	*	*			trans	-132.9	133.6	147.8	-118.5	-87.4	0	0	0	110
1032	K	23.5	Very low	27	Very low	176 Å²	176	142.8 Å²	142.8	77%	0.765	71%	0.714	S	S	*	*			trans	-110.6	111.3	-177.7	-168.4	-177.3	-175.1	-175.6	0	107.5
1033	R	30.1	Very low	26.7	Very low	212 Å²	212	143.9 Å²	143.9	80%	0.8	73%	0.725	S	S	*	*			trans	-156.8	111.3	173.1	-119.6	175.4	-174.6	137.3	3.1	111
1034	D	28	Very low	26.8	Very low	146 Å²	146	143.2 Å²	143.2	78%	0.781	74%	0.735	S	S	*	*			trans	-69.1	143.9	160.7	-60.7	-74.9	0	0	0	109.6
1035	I	27.4	Very low	26.6	Very low	154 Å²	154	148.4 Å²	148.4	79%	0.79	76%	0.756	S	S	*	*			trans	-113.1	104	169.8	-62.1	176	0	0	0	107.5
1036	P	25.9	Very low	26.7	Very low	119 Å²	119	152.7 Å²	152.7	77%	0.773	77%	0.774	S	S	*	*			trans	-102.5	61.4	-179.9	37.9	-32.9	0	0	0	112
1037	Q	25.1	Very low	26.8	Very low	149 Å²	149	152.3 Å²	152.3	70%	0.696	77%	0.772	S	S	*	*			trans	-144	150.1	167.1	-69.9	-159.7	23.4	0	0	108.7
1038	Q	25.4	Very low	26.9	Very low	154 Å²	154	152.7 Å²	152.7	72%	0.72	77%	0.774	S	S	*	*			cis	-149	130.2	7.3	-137	174	51	0	0	108
1039	K	24.1	Very low	27	Very low	202 Å²	202	149.9 Å²	149.9	88%	0.878	77%	0.769	S	S	*	*			trans	-99.7	101	167.7	-167.8	174.5	-175.2	-179.9	0	109.3	S1041	K1039-S1041 PolarHBondContact O-N 3.12Å
1040	V	26.8	Very low	27.1	Very low	104 Å²	104	148.8 Å²	148.8	63%	0.63	76%	0.763	S	S	*	*			trans	-64.4	129.5	170	177.3	0	0	0	0	109.1	I1042	V1040-I1042 HydrophobicContact CG1-CD1 4.42Å; V1040-I1042 HydrophobicContact CG1-CG1 3.91Å
1041	S	26.8	Very low	27.1	Very low	107 Å²	107	146.5 Å²	146.5	75%	0.748	76%	0.756	S	S	*	*			trans	-136.6	95.8	161	58.3	0	0	0	0	107.5	K1039 T1043	K1039-S1041 PolarHBondContact O-N 3.12Å; S1041-T1043 PolarHBondContact O-N 3.22Å
1042	I	30.9	Very low	27	Very low	156 Å²	156	143.6 Å²	143.6	80%	0.8	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-66.7	125.9	174.8	-68.3	171.3	0	0	0	107.9	V1040 S1044	V1040-I1042 HydrophobicContact CG1-CD1 4.42Å; V1040-I1042 HydrophobicContact CG1-CG1 3.91Å; I1042-S1044 PolarHBondContact O-N 3.12Å
1043	T	25.8	Very low	27.4	Very low	131 Å²	131	142.1 Å²	142.1	80%	0.804	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-68.1	125.4	174.5	-24.9	0	0	0	0	109.6	S1041	S1041-T1043 PolarHBondContact O-N 3.22Å
1044	S	29.6	Very low	27.1	Very low	105 Å²	105	135.8 Å²	135.8	73%	0.734	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-89.9	145.3	157.7	52.7	0	0	0	0	109.5	I1042	I1042-S1044 PolarHBondContact O-N 3.12Å
1045	K	26.9	Very low	27.1	Very low	197 Å²	197	134.2 Å²	134.2	86%	0.857	75%	0.748	S	S	*	*			trans	-165.1	112.1	150.9	-116	-178.5	-177.8	-172.7	0	110.8
1046	N	26.7	Very low	27.1	Very low	157 Å²	157	138.4 Å²	138.4	84%	0.84	75%	0.754	S	S	*	*			trans	-172.6	150.1	130.8	-105	-6.5	0	0	0	110.8
1047	V	31.3	Very low	27	Very low	124 Å²	124	140 Å²	140	75%	0.752	76%	0.755	S	S	*	*			trans	60.6	93.1	161	178.1	0	0	0	0	114.5
1048	S	28.8	Very low	26.9	Very low	93 Å²	93	139.6 Å²	139.6	65%	0.65	76%	0.758	S	S	*	*				69.3	144.4	72.1	80.6	0	0	0	0	113.8
1049	N	25.6	Very low	26.8	Very low	131 Å²	131	136.6 Å²	136.6	70%	0.701	75%	0.754	S	S	*	*			cis	-163.7	157.5	-2.4	-124.4	17.1	0	0	0	109.4
1050	Q	26.1	Very low	26.8	Very low	161 Å²	161	131.7 Å²	131.7	75%	0.752	75%	0.745	S	S	*	*			trans	65.9	156.1	156	-69	171.7	-63.3	0	0	116.8
1051	N	27	Very low	26.8	Very low	112 Å²	112	134.9 Å²	134.9	60%	0.599	75%	0.753	S	S	*	*			cis	-149.5	167.7	5.8	-135.5	29.9	0	0	0	113
1052	D	26.1	Very low	26.7	Very low	125 Å²	125	137.4 Å²	137.4	67%	0.668	76%	0.757	S	S	*	*			trans	78.5	123.5	145.9	-68	-36.7	0	0	0	125.7
1053	V	30.2	Very low	26.4	Very low	145 Å²	145	135.9 Å²	135.9	88%	0.879	76%	0.76	S	S	*	*			trans	82.5	148.5	137.3	174.1	0	0	0	0	119.1
1054	A	25.5	Very low	26.4	Very low	80 Å²	80	133.5 Å²	133.5	66%	0.661	75%	0.754	S	S	*	*			trans	-118.4	161.1	-158.6	0	0	0	0	0	114.6
1055	S	26.9	Very low	26.6	Very low	112 Å²	112	135.7 Å²	135.7	78%	0.783	76%	0.757	S	S	*	*			trans	66.1	113.5	156.5	69.6	0	0	0	0	118.8
1056	R	27.4	Very low	26.7	Very low	243 Å²	243	130.7 Å²	130.7	92%	0.917	75%	0.747	S	S	*	*				-165.5	171.6	117.7	-107.6	170.9	-174.7	-168.5	0.8	112.3
1057	L	24.3	Very low	27	Very low	152 Å²	152	133.5 Å²	133.5	80%	0.796	75%	0.746	S	S	*	*			trans	-72.5	160.4	179.1	-78.2	65.2	0	0	0	112
1058	D	22	Very low	27.4	Very low	140 Å²	140	132 Å²	132	75%	0.749	74%	0.738	S	S	*	*			trans	90.2	147.8	138.1	-119.2	-55.9	0	0	0	122.1
1059	S	23.7	Very low	28.2	Very low	92 Å²	92	133 Å²	133	64%	0.643	74%	0.739	S	S	*	*			trans	63.4	93.9	147.7	-72.3	0	0	0	0	121.5
1060	S	23.9	Very low	29.8	Very low	99 Å²	99	128.5 Å²	128.5	69%	0.692	72%	0.723	S	S	*	*				102.2	155.5	115	85	0	0	0	0	120.7
1061	Q	27.7	Very low	32.3	Very low	170 Å²	170	122.4 Å²	122.4	79%	0.794	70%	0.699	S	S	*	*			trans	59.5	105.6	164.7	-58.1	177	30.5	0	0	116.1
1062	I	25.2	Very low	34.9	Very low	160 Å²	160	121.6 Å²	121.6	82%	0.821	69%	0.691	S	S	*	*				50.5	88.3	61.6	-47.8	179.4	0	0	0	112.3
1063	S	23.2	Very low	37.6	Very low	124 Å²	124	119.3 Å²	119.3	87%	0.867	68%	0.679	S	S	*	*			trans	-150.8	68.7	158.1	-163.4	0	0	0	0	112
1064	A	27	Very low	40.1	Very low	81 Å²	81	115.7 Å²	115.7	67%	0.669	65%	0.65	S	S	*	*			trans	-161.8	128.4	162.4	0	0	0	0	0	108.4
1065	N	32.3	Very low	42.7	Very low	151 Å²	151	117.4 Å²	117.4	81%	0.807	64%	0.644	S	S	*	*			cis	-148.9	144.8	-4.1	-117.7	-20.8	0	0	0	111.7
1066	S	29.1	Very low	45.3	Very low	93 Å²	93	112.4 Å²	112.4	65%	0.65	61%	0.609	S	S	*	*			trans	-59.5	142.5	158.4	51.5	0	0	0	0	111
1067	R	34.2	Very low	47.3	Very low	215 Å²	215	104.7 Å²	104.7	81%	0.811	60%	0.597	S	S	*	*			cis	-139.3	133.1	-3.4	-75.6	112.7	172.9	-162.7	-1.3	109.7	V1069	R1067-V1069 HydrophobicContact CB-CG2 3.85Å; R1067-V1069 PolarHBondContact O-N 3.45Å
1068	T	39.9	Very low	49.7	Very low	94 Å²	94	103.1 Å²	103.1	58%	0.577	58%	0.584	S	S	*	*			trans	-81.2	87.8	151.2	41.6	0	0	0	0	108.8	G1070 C1071	T1068-G1070 PolarHBondContact O-N 2.7Å; T1068-G1070 VanDerWaalsContact O-N 3.09Å; T1068-C1071 PolarHBondContact O-N 3.29Å
1069	V	44.2	Very low	52	Low	113 Å²	113	97.5 Å²	97.5	69%	0.685	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	113.5	-179.2	-178.3	0	0	0	0	109.6	R1067	R1067-V1069 HydrophobicContact CB-CG2 3.85Å; R1067-V1069 PolarHBondContact O-N 3.45Å
1070	G	60.6	Low	54.2	Low	36 Å²	36	100.4 Å²	100.4	37%	0.371	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	103.8	5.3	177.6	0	0	0	0	0	116.9	C1009 R1010 T1068	C1009-G1070 CarbonylContact C-O 3.57Å; C1009-G1070 VanDerWaalsContact CA-O 3.27Å; C1009-G1070 WeakPolarHBondContact CA-O 3.28Å; R1010-G1070 PolarHBondContact N-O 2.75Å; T1068-G1070 PolarHBondContact O-N 2.7Å; T1068-G1070 VanDerWaalsContact O-N 3.09Å
1071	C	78.5	Confident	56.5	Low	34 Å²	34	100.9 Å²	100.9	23%	0.23	55%	0.546	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	144.1	174.6	-63.8	0	0	0	0	112.9	R1007 V1008 C1009 T1068	R1007-C1071 HydrophobicContact CG-CB 4.39Å; V1008-C1071 CarbonylContact O-C 3.58Å; V1008-C1071 VanDerWaalsContact O-CA 3.31Å; V1008-C1071 WeakPolarHBondContact O-CA 3.42Å; C1009-C1071 HydrophobicContact CB-CB 4.08Å; C1009-C1071 WeakPolarHBondContact CB-SG 3.24Å; C1009-C1071 WeakPolarHBondContact SG-CB 3.14Å; C1009-C1071 CovalentContact SG-SG 2.04Å; C1009-C1071 PolarHBondContact SG-SG 3.47Å; T1068-C1071 PolarHBondContact O-N 3.29Å
1072	E	80.4	Confident	58.6	Low	94 Å²	94	93.3 Å²	93.3	44%	0.439	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	140.8	174.5	-64.2	-176.4	156.7	0	0	111.2	R1007 V1008 Y1074	R1007-E1072 WeakPolarHBondContact CA-O 3.45Å; V1008-E1072 PolarHBondContact N-O 3.29Å; V1008-E1072 PolarHBondContact O-N 3.35Å; E1072-Y1074 HydrophobicContact CB-CD2 4.37Å; E1072-Y1074 HydrophobicContact CB-CE2 3.69Å; E1072-Y1074 PolarHBondContact OE2-OH 2.91Å
1073	D	83.2	Confident	61.2	Low	77 Å²	77	89.6 Å²	89.6	41%	0.412	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	107.9	-174.7	-79.2	18.2	0	0	0	111.3	I1005 R1007	I1005-D1073 HydrophobicContact CG2-CB 3.98Å; R1007-D1073 WeakPolarHBondContact CB-OD1 3.47Å; R1007-D1073 VanDerWaalsContact CG-OD1 3.25Å; R1007-D1073 WeakPolarHBondContact CG-OD1 3.09Å; R1007-D1073 IonicContact CZ-OD1 3.83Å; R1007-D1073 IonicContact CZ-OD2 2.92Å; R1007-D1073 IonicContact NE-OD1 2.71Å; R1007-D1073 PolarHBondContact NE-OD1 2.85Å; R1007-D1073 IonicContact NE-OD2 3.93Å; R1007-D1073 PolarHBondContact NE-OD2 3.25Å; R1007-D1073 IonicContact NH2-OD1 3.33Å; R1007-D1073 IonicContact NH2-OD2 2.86Å; R1007-D1073 PolarHBondContact NH2-OD2 2.9Å
1074	Y	82.5	Confident	64	Low	69 Å²	69	85 Å²	85	27%	0.271	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	112.9	179.4	-65	-98	0	0	0	110.6	L1006 V1008 E1072 V1076 I1086	L1006-Y1074 PolarHBondContact N-O 2.97Å; L1006-Y1074 PolarHBondContact O-N 3.47Å; V1008-Y1074 HydrophobicContact CB-CE2 4.4Å; V1008-Y1074 HydrophobicContact CG2-CD2 3.88Å; V1008-Y1074 HydrophobicContact CG2-CE2 4.02Å; E1072-Y1074 HydrophobicContact CB-CD2 4.37Å; E1072-Y1074 HydrophobicContact CB-CE2 3.69Å; E1072-Y1074 PolarHBondContact OE2-OH 2.91Å; Y1074-V1076 PolarHBondContact O-N 2.64Å; Y1074-I1086 HydrophobicContact CD1-CG2 4.03Å; Y1074-I1086 HydrophobicContact CE1-CG2 4.34Å; Y1074-I1086 HydrophobicContact CG-CG2 4.21Å
1075	Q	80.3	Confident	66.5	Low	117 Å²	117	86.3 Å²	86.3	55%	0.547	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	127.9	175.5	-179	172.9	-45.3	0	0	111	K1003 A1077	K1003-Q1075 VanDerWaalsContact CE-CD 3.47Å; Q1075-A1077 PolarHBondContact O-N 2.81Å; Q1075-A1077 VanDerWaalsContact O-N 3.17Å
1076	V	81.2	Confident	68.9	Low	7 Å²	7	79.6 Å²	79.6	4%	0.042	41%	0.413	C	S	.	.			trans	-77.7	105	-179.7	-175.7	0	0	0	0	109.6	F993 L1004 L1006 Y1074 K1078 P1079 M1084 F1099	F993-V1076 HydrophobicContact CE1-CG1 4.39Å; F993-V1076 HydrophobicContact CZ-CG1 3.83Å; L1004-V1076 HydrophobicContact CB-CB 4.22Å; L1004-V1076 HydrophobicContact CB-CG2 4.36Å; L1004-V1076 HydrophobicContact CD2-CB 4.16Å; L1004-V1076 HydrophobicContact CD2-CG1 4.25Å; L1004-V1076 HydrophobicContact CD2-CG2 3.98Å; L1004-V1076 HydrophobicContact CG-CB 4.2Å; L1004-V1076 HydrophobicContact CG-CG2 3.87Å; L1004-V1076 PolarHBondContact O-N 2.87Å; L1006-V1076 HydrophobicContact CB-CG2 4.39Å; Y1074-V1076 PolarHBondContact O-N 2.64Å; V1076-K1078 VanDerWaalsContact C-N 3.32Å; V1076-K1078 PolarHBondContact O-N 2.59Å; V1076-P1079 HydrophobicContact CB-CG 4.41Å; V1076-P1079 HydrophobicContact CG1-CB 4.43Å; V1076-P1079 HydrophobicContact CG1-CG 4.19Å; V1076-P1079 WeakPolarHBondContact O-CD 3.43Å; V1076-M1084 HydrophobicContact CB-SD 4.27Å; V1076-M1084 HydrophobicContact CG1-SD 4.08Å; V1076-M1084 HydrophobicContact CG2-CE 4.37Å; V1076-M1084 HydrophobicContact CG2-SD 4.09Å; V1076-F1099 HydrophobicContact CG2-CD1 4.39Å; V1076-F1099 HydrophobicContact CG2-CE1 3.88Å
1077	A	70.7	Confident	71.1	Confident	81 Å²	81	81 Å²	81	67%	0.669	41%	0.409	S	S	*	.	S	Bend	trans	-68.4	-25.9	-173.2	0	0	0	0	0	114.5	Q1075	Q1075-A1077 PolarHBondContact O-N 2.81Å; Q1075-A1077 VanDerWaalsContact O-N 3.17Å
1078	K	74.6	Confident	73.2	Confident	118 Å²	118	71.5 Å²	71.5	51%	0.513	37%	0.374	S	S	.	.			trans	-137.3	73.7	179.7	-62.6	-176.7	-179.7	174.9	0	111.4	V1076 W1080 L1081	V1076-K1078 VanDerWaalsContact C-N 3.32Å; V1076-K1078 PolarHBondContact O-N 2.59Å; K1078-W1080 HydrophobicContact CB-CD2 4.36Å; K1078-W1080 HydrophobicContact CB-CH2 4.01Å; K1078-W1080 HydrophobicContact CB-CZ2 3.82Å; K1078-W1080 HydrophobicContact CB-CZ3 4.35Å; K1078-W1080 HydrophobicContact CD-CZ2 4.08Å; K1078-W1080 HydrophobicContact CG-CH2 3.83Å; K1078-W1080 HydrophobicContact CG-CZ2 3.69Å; K1078-W1080 PolarHBondContact O-N 2.95Å; K1078-L1081 HydrophobicContact CB-CD1 3.78Å; K1078-L1081 HydrophobicContact CB-CG 3.97Å; K1078-L1081 HydrophobicContact CD-CD1 3.64Å; K1078-L1081 HydrophobicContact CD-CG 4.43Å; K1078-L1081 HydrophobicContact CG-CD1 4.34Å; K1078-L1081 PolarHBondContact O-N 2.72Å; K1078-L1081 VanDerWaalsContact O-N 3.08Å
1079	P	70.8	Confident	74.7	Confident	22 Å²	22	72 Å²	72	14%	0.143	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-59.3	-20.4	-173.3	-25.9	36	0	0	0	115.2	F993 P995 L1004 V1076	F993-P1079 VanDerWaalsContact CE2-O 3.32Å; F993-P1079 WeakPolarHBondContact CE2-O 3.42Å; P995-P1079 WeakPolarHBondContact CB-O 3.49Å; L1004-P1079 HydrophobicContact CB-CB 4.36Å; L1004-P1079 HydrophobicContact CB-CG 4.16Å; L1004-P1079 HydrophobicContact CD2-CB 4.09Å; V1076-P1079 HydrophobicContact CB-CG 4.41Å; V1076-P1079 HydrophobicContact CG1-CB 4.43Å; V1076-P1079 HydrophobicContact CG1-CG 4.19Å; V1076-P1079 WeakPolarHBondContact O-CD 3.43Å
1080	W	69.8	Low	76.3	Confident	154 Å²	154	69.7 Å²	69.7	58%	0.583	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-78.9	-12.9	179	62.3	89.2	0	0	0	114.4	P995 K1078 G1082	P995-W1080 WeakPolarHBondContact CB-O 3.47Å; K1078-W1080 HydrophobicContact CB-CD2 4.36Å; K1078-W1080 HydrophobicContact CB-CH2 4.01Å; K1078-W1080 HydrophobicContact CB-CZ2 3.82Å; K1078-W1080 HydrophobicContact CB-CZ3 4.35Å; K1078-W1080 HydrophobicContact CD-CZ2 4.08Å; K1078-W1080 HydrophobicContact CG-CH2 3.83Å; K1078-W1080 HydrophobicContact CG-CZ2 3.69Å; K1078-W1080 PolarHBondContact O-N 2.95Å; W1080-G1082 VanDerWaalsContact C-N 3.32Å
1081	L	71.3	Confident	77.1	Confident	109 Å²	109	70.9 Å²	70.9	57%	0.571	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-77.7	-15.9	179	-72.4	-178.4	0	0	0	113.7	K1078 K1083	K1078-L1081 HydrophobicContact CB-CD1 3.78Å; K1078-L1081 HydrophobicContact CB-CG 3.97Å; K1078-L1081 HydrophobicContact CD-CD1 3.64Å; K1078-L1081 HydrophobicContact CD-CG 4.43Å; K1078-L1081 HydrophobicContact CG-CD1 4.34Å; K1078-L1081 PolarHBondContact O-N 2.72Å; K1078-L1081 VanDerWaalsContact O-N 3.08Å; L1081-K1083 PolarHBondContact O-N 2.79Å; L1081-K1083 VanDerWaalsContact O-N 3.07Å
1082	G	72	Confident	77.2	Confident	11 Å²	11	69.6 Å²	69.6	11%	0.113	36%	0.363	C	S	.	.	S	Bend	trans	61.7	13.9	-178.4	0	0	0	0	0	115.4	L992 F993 W1080	L992-G1082 CarbonylContact C-O 3.56Å; L992-G1082 VanDerWaalsContact CA-O 3.3Å; L992-G1082 WeakPolarHBondContact CA-O 3.36Å; F993-G1082 PolarHBondContact N-O 2.96Å; F993-G1082 CarbonylContact O-C 3.5Å; F993-G1082 WeakPolarHBondContact O-CA 3.16Å; F993-G1082 VanDerWaalsContact O-O 3.13Å; W1080-G1082 VanDerWaalsContact C-N 3.32Å
1083	K	78.7	Confident	76.9	Confident	82 Å²	82	70.6 Å²	70.6	36%	0.357	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	137.5	175.3	-166.5	-173.6	-173.6	-160.4	0	110.1	S990 I991 L992 L1081 E1085	S990-K1083 VanDerWaalsContact CB-CE 3.42Å; S990-K1083 WeakPolarHBondContact OG-CE 3.49Å; S990-K1083 PolarHBondContact OG-NZ 2.92Å; S990-K1083 VanDerWaalsContact OG-NZ 3.08Å; I991-K1083 CarbonylContact O-C 3.6Å; I991-K1083 WeakPolarHBondContact O-CA 3.13Å; L992-K1083 HydrophobicContact CD1-CD 4.36Å; L992-K1083 HydrophobicContact CD1-CG 4Å; L992-K1083 HydrophobicContact CG-CG 4.42Å; L1081-K1083 PolarHBondContact O-N 2.79Å; L1081-K1083 VanDerWaalsContact O-N 3.07Å; K1083-E1085 WeakPolarHBondContact CE-OE1 3.41Å; K1083-E1085 IonicContact NZ-OE1 3.74Å; K1083-E1085 PolarHBondContact NZ-OE1 3.41Å
1084	M	82.1	Confident	76.6	Confident	28 Å²	28	70.3 Å²	70.3	14%	0.138	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	142.5	171.9	-176.8	81.1	165.5	0	0	107.8	S990 I991 F993 L1006 V1076 I1086	S990-M1084 CarbonylContact C-O 3.54Å; S990-M1084 WeakPolarHBondContact CA-O 3.39Å; I991-M1084 PolarHBondContact N-O 3.48Å; I991-M1084 PolarHBondContact O-N 2.85Å; F993-M1084 HydrophobicContact CE1-CB 4.11Å; L1006-M1084 HydrophobicContact CD2-CG 4.2Å; V1076-M1084 HydrophobicContact CB-SD 4.27Å; V1076-M1084 HydrophobicContact CG1-SD 4.08Å; V1076-M1084 HydrophobicContact CG2-CE 4.37Å; V1076-M1084 HydrophobicContact CG2-SD 4.09Å; M1084-I1086 HydrophobicContact CE-CG2 4.34Å; M1084-I1086 HydrophobicContact CG-CG2 4.29Å
1085	E	80.6	Confident	76.6	Confident	108 Å²	108	67.8 Å²	67.8	51%	0.505	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	133.2	172.7	-68.5	-178.4	-160.6	0	0	109.3	K1083	K1083-E1085 WeakPolarHBondContact CE-OE1 3.41Å; K1083-E1085 IonicContact NZ-OE1 3.74Å; K1083-E1085 PolarHBondContact NZ-OE1 3.41Å
1086	I	81.5	Confident	76.9	Confident	9 Å²	9	63.8 Å²	63.8	5%	0.046	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	152.2	178.5	58.9	170.4	0	0	0	110.6	T989 I991 L1006 V1008 Y1074 M1084 L1088 F1097	T989-I1086 PolarHBondContact N-O 3.45Å; T989-I1086 PolarHBondContact O-N 3.2Å; I991-I1086 HydrophobicContact CD1-CD1 3.75Å; I991-I1086 HydrophobicContact CD1-CG1 4.18Å; L1006-I1086 HydrophobicContact CD2-CD1 4.18Å; L1006-I1086 HydrophobicContact CD2-CG2 4.15Å; V1008-I1086 HydrophobicContact CG2-CD1 3.98Å; Y1074-I1086 HydrophobicContact CD1-CG2 4.03Å; Y1074-I1086 HydrophobicContact CE1-CG2 4.34Å; Y1074-I1086 HydrophobicContact CG-CG2 4.21Å; M1084-I1086 HydrophobicContact CE-CG2 4.34Å; M1084-I1086 HydrophobicContact CG-CG2 4.29Å; I1086-L1088 HydrophobicContact CD1-CD2 3.85Å; I1086-L1088 HydrophobicContact CD1-CG 4.32Å; I1086-F1097 HydrophobicContact CD1-CD1 4.38Å; I1086-F1097 HydrophobicContact CD1-CE1 3.91Å
1087	H	75.8	Confident	77.2	Confident	122 Å²	122	63.5 Å²	63.5	57%	0.565	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.2	115.7	174.8	-156.6	-55.4	0	0	0	108.3
1088	L	77.7	Confident	77.9	Confident	16 Å²	16	62.3 Å²	62.3	8%	0.084	32%	0.315	C	S	.	.			trans	-90.1	153.1	178.9	-63.7	172.1	0	0	0	109.9	T989 V1008 I1086 V1092 Y1095 F1097	T989-L1088 HydrophobicContact CG2-CD1 4.38Å; V1008-L1088 HydrophobicContact CG1-CD2 4.06Å; I1086-L1088 HydrophobicContact CD1-CD2 3.85Å; I1086-L1088 HydrophobicContact CD1-CG 4.32Å; L1088-V1092 HydrophobicContact CD1-CB 4.09Å; L1088-V1092 HydrophobicContact CD1-CG2 3.93Å; L1088-Y1095 HydrophobicContact CB-CD2 4.5Å; L1088-Y1095 HydrophobicContact CB-CE2 3.94Å; L1088-Y1095 HydrophobicContact CD1-CD2 3.93Å; L1088-Y1095 HydrophobicContact CD1-CE2 4.22Å; L1088-Y1095 HydrophobicContact CD2-CD2 4.09Å; L1088-Y1095 HydrophobicContact CD2-CE1 4.44Å; L1088-Y1095 HydrophobicContact CD2-CE2 4.03Å; L1088-Y1095 HydrophobicContact CD2-CG 4.31Å; L1088-Y1095 HydrophobicContact CG-CD2 4.41Å; L1088-Y1095 HydrophobicContact CG-CE2 4.28Å; L1088-F1097 HydrophobicContact CD1-CE1 4.29Å; L1088-F1097 HydrophobicContact CD1-CZ 3.97Å; L1088-F1097 HydrophobicContact CD2-CE1 4.42Å
1089	S	73.3	Confident	78.5	Confident	104 Å²	104	56.8 Å²	56.8	73%	0.727	29%	0.291	S	S	*	.	S	Bend	trans	-83.8	-43.3	176.6	-40.8	0	0	0	0	111.6	Y1095	S1089-Y1095 PolarHBondContact N-OH 3.37Å
1090	D	77.7	Confident	79.1	Confident	66 Å²	66	56 Å²	56	35%	0.353	29%	0.285	S	S	.	.	S	Bend	trans	-104.6	175.6	177.7	-60.2	-51	0	0	0	111.3	R1010 L1094 Y1095	R1010-D1090 VanDerWaalsContact CD-OD2 3.25Å; R1010-D1090 WeakPolarHBondContact CD-OD2 3.35Å; R1010-D1090 IonicContact CZ-OD2 3.84Å; R1010-D1090 IonicContact NE-OD2 2.77Å; R1010-D1090 IonicContact NH1-OD2 2.76Å; R1010-D1090 PolarHBondContact NH1-OD2 3.37Å; D1090-L1094 HydrophobicContact CB-CD1 4.08Å; D1090-Y1095 HydrophobicContact CB-CE2 3.83Å; D1090-Y1095 PolarHBondContact N-OH 2.79Å; D1090-Y1095 VanDerWaalsContact N-OH 3.17Å
1091	A	76.5	Confident	79.6	Confident	61 Å²	61	48.9 Å²	48.9	50%	0.504	26%	0.258	S	S	.	.			trans	-59.4	139.1	176	0	0	0	0	0	112.5	Q1093 L1094	A1091-Q1093 PolarHBondContact O-N 3.17Å; A1091-L1094 PolarHBondContact O-N 3.17Å
1092	V	79.9	Confident	79.8	Confident	6 Å²	6	46 Å²	46	4%	0.036	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-52.7	-26.2	-177.4	70.4	0	0	0	0	114.1	V982 H984 T989 L1088 L1094 Y1095 F1097 W1116	V982-V1092 HydrophobicContact CG1-CG2 4.09Å; H984-V1092 HydrophobicContact CB-CG1 4.31Å; T989-V1092 HydrophobicContact CG2-CG2 3.89Å; L1088-V1092 HydrophobicContact CD1-CB 4.09Å; L1088-V1092 HydrophobicContact CD1-CG2 3.93Å; V1092-L1094 VanDerWaalsContact C-N 3.26Å; V1092-L1094 PolarHBondContact O-N 2.93Å; V1092-Y1095 PolarHBondContact O-N 3.03Å; V1092-F1097 HydrophobicContact CG2-CE2 4.14Å; V1092-F1097 HydrophobicContact CG2-CZ 3.94Å; V1092-W1116 HydrophobicContact CG1-CB 4.32Å; V1092-W1116 HydrophobicContact CG1-CD2 3.8Å; V1092-W1116 HydrophobicContact CG1-CE3 4.36Å; V1092-W1116 HydrophobicContact CG1-CG 3.77Å; V1092-W1116 HydrophobicContact CG2-CB 4Å; V1092-W1116 HydrophobicContact CG2-CG 4.01Å
1093	Q	75.2	Confident	79.8	Confident	115 Å²	115	49.8 Å²	49.8	54%	0.537	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-68.7	-13.9	176.8	-63.1	-179.5	15	0	0	114.8	R1011 A1091 W1116	R1011-Q1093 PolarHBondContact NE-O 3.41Å; R1011-Q1093 PolarHBondContact NH1-O 3.34Å; R1011-Q1093 PolarHBondContact NH2-O 3.42Å; R1011-Q1093 VanDerWaalsContact NH2-O 3.13Å; A1091-Q1093 PolarHBondContact O-N 3.17Å; Q1093-W1116 HydrophobicContact CG-CE3 3.65Å; Q1093-W1116 HydrophobicContact CG-CZ3 3.85Å
1094	L	77.4	Confident	79.4	Confident	72 Å²	72	48.8 Å²	48.8	38%	0.377	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-93.7	-6.8	180	-65	175.5	0	0	0	113.6	R1010 R1011 D1090 A1091 V1092	R1010-L1094 WeakPolarHBondContact CA-O 3.36Å; R1010-L1094 HydrophobicContact CG-CB 4.29Å; R1010-L1094 WeakPolarHBondContact CG-O 3.24Å; R1011-L1094 WeakPolarHBondContact CG-O 3.43Å; R1011-L1094 PolarHBondContact N-O 3.01Å; D1090-L1094 HydrophobicContact CB-CD1 4.08Å; A1091-L1094 PolarHBondContact O-N 3.17Å; V1092-L1094 VanDerWaalsContact C-N 3.26Å; V1092-L1094 PolarHBondContact O-N 2.93Å
1095	Y	82	Confident	78.9	Confident	16 Å²	16	54.5 Å²	54.5	6%	0.063	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	165.2	-178.8	-61.5	-86.5	0	0	0	112.8	V1008 C1009 R1010 R1011 L1088 S1089 D1090 V1092	V1008-Y1095 HydrophobicContact CG1-CD1 3.68Å; V1008-Y1095 HydrophobicContact CG1-CE1 4.43Å; V1008-Y1095 HydrophobicContact CG1-CG 4.05Å; C1009-Y1095 CarbonylContact O-C 3.53Å; C1009-Y1095 VanDerWaalsContact O-CA 3.26Å; C1009-Y1095 WeakPolarHBondContact O-CA 3.32Å; R1010-Y1095 HydrophobicContact CB-CD1 4.28Å; R1010-Y1095 HydrophobicContact CB-CE1 4.33Å; R1010-Y1095 HydrophobicContact CG-CD1 3.95Å; R1010-Y1095 HydrophobicContact CG-CE1 3.87Å; R1011-Y1095 VanDerWaalsContact CZ-O 3.3Å; R1011-Y1095 PolarHBondContact NE-O 2.99Å; R1011-Y1095 PolarHBondContact NH2-O 3.25Å; L1088-Y1095 HydrophobicContact CB-CD2 4.5Å; L1088-Y1095 HydrophobicContact CB-CE2 3.94Å; L1088-Y1095 HydrophobicContact CD1-CD2 3.93Å; L1088-Y1095 HydrophobicContact CD1-CE2 4.22Å; L1088-Y1095 HydrophobicContact CD2-CD2 4.09Å; L1088-Y1095 HydrophobicContact CD2-CE1 4.44Å; L1088-Y1095 HydrophobicContact CD2-CE2 4.03Å; L1088-Y1095 HydrophobicContact CD2-CG 4.31Å; L1088-Y1095 HydrophobicContact CG-CD2 4.41Å; L1088-Y1095 HydrophobicContact CG-CE2 4.28Å; S1089-Y1095 PolarHBondContact N-OH 3.37Å; D1090-Y1095 HydrophobicContact CB-CE2 3.83Å; D1090-Y1095 PolarHBondContact N-OH 2.79Å; D1090-Y1095 VanDerWaalsContact N-OH 3.17Å; V1092-Y1095 PolarHBondContact O-N 3.03Å
1096	N	86.3	Confident	77.8	Confident	32 Å²	32	56.1 Å²	56.1	17%	0.171	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	156	160.5	67	35.4	0	0	0	110.3	V1008 C1009 P1113 V1114 L1115	V1008-N1096 WeakPolarHBondContact CA-O 3.34Å; C1009-N1096 WeakPolarHBondContact CB-OD1 3.41Å; C1009-N1096 PolarHBondContact N-O 3.43Å; C1009-N1096 VanDerWaalsContact N-O 3.09Å; C1009-N1096 PolarHBondContact O-N 2.9Å; N1096-P1113 HydrophobicContact CB-CB 4.03Å; N1096-V1114 WeakPolarHBondContact CA-O 3.46Å; N1096-L1115 HydrophobicContact CB-CD2 3.77Å
1097	F	87.6	Confident	77.3	Confident	1 Å²	1	59.2 Å²	59.2	0%	0.004	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	128.2	-170.8	-53.5	-82.3	0	0	0	110.1	V982 I991 L1006 V1008 I1086 L1088 V1092 V1114	V982-F1097 HydrophobicContact CG1-CD2 4.28Å; V982-F1097 HydrophobicContact CG1-CE2 3.97Å; V982-F1097 HydrophobicContact CG1-CZ 4.34Å; V982-F1097 HydrophobicContact CG2-CD2 3.95Å; V982-F1097 HydrophobicContact CG2-CE2 4.45Å; V982-F1097 HydrophobicContact CG2-CG 4.4Å; I991-F1097 HydrophobicContact CD1-CD1 3.73Å; I991-F1097 HydrophobicContact CD1-CE1 4.17Å; I991-F1097 HydrophobicContact CD1-CG 4.33Å; L1006-F1097 HydrophobicContact CD1-CB 4.32Å; V1008-F1097 HydrophobicContact CB-CD1 4.48Å; V1008-F1097 HydrophobicContact CG1-CD1 3.98Å; V1008-F1097 HydrophobicContact CG1-CE1 3.69Å; V1008-F1097 HydrophobicContact CG2-CD1 3.95Å; V1008-F1097 HydrophobicContact CG2-CE1 4.23Å; I1086-F1097 HydrophobicContact CD1-CD1 4.38Å; I1086-F1097 HydrophobicContact CD1-CE1 3.91Å; L1088-F1097 HydrophobicContact CD1-CE1 4.29Å; L1088-F1097 HydrophobicContact CD1-CZ 3.97Å; L1088-F1097 HydrophobicContact CD2-CE1 4.42Å; V1092-F1097 HydrophobicContact CG2-CE2 4.14Å; V1092-F1097 HydrophobicContact CG2-CZ 3.94Å; F1097-V1114 PolarHBondContact N-O 2.86Å; F1097-V1114 PolarHBondContact O-N 3.09Å
1098	R	85.5	Confident	76.9	Confident	57 Å²	57	56.6 Å²	56.6	22%	0.215	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	143.2	176.3	44.1	167.7	162	172.9	-7.1	111.3	R1007 C1009 E1110 T1111	R1007-R1098 HydrophobicContact CB-CG 4.08Å; R1007-R1098 HydrophobicContact CG-CG 4.3Å; R1007-R1098 PolarHBondContact N-O 3.17Å; R1007-R1098 WeakPolarHBondContact O-CG 3.17Å; R1007-R1098 PolarHBondContact O-N 3.24Å; C1009-R1098 PolarHBondContact SG-NH2 3.14Å; R1098-E1110 VanDerWaalsContact CD-OE1 3.24Å; R1098-E1110 WeakPolarHBondContact CD-OE1 3.47Å; R1098-E1110 IonicContact CZ-OE1 3.15Å; R1098-E1110 IonicContact NE-OE1 2.67Å; R1098-E1110 IonicContact NH1-OE1 3.07Å; R1098-E1110 PolarHBondContact NH1-OE1 3.03Å; R1098-T1111 WeakPolarHBondContact CA-OG1 3.43Å
1099	F	86.7	Confident	76.6	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.009	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	144.6	173.3	-75.2	-75.5	0	0	0	111.7	I980 I991 F993 L1004 I1005 L1006 V1076 E1110 T1111	I980-F1099 HydrophobicContact CD1-CD2 3.77Å; I980-F1099 HydrophobicContact CD1-CE2 4.28Å; I980-F1099 HydrophobicContact CG1-CD2 4.02Å; I980-F1099 HydrophobicContact CG1-CE2 4.08Å; I980-F1099 HydrophobicContact CG2-CE2 4.13Å; I991-F1099 HydrophobicContact CG2-CE2 4.05Å; I991-F1099 HydrophobicContact CG2-CZ 3.95Å; F993-F1099 HydrophobicContact CB-CE2 3.89Å; F993-F1099 HydrophobicContact CB-CZ 4.1Å; F993-F1099 HydrophobicContact CD1-CE1 4.37Å; F993-F1099 HydrophobicContact CD1-CE2 4.32Å; F993-F1099 AromaticContact CD1-CZ 3.67Å; F993-F1099 HydrophobicContact CD1-CZ 3.67Å; F993-F1099 HydrophobicContact CE1-CZ 4.28Å; F993-F1099 HydrophobicContact CG-CE2 4.17Å; F993-F1099 AromaticContact CG-CZ 3.88Å; F993-F1099 HydrophobicContact CG-CZ 3.88Å; L1004-F1099 HydrophobicContact CD1-CB 4.03Å; L1004-F1099 HydrophobicContact CD1-CD1 3.83Å; L1004-F1099 HydrophobicContact CD1-CG 4.25Å; L1004-F1099 HydrophobicContact CD2-CD1 4.17Å; L1004-F1099 HydrophobicContact CD2-CE1 4.3Å; L1004-F1099 HydrophobicContact CG-CD1 3.94Å; L1004-F1099 HydrophobicContact CG-CE1 4.44Å; I1005-F1099 CarbonylContact O-C 3.51Å; I1005-F1099 WeakPolarHBondContact O-CA 3.24Å; L1006-F1099 HydrophobicContact CB-CD1 4.07Å; L1006-F1099 HydrophobicContact CB-CE1 3.78Å; L1006-F1099 HydrophobicContact CD1-CD1 4.31Å; L1006-F1099 HydrophobicContact CD1-CE1 4Å; L1006-F1099 HydrophobicContact CD1-CE2 4.35Å; L1006-F1099 HydrophobicContact CD1-CZ 4.03Å; L1006-F1099 HydrophobicContact CG-CE1 4.41Å; V1076-F1099 HydrophobicContact CG2-CD1 4.39Å; V1076-F1099 HydrophobicContact CG2-CE1 3.88Å; F1099-E1110 WeakPolarHBondContact O-CA 3.45Å; F1099-T1111 HydrophobicContact CB-CG2 3.94Å; F1099-T1111 PolarHBondContact N-OG1 3.18Å; F1099-T1111 PolarHBondContact O-N 3.08Å
1100	L	83.3	Confident	76.8	Confident	4 Å²	4	57 Å²	57	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	116.6	175.1	-59.2	169.3	0	0	0	108.5	I1005 R1007 F1102 L1107 Q1109 E1110	I1005-L1100 HydrophobicContact CB-CB 4.34Å; I1005-L1100 PolarHBondContact N-O 3.48Å; I1005-L1100 PolarHBondContact O-N 3.24Å; R1007-L1100 HydrophobicContact CB-CD1 4.25Å; L1100-F1102 HydrophobicContact CB-CD2 4.34Å; L1100-F1102 HydrophobicContact CB-CE2 3.69Å; L1100-L1107 HydrophobicContact CB-CD1 3.98Å; L1100-L1107 HydrophobicContact CD2-CD1 4.06Å; L1100-Q1109 WeakPolarHBondContact CA-O 3.37Å; L1100-E1110 HydrophobicContact CD2-CB 3.7Å; L1100-E1110 HydrophobicContact CD2-CG 3.56Å
1101	L	80.9	Confident	76.8	Confident	6 Å²	6	54.3 Å²	54.3	3%	0.031	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	122.6	179	-177.1	66.9	0	0	0	109.8	M1002 L1004 L1108 Q1109	M1002-L1101 HydrophobicContact CB-CD1 4.26Å; L1004-L1101 HydrophobicContact CD1-CD1 4.37Å; L1101-L1108 PolarHBondContact O-N 3.17Å; L1101-Q1109 HydrophobicContact CB-CB 4.13Å; L1101-Q1109 PolarHBondContact N-O 3.46Å; L1101-Q1109 PolarHBondContact O-N 3.26Å
1102	F	75.6	Confident	76.7	Confident	49 Å²	49	53.8 Å²	53.8	22%	0.215	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	141.2	179.8	-67.6	-99.7	0	0	0	111.8	M1002 K1003 I1005 L1100 K1106 L1107	M1002-F1102 CarbonylContact C-O 3.6Å; M1002-F1102 WeakPolarHBondContact CA-O 3.4Å; K1003-F1102 HydrophobicContact CB-CB 4.25Å; K1003-F1102 PolarHBondContact N-O 3.44Å; K1003-F1102 PolarHBondContact O-N 3.36Å; I1005-F1102 HydrophobicContact CD1-CD2 4.32Å; I1005-F1102 HydrophobicContact CD1-CE2 3.83Å; I1005-F1102 HydrophobicContact CG1-CE2 4.36Å; L1100-F1102 HydrophobicContact CB-CD2 4.34Å; L1100-F1102 HydrophobicContact CB-CE2 3.69Å; F1102-K1106 CarbonylContact C-O 3.47Å; F1102-K1106 VanDerWaalsContact CA-O 3.32Å; F1102-K1106 WeakPolarHBondContact CA-O 3.33Å; F1102-L1107 HydrophobicContact CD1-CB 4.13Å; F1102-L1107 HydrophobicContact CD1-CD1 4.24Å; F1102-L1107 HydrophobicContact CD2-CD1 4.11Å; F1102-L1107 HydrophobicContact CE1-CB 3.96Å; F1102-L1107 HydrophobicContact CE1-CD1 3.94Å; F1102-L1107 HydrophobicContact CE2-CD1 3.8Å; F1102-L1107 HydrophobicContact CG-CD1 4.32Å; F1102-L1107 HydrophobicContact CZ-CD1 3.71Å
1103	Q	71.2	Confident	76.3	Confident	89 Å²	89	57 Å²	57	42%	0.416	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	109.9	167.2	-173.6	178.1	43.9	0	0	108.3	M1002 T1105 K1106 L1108	M1002-Q1103 HydrophobicContact CE-CB 4.27Å; M1002-Q1103 HydrophobicContact CE-CG 4.07Å; M1002-Q1103 HydrophobicContact SD-CB 3.68Å; M1002-Q1103 HydrophobicContact SD-CG 3.88Å; Q1103-T1105 PolarHBondContact O-N 2.9Å; Q1103-K1106 PolarHBondContact N-O 2.8Å; Q1103-K1106 PolarHBondContact O-N 3.21Å; Q1103-L1108 HydrophobicContact CB-CD1 3.67Å; Q1103-L1108 HydrophobicContact CB-CD2 4.14Å; Q1103-L1108 HydrophobicContact CB-CG 3.74Å
1104	G	71.5	Confident	76.4	Confident	62 Å²	62	52.2 Å²	52.2	64%	0.639	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	-123.3	-165.7	0	0	0	0	0	111.1
1105	T	70.7	Confident	76.2	Confident	148 Å²	148	52.6 Å²	52.6	91%	0.908	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-6	176	52.3	0	0	0	0	114.2	Q1103	Q1103-T1105 PolarHBondContact O-N 2.9Å
1106	K	57.5	Low	75.8	Confident	141 Å²	141	54.7 Å²	54.7	61%	0.613	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	122.9	-173.8	-173.1	-179.1	178.8	-174.7	0	111.1	F1102 Q1103 L1108	F1102-K1106 CarbonylContact C-O 3.47Å; F1102-K1106 VanDerWaalsContact CA-O 3.32Å; F1102-K1106 WeakPolarHBondContact CA-O 3.33Å; Q1103-K1106 PolarHBondContact N-O 2.8Å; Q1103-K1106 PolarHBondContact O-N 3.21Å; K1106-L1108 PolarHBondContact O-N 3.3Å
1107	L	71.7	Confident	74.4	Confident	75 Å²	75	60.5 Å²	60.5	39%	0.393	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	120.6	166.4	-173.9	71.4	0	0	0	108.8	L1100 F1102 Q1109	L1100-L1107 HydrophobicContact CB-CD1 3.98Å; L1100-L1107 HydrophobicContact CD2-CD1 4.06Å; F1102-L1107 HydrophobicContact CD1-CB 4.13Å; F1102-L1107 HydrophobicContact CD1-CD1 4.24Å; F1102-L1107 HydrophobicContact CD2-CD1 4.11Å; F1102-L1107 HydrophobicContact CE1-CB 3.96Å; F1102-L1107 HydrophobicContact CE1-CD1 3.94Å; F1102-L1107 HydrophobicContact CE2-CD1 3.8Å; F1102-L1107 HydrophobicContact CG-CD1 4.32Å; F1102-L1107 HydrophobicContact CZ-CD1 3.71Å; L1107-Q1109 WeakPolarHBondContact CD1-O 3.44Å
1108	L	67.7	Low	72.9	Confident	67 Å²	67	64.6 Å²	64.6	35%	0.351	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-40.8	173.2	-71.7	-172.5	0	0	0	111.8	M1002 L1101 Q1103 K1106	M1002-L1108 HydrophobicContact CE-CD1 3.8Å; M1002-L1108 HydrophobicContact SD-CD1 3.94Å; L1101-L1108 PolarHBondContact O-N 3.17Å; Q1103-L1108 HydrophobicContact CB-CD1 3.67Å; Q1103-L1108 HydrophobicContact CB-CD2 4.14Å; Q1103-L1108 HydrophobicContact CB-CG 3.74Å; K1106-L1108 PolarHBondContact O-N 3.3Å
1109	Q	70	Confident	70.8	Confident	42 Å²	42	71 Å²	71	20%	0.196	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	141.2	-174.5	-159.5	-159.7	-13.5	0	0	111.5	I975 L1100 L1101 L1107	I975-Q1109 PolarHBondContact O-NE2 2.71Å; L1100-Q1109 WeakPolarHBondContact CA-O 3.37Å; L1101-Q1109 HydrophobicContact CB-CB 4.13Å; L1101-Q1109 PolarHBondContact N-O 3.46Å; L1101-Q1109 PolarHBondContact O-N 3.26Å; L1107-Q1109 WeakPolarHBondContact CD1-O 3.44Å
1110	E	78.4	Confident	68.7	Low	86 Å²	86	78.2 Å²	78.2	40%	0.402	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	135.8	159.8	174.9	160.8	-152.9	0	0	107.9	R1098 F1099 L1100	R1098-E1110 VanDerWaalsContact CD-OE1 3.24Å; R1098-E1110 WeakPolarHBondContact CD-OE1 3.47Å; R1098-E1110 IonicContact CZ-OE1 3.15Å; R1098-E1110 IonicContact NE-OE1 2.67Å; R1098-E1110 IonicContact NH1-OE1 3.07Å; R1098-E1110 PolarHBondContact NH1-OE1 3.03Å; F1099-E1110 WeakPolarHBondContact O-CA 3.45Å; L1100-E1110 HydrophobicContact CD2-CB 3.7Å; L1100-E1110 HydrophobicContact CD2-CG 3.56Å
1111	T	77.8	Confident	66.5	Low	10 Å²	10	83.7 Å²	83.7	6%	0.061	46%	0.456	C	S	.	.			trans	-87.2	158	176.5	72.2	0	0	0	0	111.5	I975 I980 R1098 F1099	I975-T1111 HydrophobicContact CB-CG2 4.32Å; I975-T1111 HydrophobicContact CG2-CG2 4.31Å; I980-T1111 HydrophobicContact CD1-CG2 4.16Å; R1098-T1111 WeakPolarHBondContact CA-OG1 3.43Å; F1099-T1111 HydrophobicContact CB-CG2 3.94Å; F1099-T1111 PolarHBondContact N-OG1 3.18Å; F1099-T1111 PolarHBondContact O-N 3.08Å
1112	S	73.3	Confident	64.1	Low	50 Å²	50	92.9 Å²	92.9	35%	0.35	50%	0.496	S	S	.	.			trans	-53	150.1	165.2	-15.7	0	0	0	0	111.1	E977 V1114	E977-S1112 VanDerWaalsContact CD-CB 3.49Å; E977-S1112 WeakPolarHBondContact OE2-CB 3.32Å; E977-S1112 PolarHBondContact OE2-OG 2.94Å; S1112-V1114 PolarHBondContact O-N 2.85Å; S1112-V1114 VanDerWaalsContact O-N 3.14Å
1113	P	73	Confident	62.2	Low	72 Å²	72	97.7 Å²	97.7	47%	0.468	53%	0.53	S	S	.	.			trans	-75.2	100	176.4	30	-33.6	0	0	0	111	N1096	N1096-P1113 HydrophobicContact CB-CB 4.03Å
1114	V	76.9	Confident	60.2	Low	16 Å²	16	105.6 Å²	105.6	10%	0.097	56%	0.556	C	S	.	*	B	Isolated β-bridge	trans	-68.5	138.4	177.4	179.8	0	0	0	0	110.2	E977 I980 V982 N1096 F1097 S1112	E977-V1114 HydrophobicContact CG-CG2 3.93Å; I980-V1114 HydrophobicContact CB-CG2 4.05Å; I980-V1114 HydrophobicContact CD1-CG2 3.93Å; I980-V1114 HydrophobicContact CG2-CB 4.35Å; I980-V1114 HydrophobicContact CG2-CG1 4.31Å; I980-V1114 HydrophobicContact CG2-CG2 4.04Å; V982-V1114 HydrophobicContact CG2-CG1 4.23Å; N1096-V1114 WeakPolarHBondContact CA-O 3.46Å; F1097-V1114 PolarHBondContact N-O 2.86Å; F1097-V1114 PolarHBondContact O-N 3.09Å; S1112-V1114 PolarHBondContact O-N 2.85Å; S1112-V1114 VanDerWaalsContact O-N 3.14Å
1115	L	73.3	Confident	58.1	Low	80 Å²	80	105.7 Å²	105.7	42%	0.419	56%	0.557	S	S	.	*			trans	-111.8	135.4	178	-52.6	177.2	0	0	0	108.8	N1096 Q1117	N1096-L1115 HydrophobicContact CB-CD2 3.77Å; L1115-Q1117 PolarHBondContact O-N 2.83Å
1116	W	73.6	Confident	56.1	Low	60 Å²	60	104.7 Å²	104.7	23%	0.227	55%	0.55	C	S	.	*			trans	-60.7	133.8	170.9	-177.6	88.4	0	0	0	110.8	V982 V1092 Q1093 P1118	V982-W1116 PolarHBondContact O-NE1 3.42Å; V1092-W1116 HydrophobicContact CG1-CB 4.32Å; V1092-W1116 HydrophobicContact CG1-CD2 3.8Å; V1092-W1116 HydrophobicContact CG1-CE3 4.36Å; V1092-W1116 HydrophobicContact CG1-CG 3.77Å; V1092-W1116 HydrophobicContact CG2-CB 4Å; V1092-W1116 HydrophobicContact CG2-CG 4.01Å; Q1093-W1116 HydrophobicContact CG-CE3 3.65Å; Q1093-W1116 HydrophobicContact CG-CZ3 3.85Å; W1116-P1118 HydrophobicContact CH2-CB 3.89Å; W1116-P1118 HydrophobicContact CZ3-CB 4.18Å; W1116-P1118 HydrophobicContact CZ3-CG 4.36Å
1117	Q	56.9	Low	54.9	Low	154 Å²	154	107.8 Å²	107.8	72%	0.72	56%	0.564	S	S	*	*			trans	-130.6	138.4	177.7	-62.5	-179.4	16.4	0	0	109.2	L1115	L1115-Q1117 PolarHBondContact O-N 2.83Å
1118	P	55.4	Low	52.9	Low	87 Å²	87	111 Å²	111	57%	0.565	58%	0.581	S	S	*	*			trans	-72.2	142.4	171.7	30.7	-33.4	0	0	0	110.7	W1116 I1120	W1116-P1118 HydrophobicContact CH2-CB 3.89Å; W1116-P1118 HydrophobicContact CZ3-CB 4.18Å; W1116-P1118 HydrophobicContact CZ3-CG 4.36Å; P1118-I1120 PolarHBondContact O-N 3.43Å
1119	E	41.8	Very low	51	Low	192 Å²	192	116.3 Å²	116.3	90%	0.897	60%	0.602	S	S	*	*			trans	-65.1	115.4	-177.3	-67.9	-174.8	95.5	0	0	113
1120	I	42.9	Very low	49.4	Very low	152 Å²	152	120.4 Å²	120.4	78%	0.779	64%	0.635	S	S	*	*			trans	-135.4	135.4	164.6	-56	-178.8	0	0	0	107.9	P1118	P1118-I1120 PolarHBondContact O-N 3.43Å
1121	S	36.9	Very low	47	Very low	120 Å²	120	122.7 Å²	122.7	84%	0.839	65%	0.65	S	S	*	*			trans	-76.5	147.3	-161.4	49.2	0	0	0	0	115.5
1122	K	31	Very low	44.7	Very low	198 Å²	198	129.9 Å²	129.9	86%	0.861	69%	0.687	S	S	*	*			trans	-94.4	139.3	-177.2	-64.7	175.2	178.9	173.2	0	113
1123	T	35	Very low	42.7	Very low	150 Å²	150	131.9 Å²	131.9	92%	0.92	71%	0.707	S	S	*	*			trans	-138.6	165.6	158.1	46.7	0	0	0	0	111.8
1124	R	29.1	Very low	41.1	Very low	255 Å²	255	136 Å²	136	96%	0.962	72%	0.724	S	S	*	*			trans	-98.8	146.4	-161.2	-77	172.3	160.7	164.1	-7	115
1125	G	27.6	Very low	39	Very low	65 Å²	65	140.7 Å²	140.7	67%	0.67	76%	0.764	S	S	*	*				121.2	126.3	104.5	0	0	0	0	0	121
1126	V	29.3	Very low	37.5	Very low	126 Å²	126	141 Å²	141	76%	0.764	78%	0.778	S	S	*	*			trans	63.2	111.3	143.3	-166.7	0	0	0	0	119.5
1127	F	31.5	Very low	36.3	Very low	206 Å²	206	143 Å²	143	90%	0.904	80%	0.801	S	S	*	*				-169.4	164.2	108.9	-110.6	-76.2	0	0	0	110.7
1128	N	29.8	Very low	35.8	Very low	142 Å²	142	138.5 Å²	138.5	76%	0.759	80%	0.796	S	S	*	*			trans	-145.5	148.7	-176.7	-163.4	-9.3	0	0	0	111.8
1129	K	28.7	Very low	35.4	Very low	180 Å²	180	136.8 Å²	136.8	78%	0.783	80%	0.795	S	S	*	*			trans	66.4	109.6	-179.6	-59.6	-176.4	179.1	179	0	117.6
1130	S	34.7	Very low	36	Very low	128 Å²	128	132.2 Å²	132.2	90%	0.895	78%	0.783	S	S	*	*				-113.9	172.3	122.8	-167.9	0	0	0	0	108.8
1131	L	29.4	Very low	36.8	Very low	134 Å²	134	126.3 Å²	126.3	70%	0.702	76%	0.756	S	S	*	*			trans	-126.4	157.6	-160.8	-152.2	80.7	0	0	0	112.5
1132	L	29.6	Very low	37.8	Very low	160 Å²	160	124.8 Å²	124.8	84%	0.838	74%	0.739	S	S	*	*			trans	54.6	95.8	151.9	-116.1	70.6	0	0	0	118.6
1133	A	30.8	Very low	39.6	Very low	93 Å²	93	119.4 Å²	119.4	77%	0.769	72%	0.722	S	S	*	*			trans	-147.5	157.6	150.8	0	0	0	0	0	110.5
1134	L	38.2	Very low	41.4	Very low	158 Å²	158	117 Å²	117	83%	0.827	70%	0.703	S	S	*	*			trans	63.3	49	172.5	-63.1	172.7	0	0	0	117.8	A1136	L1134-A1136 PolarHBondContact O-N 2.82Å
1135	A	34.5	Very low	43.4	Very low	115 Å²	115	106.9 Å²	106.9	95%	0.95	67%	0.669	S	S	*	*			trans	-73.5	78.2	152.4	0	0	0	0	0	110.3
1136	A	41.4	Very low	45.6	Very low	86 Å²	86	110.5 Å²	110.5	71%	0.711	67%	0.666	S	S	*	*			trans	-142.9	-2.4	-171.6	0	0	0	0	0	117.1	L1134	L1134-A1136 PolarHBondContact O-N 2.82Å
1137	S	49	Very low	47.7	Very low	101 Å²	101	108.8 Å²	108.8	71%	0.706	65%	0.653	S	S	*	*	S	Bend	trans	-129.3	-5.3	-171.8	56.5	0	0	0	0	116.2	G1139	S1137-G1139 VanDerWaalsContact C-N 3.27Å; S1137-G1139 PolarHBondContact O-N 3.49Å
1138	G	45.1	Very low	49.7	Very low	60 Å²	60	103.2 Å²	103.2	62%	0.619	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-14.8	-173.3	0	0	0	0	0	116.4
1139	G	47.3	Very low	51.6	Low	52 Å²	52	99.4 Å²	99.4	54%	0.536	61%	0.613	S	S	.	*	H	α-helix	trans	-73.8	-33.5	-172.6	0	0	0	0	0	115.5	S1137 A1141	S1137-G1139 VanDerWaalsContact C-N 3.27Å; S1137-G1139 PolarHBondContact O-N 3.49Å; G1139-A1141 PolarHBondContact O-N 3.3Å
1140	C	54.5	Low	53.7	Low	96 Å²	96	93.9 Å²	93.9	65%	0.649	59%	0.592	S	S	*	*	H	α-helix	trans	-68.2	-33.5	-169.7	-67.1	0	0	0	0	113.6	I1144	C1140-I1144 WeakPolarHBondContact O-CG1 3.36Å; C1140-I1144 PolarHBondContact O-N 3.44Å
1141	A	59.5	Low	55.4	Low	27 Å²	27	92.6 Å²	92.6	22%	0.223	57%	0.574	C	S	.	*	H	α-helix	trans	-79.4	-35	-172.5	0	0	0	0	0	113.1	Q1024 G1139 V1143 I1144 V1145	Q1024-A1141 PolarHBondContact OE1-O 3.44Å; G1139-A1141 PolarHBondContact O-N 3.3Å; A1141-V1143 VanDerWaalsContact C-N 3.31Å; A1141-V1143 PolarHBondContact O-N 2.83Å; A1141-I1144 WeakPolarHBondContact O-CB 3.5Å; A1141-I1144 PolarHBondContact O-N 3.37Å; A1141-I1144 VanDerWaalsContact O-N 3.15Å; A1141-V1145 PolarHBondContact O-N 3.24Å
1142	L	56.9	Low	57.2	Low	89 Å²	89	91.2 Å²	91.2	47%	0.466	57%	0.566	S	S	.	*	H	α-helix	trans	-66.7	-33.9	173.6	-68.1	177.6	0	0	0	111.8	I1144 V1145 F1146	L1142-I1144 VanDerWaalsContact C-N 3.34Å; L1142-V1145 PolarHBondContact O-N 3.38Å; L1142-F1146 WeakPolarHBondContact O-CB 3.3Å; L1142-F1146 PolarHBondContact O-N 3.23Å
1143	V	70.7	Confident	58.9	Low	85 Å²	85	88.4 Å²	88.4	52%	0.515	55%	0.551	S	S	.	*	H	α-helix	trans	-64.3	-39.1	171.3	175.3	0	0	0	0	111.1	A1141 F1146 L1147	A1141-V1143 VanDerWaalsContact C-N 3.31Å; A1141-V1143 PolarHBondContact O-N 2.83Å; V1143-F1146 PolarHBondContact O-N 3.4Å; V1143-L1147 HydrophobicContact CG1-CD1 3.94Å; V1143-L1147 HydrophobicContact CG1-CG 4.34Å; V1143-L1147 WeakPolarHBondContact O-CB 3.37Å; V1143-L1147 VanDerWaalsContact O-CG 3.3Å; V1143-L1147 WeakPolarHBondContact O-CG 3.15Å; V1143-L1147 PolarHBondContact O-N 3Å
1144	I	71.8	Confident	60.4	Low	99 Å²	99	92.5 Å²	92.5	51%	0.508	55%	0.547	S	S	.	.	H	α-helix	trans	-64.7	-43	176	-69.5	166.3	0	0	0	111.3	C1140 A1141 L1142 F1146 L1147 I1148	C1140-I1144 WeakPolarHBondContact O-CG1 3.36Å; C1140-I1144 PolarHBondContact O-N 3.44Å; A1141-I1144 WeakPolarHBondContact O-CB 3.5Å; A1141-I1144 PolarHBondContact O-N 3.37Å; A1141-I1144 VanDerWaalsContact O-N 3.15Å; L1142-I1144 VanDerWaalsContact C-N 3.34Å; I1144-F1146 PolarHBondContact O-N 3.17Å; I1144-L1147 PolarHBondContact O-N 2.86Å; I1144-I1148 HydrophobicContact CG2-CD1 3.81Å; I1144-I1148 VanDerWaalsContact O-CG1 3.29Å; I1144-I1148 WeakPolarHBondContact O-CG1 3.17Å; I1144-I1148 PolarHBondContact O-N 3.41Å
1145	V	72	Confident	61.1	Low	42 Å²	42	89.1 Å²	89.1	26%	0.255	54%	0.537	S	S	.	.	H	α-helix	trans	-63.5	-41.6	174.7	177	0	0	0	0	111.4	Q1024 A1141 L1142 L1147 I1148 T1149	Q1024-V1145 HydrophobicContact CB-CG2 3.76Å; A1141-V1145 PolarHBondContact O-N 3.24Å; L1142-V1145 PolarHBondContact O-N 3.38Å; V1145-L1147 VanDerWaalsContact C-N 3.34Å; V1145-L1147 PolarHBondContact O-N 3.22Å; V1145-I1148 PolarHBondContact O-N 3.47Å; V1145-T1149 PolarHBondContact O-N 3.35Å; V1145-T1149 PolarHBondContact O-OG1 3.49Å
1146	F	72.4	Confident	61.7	Low	141 Å²	141	88.8 Å²	88.8	62%	0.618	53%	0.527	S	S	*	.	H	α-helix	trans	-67.6	-33.1	178	-150.5	-99.3	0	0	0	112.6	L1142 V1143 I1144 T1149 I1150	L1142-F1146 WeakPolarHBondContact O-CB 3.3Å; L1142-F1146 PolarHBondContact O-N 3.23Å; V1143-F1146 PolarHBondContact O-N 3.4Å; I1144-F1146 PolarHBondContact O-N 3.17Å; F1146-T1149 PolarHBondContact O-OG1 3.24Å; F1146-T1149 VanDerWaalsContact O-OG1 3.07Å; F1146-I1150 HydrophobicContact CD1-CD1 3.65Å; F1146-I1150 HydrophobicContact CD1-CG1 4.42Å; F1146-I1150 HydrophobicContact CE1-CD1 3.78Å; F1146-I1150 WeakPolarHBondContact O-CB 3.41Å; F1146-I1150 VanDerWaalsContact O-CG1 3.23Å; F1146-I1150 WeakPolarHBondContact O-CG1 3.16Å; F1146-I1150 PolarHBondContact O-N 3.42Å
1147	L	74.5	Confident	61.7	Low	90 Å²	90	94.5 Å²	94.5	47%	0.471	53%	0.531	S	S	.	.	H	α-helix	trans	-71	-38.1	171.2	-74	171	0	0	0	111.9	V1143 I1144 V1145 I1150 I1151	V1143-L1147 HydrophobicContact CG1-CD1 3.94Å; V1143-L1147 HydrophobicContact CG1-CG 4.34Å; V1143-L1147 WeakPolarHBondContact O-CB 3.37Å; V1143-L1147 VanDerWaalsContact O-CG 3.3Å; V1143-L1147 WeakPolarHBondContact O-CG 3.15Å; V1143-L1147 PolarHBondContact O-N 3Å; I1144-L1147 PolarHBondContact O-N 2.86Å; V1145-L1147 VanDerWaalsContact C-N 3.34Å; V1145-L1147 PolarHBondContact O-N 3.22Å; L1147-I1150 PolarHBondContact O-N 3.29Å; L1147-I1151 WeakPolarHBondContact O-CB 3.29Å; L1147-I1151 WeakPolarHBondContact O-CD1 3.46Å; L1147-I1151 WeakPolarHBondContact O-CG1 3.33Å; L1147-I1151 PolarHBondContact O-N 2.92Å
1148	I	73.5	Confident	60.9	Low	89 Å²	89	92.7 Å²	92.7	46%	0.456	53%	0.528	S	S	.	.	H	α-helix	trans	-66	-41.2	176.4	-71.2	166.1	0	0	0	111.1	I1144 V1145 I1151 I1152	I1144-I1148 HydrophobicContact CG2-CD1 3.81Å; I1144-I1148 VanDerWaalsContact O-CG1 3.29Å; I1144-I1148 WeakPolarHBondContact O-CG1 3.17Å; I1144-I1148 PolarHBondContact O-N 3.41Å; V1145-I1148 PolarHBondContact O-N 3.47Å; I1148-I1151 PolarHBondContact O-N 3.01Å; I1148-I1152 HydrophobicContact CG2-CD1 3.97Å; I1148-I1152 WeakPolarHBondContact O-CG1 3.32Å; I1148-I1152 PolarHBondContact O-N 2.94Å
1149	T	69.1	Low	60.4	Low	62 Å²	62	101 Å²	101	38%	0.38	54%	0.541	S	S	.	.	H	α-helix	trans	-67.4	-39.9	174.4	55.1	0	0	0	0	112.1	V1145 F1146 I1151 I1152 I1153	V1145-T1149 PolarHBondContact O-N 3.35Å; V1145-T1149 PolarHBondContact O-OG1 3.49Å; F1146-T1149 PolarHBondContact O-OG1 3.24Å; F1146-T1149 VanDerWaalsContact O-OG1 3.07Å; T1149-I1151 VanDerWaalsContact C-N 3.35Å; T1149-I1151 PolarHBondContact O-N 3.35Å; T1149-I1152 PolarHBondContact O-N 3.29Å; T1149-I1153 WeakPolarHBondContact O-CB 3.34Å; T1149-I1153 WeakPolarHBondContact O-CD1 3.4Å; T1149-I1153 VanDerWaalsContact O-CG1 3.27Å; T1149-I1153 WeakPolarHBondContact O-CG1 3.46Å; T1149-I1153 PolarHBondContact O-N 2.9Å
1150	I	72.8	Confident	59.6	Low	64 Å²	64	105.1 Å²	105.1	33%	0.328	55%	0.551	S	S	.	*	H	α-helix	trans	-61.6	-41	171.9	-73.9	171.3	0	0	0	111.5	F1146 L1147 I1153 Y1154	F1146-I1150 HydrophobicContact CD1-CD1 3.65Å; F1146-I1150 HydrophobicContact CD1-CG1 4.42Å; F1146-I1150 HydrophobicContact CE1-CD1 3.78Å; F1146-I1150 WeakPolarHBondContact O-CB 3.41Å; F1146-I1150 VanDerWaalsContact O-CG1 3.23Å; F1146-I1150 WeakPolarHBondContact O-CG1 3.16Å; F1146-I1150 PolarHBondContact O-N 3.42Å; L1147-I1150 PolarHBondContact O-N 3.29Å; I1150-I1153 PolarHBondContact O-N 3.04Å; I1150-Y1154 HydrophobicContact CG2-CD2 3.92Å; I1150-Y1154 HydrophobicContact CG2-CE2 4.31Å; I1150-Y1154 WeakPolarHBondContact O-CB 3.02Å; I1150-Y1154 PolarHBondContact O-N 2.87Å
1151	I	71.4	Confident	58.4	Low	101 Å²	101	109.5 Å²	109.5	52%	0.518	56%	0.559	S	S	.	*	H	α-helix	trans	-66.5	-39.5	177.9	-74.1	163.9	0	0	0	111.2	L1147 I1148 T1149 Y1154 S1155	L1147-I1151 WeakPolarHBondContact O-CB 3.29Å; L1147-I1151 WeakPolarHBondContact O-CD1 3.46Å; L1147-I1151 WeakPolarHBondContact O-CG1 3.33Å; L1147-I1151 PolarHBondContact O-N 2.92Å; I1148-I1151 PolarHBondContact O-N 3.01Å; T1149-I1151 VanDerWaalsContact C-N 3.35Å; T1149-I1151 PolarHBondContact O-N 3.35Å; I1151-Y1154 PolarHBondContact O-N 3.06Å; I1151-S1155 VanDerWaalsContact O-CB 3.28Å; I1151-S1155 WeakPolarHBondContact O-CB 3.48Å; I1151-S1155 PolarHBondContact O-N 3.43Å; I1151-S1155 PolarHBondContact O-OG 2.82Å
1152	I	65.5	Low	57	Low	106 Å²	106	114.2 Å²	114.2	54%	0.544	58%	0.576	S	S	.	*	H	α-helix	trans	-65.6	-39.9	174.5	-69.7	166.7	0	0	0	110.7	I1148 T1149 S1155 C1156	I1148-I1152 HydrophobicContact CG2-CD1 3.97Å; I1148-I1152 WeakPolarHBondContact O-CG1 3.32Å; I1148-I1152 PolarHBondContact O-N 2.94Å; T1149-I1152 PolarHBondContact O-N 3.29Å; I1152-S1155 PolarHBondContact O-N 2.86Å; I1152-C1156 PolarHBondContact O-N 3.27Å
1153	I	65.1	Low	55.6	Low	101 Å²	101	114.5 Å²	114.5	52%	0.518	58%	0.578	S	S	.	*	H	α-helix	trans	-65.5	-43.7	175.1	-69.6	165.3	0	0	0	111.2	T1149 I1150 C1156 Y1157	T1149-I1153 WeakPolarHBondContact O-CB 3.34Å; T1149-I1153 WeakPolarHBondContact O-CD1 3.4Å; T1149-I1153 VanDerWaalsContact O-CG1 3.27Å; T1149-I1153 WeakPolarHBondContact O-CG1 3.46Å; T1149-I1153 PolarHBondContact O-N 2.9Å; I1150-I1153 PolarHBondContact O-N 3.04Å; I1153-C1156 PolarHBondContact O-N 2.91Å; I1153-Y1157 HydrophobicContact CG2-CD2 4.41Å; I1153-Y1157 PolarHBondContact O-N 3.2Å
1154	Y	62.5	Low	53.6	Low	178 Å²	178	112.3 Å²	112.3	70%	0.698	57%	0.566	S	S	*	*	H	α-helix	trans	-67.6	-32.3	175.4	-99.4	-89.8	0	0	0	113.3	I1150 I1151 C1156 Y1157	I1150-Y1154 HydrophobicContact CG2-CD2 3.92Å; I1150-Y1154 HydrophobicContact CG2-CE2 4.31Å; I1150-Y1154 WeakPolarHBondContact O-CB 3.02Å; I1150-Y1154 PolarHBondContact O-N 2.87Å; I1151-Y1154 PolarHBondContact O-N 3.06Å; Y1154-C1156 PolarHBondContact O-N 2.93Å; Y1154-Y1157 PolarHBondContact O-N 3.27Å
1155	S	53.1	Low	51.5	Low	88 Å²	88	113.1 Å²	113.1	62%	0.615	57%	0.571	S	S	*	*	H	α-helix	trans	-67.7	-22.3	177.5	-60.9	0	0	0	0	112.9	I1151 I1152	I1151-S1155 VanDerWaalsContact O-CB 3.28Å; I1151-S1155 WeakPolarHBondContact O-CB 3.48Å; I1151-S1155 PolarHBondContact O-N 3.43Å; I1151-S1155 PolarHBondContact O-OG 2.82Å; I1152-S1155 PolarHBondContact O-N 2.86Å
1156	C	48.6	Very low	49.3	Very low	108 Å²	108	119.3 Å²	119.3	73%	0.73	59%	0.594	S	S	*	*	H	α-helix	trans	-93.6	-21.1	173.1	-68.5	0	0	0	0	113.5	I1152 I1153 Y1154 G1158	I1152-C1156 PolarHBondContact O-N 3.27Å; I1153-C1156 PolarHBondContact O-N 2.91Å; Y1154-C1156 PolarHBondContact O-N 2.93Å; C1156-G1158 PolarHBondContact O-N 2.96Å
1157	Y	40.6	Very low	47.1	Very low	206 Å²	206	121 Å²	121	81%	0.808	60%	0.602	S	S	*	*	S	Bend	trans	-81.8	46.4	176	-99.6	-91.7	0	0	0	112.8	I1153 Y1154	I1153-Y1157 HydrophobicContact CG2-CD2 4.41Å; I1153-Y1157 PolarHBondContact O-N 3.2Å; Y1154-Y1157 PolarHBondContact O-N 3.27Å
1158	G	32.1	Very low	44.8	Very low	62 Å²	62	127.2 Å²	127.2	64%	0.639	62%	0.619	S	S	*	*			trans	-129.5	6.8	-157	0	0	0	0	0	119	C1156	C1156-G1158 PolarHBondContact O-N 2.96Å
1159	R	34.5	Very low	42.5	Very low	235 Å²	235	127.6 Å²	127.6	89%	0.887	62%	0.622	S	S	*	*	S	Bend	trans	-147.9	110.4	178.1	-132.1	167.4	-178.4	141.5	-1.2	116.5
1160	N	31.3	Very low	40.5	Very low	138 Å²	138	131.3 Å²	131.3	74%	0.738	64%	0.639	S	S	*	*			trans	27.9	99.1	153	-63.3	-20.5	0	0	0	118.6
1161	K	28.8	Very low	38.3	Very low	188 Å²	188	137 Å²	137	82%	0.817	66%	0.661	S	S	*	*				84.5	94.1	83.3	-87.2	-174.8	172.3	174.7	0	116.5
1162	H	29.4	Very low	36.2	Very low	127 Å²	127	140.9 Å²	140.9	59%	0.588	67%	0.674	S	S	*	*				69	102.4	109.8	168.2	69.4	0	0	0	120.8	W1363 K1364	H1162-W1363 HydrophobicContact CB-CH2 4.4Å; H1162-W1363 HydrophobicContact CB-CZ3 4.31Å; H1162-W1363 AromaticContact CE1-CZ3 3.38Å; H1162-W1363 WeakPolarHBondContact CE1-CZ3 3.07Å; H1162-W1363 AromaticContact CG-CZ3 3.64Å; H1162-W1363 AromaticContact ND1-CH2 3.49Å; H1162-W1363 WeakPolarHBondContact ND1-CH2 3.49Å; H1162-W1363 AromaticContact ND1-CZ3 3.16Å; H1162-W1363 WeakPolarHBondContact ND1-CZ3 3.29Å; H1162-W1363 AromaticContact NE2-CZ3 3.93Å; H1162-W1363 WeakPolarHBondContact O-CZ3 3.37Å; H1162-K1364 PolarHBondContact CD2-NZ 2.91Å; H1162-K1364 PolarHBondContact NE2-NZ 3.3Å; H1162-K1364 PolarHBondContact O-NZ 2.87Å
1163	D	27.2	Very low	34.5	Very low	95 Å²	95	139.9 Å²	139.9	51%	0.508	68%	0.676	S	S	.	*			trans	59.7	126.2	137.6	-100.3	-63.7	0	0	0	129.7	W1363 K1364	D1163-W1363 VanDerWaalsContact CA-CG 3.41Å; D1163-W1363 HydrophobicContact CB-CD2 3.93Å; D1163-W1363 HydrophobicContact CB-CE3 3.47Å; D1163-W1363 VanDerWaalsContact CB-CE3 3.47Å; D1163-W1363 HydrophobicContact CB-CH2 2.58Å; D1163-W1363 HydrophobicContact CB-CZ2 3.14Å; D1163-W1363 HydrophobicContact CB-CZ3 2.77Å; D1163-W1363 WeakPolarHBondContact OD2-CH2 3.47Å; D1163-W1363 WeakPolarHBondContact OD2-CZ2 3.39Å; D1163-K1364 WeakPolarHBondContact O-CA 3.5Å
1164	S	29.4	Very low	32.7	Very low	38 Å²	38	142.2 Å²	142.2	27%	0.266	69%	0.689	S	S	.	*			trans	70.4	92	147.2	69.8	0	0	0	0	123	K1364 K1365	S1164-K1364 CarbonylContact O-C 3.54Å; S1164-K1364 WeakPolarHBondContact O-CA 3.42Å; S1164-K1364 PolarHBondContact O-N 3.34Å; S1164-K1365 PolarHBondContact O-N 2.83Å; S1164-K1365 PolarHBondContact OG-N 2.78Å
1165	L	28.3	Very low	30.9	Very low	117 Å²	117	142.1 Å²	142.1	61%	0.613	69%	0.692	S	S	*	*			trans	50	136.6	138.2	-74.7	78.2	0	0	0	125.6	W1363	L1165-W1363 VanDerWaalsContact N-C 3.3Å
1166	K	26	Very low	29.4	Very low	171 Å²	171	142.4 Å²	142.4	74%	0.743	69%	0.694	S	S	*	*			trans	76.2	112	131	-71.3	-173.1	177.2	-177.9	0	125.4
1167	F	25.5	Very low	28.3	Very low	177 Å²	177	142.7 Å²	142.7	78%	0.776	70%	0.697	S	S	*	*				45.4	122.8	124.9	-81.3	-92.3	0	0	0	123.3
1168	W	25.2	Very low	27.6	Very low	220 Å²	220	139 Å²	139	83%	0.833	70%	0.697	S	S	*	*				-164.4	145.7	98.4	-123.3	69.3	0	0	0	115.3
1169	N	25.1	Very low	27.3	Very low	97 Å²	97	140 Å²	140	52%	0.519	69%	0.694	S	S	.	*			trans	-22.1	164.9	170.4	-55.3	-32.6	0	0	0	121.9
1170	I	28.2	Very low	26.8	Very low	141 Å²	141	136.3 Å²	136.3	72%	0.723	69%	0.687	S	S	*	*				-176.4	140.9	114.5	-98.4	161.8	0	0	0	114.9
1171	K	26.8	Very low	26.5	Very low	183 Å²	183	137.8 Å²	137.8	80%	0.796	69%	0.689	S	S	*	*			trans	66.3	158.8	164.6	-82.7	165.6	-176	175.9	0	117.9
1172	K	27.2	Very low	26.5	Very low	182 Å²	182	133.7 Å²	133.7	79%	0.791	68%	0.684	S	S	*	*			cis	177.4	163.1	-27.2	-109.6	-167.2	-170	-173.4	0	105.2
1173	S	29.3	Very low	26.7	Very low	85 Å²	85	132 Å²	132	59%	0.594	69%	0.686	S	S	*	*			cis	-179.5	160.4	4.1	42.3	0	0	0	0	112.4
1174	L	28.4	Very low	26.9	Very low	151 Å²	151	136.3 Å²	136.3	79%	0.791	70%	0.701	S	S	*	*			trans	65.9	151.8	144.9	-93.7	71.3	0	0	0	118.6
1175	K	22.9	Very low	26.8	Very low	175 Å²	175	140.4 Å²	140.4	76%	0.761	72%	0.72	S	S	*	*			cis	-164.4	145.6	-19.2	-142.9	-175.5	-174.5	-173.1	0	111.8
1176	S	22.7	Very low	26.8	Very low	94 Å²	94	141.8 Å²	141.8	66%	0.657	73%	0.727	S	S	*	*			trans	39.8	117.4	146	59.4	0	0	0	0	122.4
1177	S	25.4	Very low	26.7	Very low	114 Å²	114	140.2 Å²	140.2	80%	0.797	73%	0.727	S	S	*	*			trans	-162.5	138.2	141.5	-78.7	0	0	0	0	111.5
1178	T	26.5	Very low	27.6	Very low	129 Å²	129	139.2 Å²	139.2	79%	0.791	73%	0.734	S	S	*	*				24.8	134.4	118.3	-41.9	0	0	0	0	117.9
1179	S	24.4	Very low	27.9	Very low	83 Å²	83	133 Å²	133	58%	0.58	72%	0.722	S	S	*	*			cis	-179	167.9	-10.9	53.2	0	0	0	0	110.1
1180	Q	25	Very low	28	Very low	157 Å²	157	134.2 Å²	134.2	73%	0.734	73%	0.729	S	S	*	*			trans	57.3	116.9	148.9	-71.7	174.2	-72.4	0	0	122.5
1181	Q	24.8	Very low	28.1	Very low	170 Å²	170	134.3 Å²	134.3	79%	0.794	73%	0.726	S	S	*	*				61.3	92.8	126	-61.4	171.5	-75.7	0	0	120.7
1182	S	28.3	Very low	28.2	Very low	102 Å²	102	132.3 Å²	132.3	71%	0.713	72%	0.723	S	S	*	*			trans	-150.3	144.1	144.4	-157.7	0	0	0	0	107.9
1183	S	33.4	Very low	28.1	Very low	90 Å²	90	126.8 Å²	126.8	63%	0.629	72%	0.717	S	S	*	*			cis	73	151.3	26.4	111.9	0	0	0	0	113.4
1184	K	31.4	Very low	28	Very low	186 Å²	186	127.6 Å²	127.6	81%	0.809	72%	0.722	S	S	*	*			cis	-168	154.8	-12.5	-121.9	175.3	177	-174.2	0	107.5
1185	N	28.5	Very low	27.8	Very low	125 Å²	125	127.8 Å²	127.8	67%	0.668	72%	0.719	S	S	*	*			cis	-167.3	132.3	-44.1	-106.7	106.7	0	0	0	105.9
1186	L	27.7	Very low	28	Very low	145 Å²	145	125.6 Å²	125.6	76%	0.759	72%	0.715	S	S	*	*			trans	-156.1	143.1	163.5	-137.3	69.4	0	0	0	110.9
1187	D	24.3	Very low	28	Very low	139 Å²	139	123.9 Å²	123.9	74%	0.743	71%	0.712	S	S	*	*	S	Bend	trans	37.8	113.3	167.3	-54.1	-21	0	0	0	120.9	P1189	D1187-P1189 VanDerWaalsContact C-CD 3.49Å
1188	V	43.3	Very low	28	Very low	155 Å²	155	126.7 Å²	126.7	94%	0.939	71%	0.71	S	S	*	*	S	Bend	trans	32.8	73.7	173.1	-163.4	0	0	0	0	117.3
1189	P	32.9	Very low	27.9	Very low	89 Å²	89	128.3 Å²	128.3	58%	0.578	71%	0.709	S	S	*	*			trans	-132	176.5	170	40.1	-23.7	0	0	0	114.7	D1187	D1187-P1189 VanDerWaalsContact C-CD 3.49Å
1190	N	27.5	Very low	27.9	Very low	123 Å²	123	130.9 Å²	130.9	66%	0.658	72%	0.716	S	S	*	*			cis	-170.5	162.6	-45.5	-160.4	-2.3	0	0	0	107.5
1191	H	29.5	Very low	28	Very low	143 Å²	143	130.9 Å²	130.9	66%	0.662	72%	0.715	S	S	*	*			trans	63	129.3	174.9	-65.9	-82.1	0	0	0	116.8
1192	I	28	Very low	28	Very low	141 Å²	141	126.8 Å²	126.8	72%	0.723	71%	0.706	S	S	*	*			cis	80.5	124.6	37.4	-58.8	161	0	0	0	113.3
1193	G	26.2	Very low	27.9	Very low	66 Å²	66	129.2 Å²	129.2	68%	0.68	71%	0.71	S	S	*	*			trans	109.8	172.3	146.3	0	0	0	0	0	115.9
1194	C	26.6	Very low	27.5	Very low	103 Å²	103	132.8 Å²	132.8	70%	0.696	72%	0.722	S	S	*	*			cis	-172.4	155.3	-13.2	-97.8	0	0	0	0	104.5
1195	E	25	Very low	27.3	Very low	155 Å²	155	128 Å²	128	72%	0.724	73%	0.725	S	S	*	*			cis	-153.4	156.1	7.1	-122.6	161.7	140.5	0	0	109.9
1196	L	26.2	Very low	27.1	Very low	128 Å²	128	127.1 Å²	127.1	67%	0.67	73%	0.729	S	S	*	*			trans	24.1	149.7	134.2	-57.8	172.1	0	0	0	121.2	F1198	L1196-F1198 HydrophobicContact CB-CE2 4.18Å; L1196-F1198 HydrophobicContact CD1-CE2 4.08Å; L1196-F1198 HydrophobicContact CD1-CZ 4.18Å
1197	G	24	Very low	27.1	Very low	59 Å²	59	127 Å²	127	61%	0.608	73%	0.733	S	S	*	*			cis	143.7	-170.3	2.4	0	0	0	0	0	112.3
1198	F	25	Very low	27.1	Very low	172 Å²	172	130.5 Å²	130.5	75%	0.754	74%	0.736	S	S	*	*			trans	70.2	138.4	179.4	-48.7	-75.4	0	0	0	114.3	L1196	L1196-F1198 HydrophobicContact CB-CE2 4.18Å; L1196-F1198 HydrophobicContact CD1-CE2 4.08Å; L1196-F1198 HydrophobicContact CD1-CZ 4.18Å
1199	E	24.5	Very low	26.1	Very low	164 Å²	164	133.2 Å²	133.2	77%	0.766	73%	0.73	S	S	*	*			cis	-152.1	160.3	5	-129.7	176.4	167.2	0	0	111.8
1200	L	24.5	Very low	25.8	Very low	137 Å²	137	139.2 Å²	139.2	72%	0.717	74%	0.742	S	S	*	*			trans	24	132.9	166.6	-87	66.3	0	0	0	119.4
1201	H	26.6	Very low	25.9	Very low	156 Å²	156	141.6 Å²	141.6	72%	0.722	75%	0.75	S	S	*	*				-166.7	145.7	55.7	-142.2	-78.7	0	0	0	113.6
1202	S	24.3	Very low	25.8	Very low	85 Å²	85	139.8 Å²	139.8	59%	0.594	75%	0.75	S	S	*	*			trans	48.9	124.7	156.2	41.7	0	0	0	0	122.8
1203	D	27.7	Very low	25.7	Very low	152 Å²	152	141.2 Å²	141.2	81%	0.813	75%	0.754	S	S	*	*			trans	79.8	87.7	136.4	-52.7	-20.8	0	0	0	123	G1205	D1203-G1205 PolarHBondContact O-N 3.29Å
1204	L	25	Very low	25.8	Very low	166 Å²	166	143.6 Å²	143.6	87%	0.869	76%	0.755	S	S	*	*				72.5	37.9	114.4	-143.2	73.4	0	0	0	120.6	S1206	L1204-S1206 PolarHBondContact O-N 3.17Å; L1204-S1206 VanDerWaalsContact O-N 3.1Å
1205	G	25.6	Very low	26.2	Very low	86 Å²	86	144 Å²	144	89%	0.887	76%	0.757	S	S	*	*			trans	-78.8	66.8	164.6	0	0	0	0	0	114.8	D1203	D1203-G1205 PolarHBondContact O-N 3.29Å
1206	S	25.4	Very low	26.5	Very low	105 Å²	105	145.4 Å²	145.4	73%	0.734	76%	0.757	S	S	*	*			trans	-103.3	110.1	178.2	-171.2	0	0	0	0	113.2	L1204	L1204-S1206 PolarHBondContact O-N 3.17Å; L1204-S1206 VanDerWaalsContact O-N 3.1Å
1207	V	26.5	Very low	26.6	Very low	142 Å²	142	146 Å²	146	86%	0.861	75%	0.754	S	S	*	*			trans	-127.2	94.1	168.8	-178.4	0	0	0	0	110.3
1208	R	25.3	Very low	26.8	Very low	213 Å²	213	152.3 Å²	152.3	80%	0.804	77%	0.768	S	S	*	*			trans	-150.8	108.4	161.7	-85.2	-163.6	177	-170	1.5	111.5
1209	R	22.4	Very low	27.3	Very low	212 Å²	212	149.1 Å²	149.1	80%	0.8	76%	0.764	S	S	*	*			trans	65.5	137.7	164.1	-50.9	178.1	-172.8	175.5	1	113.1
1210	Y	26.1	Very low	27.6	Very low	216 Å²	216	146.8 Å²	146.8	85%	0.847	76%	0.763	S	S	*	*				-145.5	153.2	50.4	-102.5	-97.1	0	0	0	113.5
1211	Q	29	Very low	28.5	Very low	173 Å²	173	146.3 Å²	146.3	81%	0.808	77%	0.768	S	S	*	*			trans	-74.8	150.4	150	-75.3	170.9	-92	0	0	108.4
1212	P	28.8	Very low	28.7	Very low	104 Å²	104	145 Å²	145	68%	0.675	78%	0.777	S	S	*	*				-140.1	146.2	86.3	41.3	-25.8	0	0	0	112.7
1213	E	24.6	Very low	28.9	Very low	172 Å²	172	143.8 Å²	143.8	80%	0.804	78%	0.778	S	S	*	*				71.7	149.3	101	-62.4	-178.3	-176.5	0	0	114.7
1214	T	28	Very low	28.9	Very low	115 Å²	115	141.6 Å²	141.6	71%	0.706	77%	0.774	S	S	*	*			cis	-157.9	-169.4	-5.1	20.2	0	0	0	0	106.2
1215	P	34.9	Very low	29	Very low	112 Å²	112	142.7 Å²	142.7	73%	0.727	77%	0.772	S	S	*	*			cis	-126	-174.2	-8.1	23.9	1.7	0	0	0	112.2
1216	Y	31.8	Very low	29.2	Very low	185 Å²	185	145.6 Å²	145.6	73%	0.725	77%	0.766	S	S	*	*			cis	-128.2	-112.9	-13.5	-159	-105.5	0	0	0	111.3
1217	K	29.8	Very low	29.4	Very low	140 Å²	140	145.7 Å²	145.7	61%	0.609	77%	0.766	S	S	*	*			trans	-159.8	150.1	-167.5	-48.7	171.1	-166.2	158.9	0	110.9
1218	Q	26.8	Very low	29.4	Very low	192 Å²	192	146.8 Å²	146.8	90%	0.897	77%	0.767	S	S	*	*	S	Bend		-105.3	156.1	127.5	-95.2	-161	-12.1	0	0	107.9
1219	P	35.5	Very low	29.6	Very low	104 Å²	104	140.1 Å²	140.1	68%	0.675	77%	0.765	S	S	*	*			trans	-116	-167.5	-134.7	48.3	-38.9	0	0	0	112.6
1220	P	31.5	Very low	30	Very low	115 Å²	115	140.3 Å²	140.3	75%	0.747	77%	0.767	S	S	*	*				-130.6	175.2	-111.5	26.3	-0.4	0	0	0	116.1
1221	P	43.8	Very low	30.2	Very low	128 Å²	128	135.9 Å²	135.9	83%	0.831	76%	0.758	S	S	*	*			trans	-111.7	165.2	177	40.6	-33.3	0	0	0	115.3
1222	S	29.6	Very low	30.3	Very low	129 Å²	129	134.2 Å²	134.2	90%	0.902	76%	0.755	S	S	*	*			trans	-164	154.5	159.4	56.8	0	0	0	0	109
1223	G	29.4	Very low	30.5	Very low	59 Å²	59	134.1 Å²	134.1	61%	0.608	76%	0.757	S	S	*	*			cis	-171.3	157	-13	0	0	0	0	0	111.6
1224	S	28.4	Very low	30.7	Very low	106 Å²	106	133.3 Å²	133.3	74%	0.741	76%	0.757	S	S	*	*				42.6	147.6	125	60.9	0	0	0	0	122.1
1225	F	26	Very low	30.7	Very low	188 Å²	188	135.1 Å²	135.1	83%	0.825	76%	0.762	S	S	*	*			cis	-171.2	168.8	19	-121.9	-40.6	0	0	0	112.6
1226	I	28.9	Very low	30.3	Very low	148 Å²	148	133 Å²	133	76%	0.759	76%	0.762	S	S	*	*			trans	72.4	115.4	149.3	-65.1	157.3	0	0	0	121.1
1227	S	29.6	Very low	30.2	Very low	106 Å²	106	131.2 Å²	131.2	74%	0.741	76%	0.763	S	S	*	*				165.9	99.5	109.4	-164.7	0	0	0	0	116.7
1228	N	27.8	Very low	30	Very low	165 Å²	165	132 Å²	132	88%	0.882	77%	0.768	S	S	*	*			trans	16.4	142.9	148.5	-56.3	-7.3	0	0	0	124.9
1229	G	28.7	Very low	30	Very low	73 Å²	73	129 Å²	129	75%	0.753	75%	0.754	S	S	*	*			trans	-172.6	68.3	166.9	0	0	0	0	0	117.8
1230	Y	31.7	Very low	29.4	Very low	216 Å²	216	134.2 Å²	134.2	85%	0.847	77%	0.766	S	S	*	*			trans	48.3	114.8	158.2	-73.8	-82.7	0	0	0	124.5
1231	D	29.1	Very low	29.2	Very low	123 Å²	123	135.2 Å²	135.2	66%	0.658	77%	0.765	S	S	*	*			trans	55.4	102.8	132.3	-72.5	-34.9	0	0	0	125.8
1232	N	31	Very low	28.4	Very low	139 Å²	139	134 Å²	134	74%	0.743	76%	0.761	S	S	*	*				66.6	110.8	110.8	-74.4	-47.1	0	0	0	125
1233	S	33.6	Very low	28.5	Very low	102 Å²	102	135.9 Å²	135.9	71%	0.713	76%	0.759	S	S	*	*			trans	80.6	102.5	130.5	69.8	0	0	0	0	123.6
1234	L	28.2	Very low	28.4	Very low	155 Å²	155	140.9 Å²	140.9	81%	0.812	77%	0.767	S	S	*	*			trans	58.4	139.9	132.6	-89	79.1	0	0	0	123.9
1235	N	28.5	Very low	28.2	Very low	152 Å²	152	142.7 Å²	142.7	81%	0.813	77%	0.768	S	S	*	*			trans	70.9	107.7	152.7	-65.1	-7.9	0	0	0	120.1
1236	G	26.6	Very low	28.3	Very low	69 Å²	69	139.9 Å²	139.9	71%	0.711	77%	0.772	S	S	*	*				144.5	93.8	110.4	0	0	0	0	0	119.3
1237	I	29	Very low	28.1	Very low	147 Å²	147	137.2 Å²	137.2	75%	0.754	77%	0.772	S	S	*	*			trans	70.2	100.9	145	-54.9	178.8	0	0	0	118.2
1238	H	26.6	Very low	28.1	Very low	155 Å²	155	139.3 Å²	139.3	72%	0.718	77%	0.773	S	S	*	*				21.5	135.7	128.8	-45.6	-80.7	0	0	0	120.2
1239	H	26.3	Very low	28	Very low	131 Å²	131	139 Å²	139	61%	0.606	77%	0.772	S	S	*	*				-176.6	146	80.4	-99	-71.1	0	0	0	113.6
1240	F	24.4	Very low	27.9	Very low	212 Å²	212	139.5 Å²	139.5	93%	0.93	78%	0.776	S	S	*	*			trans	-130.6	92	135.2	-108.2	-79.1	0	0	0	108.1
1241	N	25.4	Very low	27.6	Very low	136 Å²	136	132.3 Å²	132.3	73%	0.727	77%	0.768	S	S	*	*			trans	-110.6	140.4	159.7	-89.5	-0.5	0	0	0	107.2
1242	S	27.9	Very low	27.5	Very low	104 Å²	104	134.1 Å²	134.1	73%	0.727	78%	0.777	S	S	*	*			trans	-137.8	137.7	166.9	107.8	0	0	0	0	107.6
1243	L	31	Very low	27.3	Very low	168 Å²	168	134.7 Å²	134.7	88%	0.88	78%	0.78	S	S	*	*			cis	-145.5	175.2	4	-124.2	157	0	0	0	110.7
1244	Q	26.9	Very low	27	Very low	163 Å²	163	133.2 Å²	133.2	76%	0.762	78%	0.781	S	S	*	*			trans	-125.8	151.4	-160.8	-171.8	173.8	4.9	0	0	112.4
1245	N	25.1	Very low	26.9	Very low	145 Å²	145	132.6 Å²	132.6	78%	0.775	77%	0.774	S	S	*	*			trans	-4.3	123.2	170.8	-58.1	-4.3	0	0	0	119.2
1246	S	28.3	Very low	26.8	Very low	129 Å²	129	129.1 Å²	129.1	90%	0.902	76%	0.762	S	S	*	*				-166.5	165.1	114.3	40.4	0	0	0	0	109.9
1247	A	25.2	Very low	26.9	Very low	91 Å²	91	129.6 Å²	129.6	75%	0.752	75%	0.747	S	S	*	*			trans	-146.3	157.9	-170.2	0	0	0	0	0	112.2
1248	I	29.4	Very low	26.7	Very low	150 Å²	150	128.1 Å²	128.1	77%	0.769	74%	0.741	S	S	*	*			trans	159.6	123.4	140.8	-84.8	157.7	0	0	0	110.3
1249	N	26.1	Very low	26.7	Very low	160 Å²	160	127.9 Å²	127.9	86%	0.856	75%	0.745	S	S	*	*			trans	44.2	142.2	155.7	-53.6	-6.6	0	0	0	121.4
1250	G	25	Very low	26.5	Very low	82 Å²	82	129.4 Å²	129.4	85%	0.845	75%	0.752	S	S	*	*			cis	163.8	162.8	-3.2	0	0	0	0	0	112.8
1251	G	26.1	Very low	26.6	Very low	66 Å²	66	124.7 Å²	124.7	68%	0.68	74%	0.744	S	S	*	*			trans	134	103.1	-179.1	0	0	0	0	0	111.8
1252	L	26.6	Very low	26.5	Very low	161 Å²	161	122.9 Å²	122.9	84%	0.843	75%	0.748	S	S	*	*				68.5	119.9	95.5	-64	166	0	0	0	112.4
1253	D	27.8	Very low	26.3	Very low	150 Å²	150	122.6 Å²	122.6	80%	0.802	75%	0.752	S	S	*	*			cis	-145.7	150.6	12.7	-83	-56.1	0	0	0	114.3
1254	G	26.6	Very low	26	Very low	72 Å²	72	123.1 Å²	123.1	74%	0.742	76%	0.755	S	S	*	*			trans	88.7	167.9	165.8	0	0	0	0	0	117.9
1255	H	26.2	Very low	25.9	Very low	141 Å²	141	122.5 Å²	122.5	65%	0.653	76%	0.756	S	S	*	*			cis	-160.1	-180	-20.8	-153.8	-102.1	0	0	0	112.4	Q1788	H1255-Q1788 PolarHBondContact CE1-OE1 3.14Å; H1255-Q1788 PolarHBondContact NE2-OE1 2.67Å
1256	S	26	Very low	25.8	Very low	80 Å²	80	124.1 Å²	124.1	56%	0.559	76%	0.758	S	S	*	*			trans	-120.3	-174.1	176.6	-128.4	0	0	0	0	111.6
1257	I	28	Very low	25.6	Very low	78 Å²	78	123.3 Å²	123.3	40%	0.4	75%	0.752	S	S	.	*			cis	-151.7	175.9	22.7	-144	160	0	0	0	114.9	I1787 Q1788	I1257-I1787 HydrophobicContact CD1-CG2 3.8Å; I1257-I1787 WeakPolarHBondContact CD1-O 3.1Å; I1257-I1787 WeakPolarHBondContact CG2-O 3.05Å; I1257-Q1788 WeakPolarHBondContact CG2-O 3.21Å
1258	D	26	Very low	25.5	Very low	117 Å²	117	130.1 Å²	130.1	63%	0.626	76%	0.759	S	S	*	*			trans	-36.3	162.2	171.6	-32	-32.9	0	0	0	117.5
1259	N	25.6	Very low	25.4	Very low	150 Å²	150	130.4 Å²	130.4	80%	0.802	76%	0.762	S	S	*	*				-171.7	-177.6	57.7	-138	-44.2	0	0	0	115.7
1260	E	23.8	Very low	25.2	Very low	163 Å²	163	128.8 Å²	128.8	76%	0.762	76%	0.763	S	S	*	*			trans	-90.5	159.5	-169.7	-65.2	-168.5	92.1	0	0	118.2
1261	C	24.5	Very low	25.3	Very low	112 Å²	112	131.1 Å²	131.1	76%	0.757	76%	0.761	S	S	*	*			trans	64.3	129.8	138.3	-79.7	0	0	0	0	124.9
1262	A	24.2	Very low	25.1	Very low	99 Å²	99	132.8 Å²	132.8	82%	0.818	77%	0.768	S	S	*	*			trans	74.8	105.8	133.3	0	0	0	0	0	121.8
1263	A	23	Very low	25	Very low	97 Å²	97	130.5 Å²	130.5	80%	0.802	77%	0.765	S	S	*	*				-163.3	105.5	119.1	0	0	0	0	0	112.4
1264	L	24.7	Very low	24.9	Very low	180 Å²	180	128.7 Å²	128.7	94%	0.942	77%	0.765	S	S	*	*			trans	178	72	141.9	-99.7	170.9	0	0	0	112.5
1265	L	24.8	Very low	24.9	Very low	150 Å²	150	134.1 Å²	134.1	79%	0.785	77%	0.771	S	S	*	*			trans	-121.6	144	152.6	-71.6	168.6	0	0	0	106.3
1266	H	24.8	Very low	24.9	Very low	179 Å²	179	132.4 Å²	132.4	83%	0.829	77%	0.774	S	S	*	*			cis	-134.6	145	20.2	-53.2	-105.2	0	0	0	112.3
1267	S	22.9	Very low	25	Very low	111 Å²	111	132 Å²	132	78%	0.776	78%	0.776	S	S	*	*	S	Bend		178.1	86.4	123.2	-173.3	0	0	0	0	111.9
1268	R	24.4	Very low	25	Very low	235 Å²	235	134.9 Å²	134.9	89%	0.887	79%	0.788	S	S	*	*			trans	170.2	154.2	146.3	-97.5	160.7	178.2	172.2	-0.8	111.3
1269	N	26.6	Very low	25.2	Very low	156 Å²	156	135.9 Å²	135.9	83%	0.834	79%	0.79	S	S	*	*			trans	99.5	69.1	170.7	-59	-4.5	0	0	0	117.3
1270	S	22.1	Very low	25.7	Very low	125 Å²	125	134.7 Å²	134.7	87%	0.874	78%	0.784	S	S	*	*			trans	-96.4	42.8	159.3	61.9	0	0	0	0	112.1
1271	V	25.6	Very low	26.2	Very low	132 Å²	132	133.8 Å²	133.8	80%	0.8	78%	0.781	S	S	*	*			trans	-145.9	76	178.2	-170.6	0	0	0	0	110.6
1272	A	23.8	Very low	26.8	Very low	100 Å²	100	131.7 Å²	131.7	83%	0.826	76%	0.762	S	S	*	*			trans	-177.7	73.8	162.2	0	0	0	0	0	111.9
1273	S	24	Very low	27.5	Very low	114 Å²	114	130.9 Å²	130.9	80%	0.797	74%	0.744	S	S	*	*			trans	-148	58.1	174.4	68.5	0	0	0	0	112.9
1274	S	25.5	Very low	28.1	Very low	112 Å²	112	129.6 Å²	129.6	78%	0.783	73%	0.729	S	S	*	*			trans	-130.5	35.6	-175.9	62.5	0	0	0	0	113.7
1275	Q	25.5	Very low	28.8	Very low	186 Å²	186	128.9 Å²	128.9	87%	0.869	71%	0.713	S	S	*	*	S	Bend	trans	-137.8	1.4	177.3	-109	172.6	6.5	0	0	116.2
1276	S	26.9	Very low	29.7	Very low	104 Å²	104	126.2 Å²	126.2	73%	0.727	70%	0.699	S	S	*	*	S	Bend	trans	-105.3	-13.3	172.7	53.3	0	0	0	0	114.4
1277	A	27.9	Very low	30.6	Very low	73 Å²	73	124.5 Å²	124.5	60%	0.603	69%	0.69	S	S	*	*	S	Bend	trans	-77.6	-18.3	178.2	0	0	0	0	0	114	M1279 M1281	A1277-M1279 PolarHBondContact O-N 2.65Å; A1277-M1281 PolarHBondContact O-N 3.25Å
1278	H	29.2	Very low	31.6	Very low	138 Å²	138	122 Å²	122	64%	0.639	68%	0.676	S	S	*	*	H	α-helix	trans	-72	-27.4	-166.3	-154.9	-84.1	0	0	0	114.2	I1282	H1278-I1282 WeakPolarHBondContact O-CG1 3.48Å
1279	M	30	Very low	32.6	Very low	137 Å²	137	115.8 Å²	115.8	68%	0.675	66%	0.656	S	S	*	*	H	α-helix	trans	-80.7	-35	-180	-77.3	-61.5	-161.4	0	0	113.8	A1277 I1282 N1283	A1277-M1279 PolarHBondContact O-N 2.65Å; M1279-I1282 PolarHBondContact O-N 3.2Å; M1279-N1283 PolarHBondContact O-N 2.89Å
1280	N	36	Very low	33.8	Very low	125 Å²	125	110.8 Å²	110.8	67%	0.668	64%	0.637	S	S	*	*	H	α-helix	trans	-75.9	-25.7	179.3	-74.3	-15.3	0	0	0	112.8	S1284	N1280-S1284 WeakPolarHBondContact O-CB 3.26Å; N1280-S1284 PolarHBondContact O-N 2.78Å; N1280-S1284 PolarHBondContact O-OG 2.87Å
1281	M	32.9	Very low	35.4	Very low	145 Å²	145	114 Å²	114	71%	0.714	63%	0.631	S	S	*	*	H	α-helix	trans	-77.5	-29.9	174.2	-158.4	171.6	-170.6	0	0	112.8	A1277 S1284 R1285	A1277-M1281 PolarHBondContact O-N 3.25Å; M1281-S1284 WeakPolarHBondContact CA-OG 3.49Å; M1281-S1284 PolarHBondContact O-OG 2.03Å; M1281-R1285 VanDerWaalsContact O-CB 3.27Å; M1281-R1285 WeakPolarHBondContact O-CB 3.46Å; M1281-R1285 PolarHBondContact O-N 3.08Å; M1281-R1285 VanDerWaalsContact O-N 3.15Å
1282	I	38.5	Very low	36.4	Very low	68 Å²	68	109.5 Å²	109.5	35%	0.349	61%	0.608	S	S	.	*	H	α-helix	trans	-69.8	-50.5	173.5	-73.3	173.4	0	0	0	110.6	H1278 M1279 S1284 R1285 I1286	H1278-I1282 WeakPolarHBondContact O-CG1 3.48Å; M1279-I1282 PolarHBondContact O-N 3.2Å; I1282-S1284 PolarHBondContact O-N 3.47Å; I1282-R1285 PolarHBondContact O-N 2.94Å; I1282-R1285 VanDerWaalsContact O-N 3.17Å; I1282-I1286 HydrophobicContact CG2-CD1 3.61Å; I1282-I1286 HydrophobicContact CG2-CG1 4.32Å; I1282-I1286 WeakPolarHBondContact O-CG1 3.44Å; I1282-I1286 PolarHBondContact O-N 2.87Å
1283	N	38.4	Very low	37.4	Very low	82 Å²	82	107.2 Å²	107.2	44%	0.439	59%	0.59	S	S	.	*	H	α-helix	trans	-60.6	-44.1	-180	-75.1	-15.7	0	0	0	112.4	M1279 R1285 I1286 F1287	M1279-N1283 PolarHBondContact O-N 2.89Å; N1283-R1285 VanDerWaalsContact C-N 3.32Å; N1283-R1285 PolarHBondContact O-N 2.86Å; N1283-I1286 PolarHBondContact O-N 2.88Å; N1283-F1287 HydrophobicContact CB-CE2 4.45Å; N1283-F1287 WeakPolarHBondContact O-CD2 3.4Å; N1283-F1287 PolarHBondContact O-N 3.15Å
1284	S	35.8	Very low	38.5	Very low	69 Å²	69	104.7 Å²	104.7	48%	0.483	58%	0.576	S	S	.	*	H	α-helix	trans	-65.9	-32.7	177.1	50.4	0	0	0	0	113.1	N1280 M1281 I1282 A1288	N1280-S1284 WeakPolarHBondContact O-CB 3.26Å; N1280-S1284 PolarHBondContact O-N 2.78Å; N1280-S1284 PolarHBondContact O-OG 2.87Å; M1281-S1284 WeakPolarHBondContact CA-OG 3.49Å; M1281-S1284 PolarHBondContact O-OG 2.03Å; I1282-S1284 PolarHBondContact O-N 3.47Å; S1284-A1288 VanDerWaalsContact O-CB 3.28Å; S1284-A1288 WeakPolarHBondContact O-CB 3.41Å; S1284-A1288 PolarHBondContact O-N 3.47Å
1285	R	39.3	Very low	39.4	Very low	165 Å²	165	102.2 Å²	102.2	62%	0.623	56%	0.562	S	S	*	*	H	α-helix	trans	-71.3	-41.9	172.8	-169.4	174.3	-174	160.9	5.3	112.5	M1281 I1282 N1283 A1288 E1289	M1281-R1285 VanDerWaalsContact O-CB 3.27Å; M1281-R1285 WeakPolarHBondContact O-CB 3.46Å; M1281-R1285 PolarHBondContact O-N 3.08Å; M1281-R1285 VanDerWaalsContact O-N 3.15Å; I1282-R1285 PolarHBondContact O-N 2.94Å; I1282-R1285 VanDerWaalsContact O-N 3.17Å; N1283-R1285 VanDerWaalsContact C-N 3.32Å; N1283-R1285 PolarHBondContact O-N 2.86Å; R1285-A1288 PolarHBondContact O-N 2.82Å; R1285-E1289 HydrophobicContact CG-CG 4.48Å; R1285-E1289 IonicContact CZ-OE1 2.98Å; R1285-E1289 IonicContact NE-OE1 2.63Å; R1285-E1289 PolarHBondContact NE-OE1 3.34Å; R1285-E1289 VanDerWaalsContact NE-OE1 3.13Å; R1285-E1289 IonicContact NH2-OE1 3.07Å; R1285-E1289 WeakPolarHBondContact O-CB 3.34Å; R1285-E1289 PolarHBondContact O-N 2.91Å
1286	I	44.4	Very low	40.2	Very low	94 Å²	94	101.6 Å²	101.6	48%	0.482	55%	0.551	S	S	.	*	H	α-helix	trans	-61.8	-43.9	174.4	-69.3	170.4	0	0	0	110.6	I1282 N1283 E1289 A1290	I1282-I1286 HydrophobicContact CG2-CD1 3.61Å; I1282-I1286 HydrophobicContact CG2-CG1 4.32Å; I1282-I1286 WeakPolarHBondContact O-CG1 3.44Å; I1282-I1286 PolarHBondContact O-N 2.87Å; N1283-I1286 PolarHBondContact O-N 2.88Å; I1286-E1289 PolarHBondContact O-N 2.91Å; I1286-A1290 WeakPolarHBondContact O-CB 3.38Å; I1286-A1290 PolarHBondContact O-N 2.86Å
1287	F	43.1	Very low	40.9	Very low	144 Å²	144	98.7 Å²	98.7	63%	0.632	53%	0.534	S	S	*	.	H	α-helix	trans	-67.5	-34.8	175.5	-72.6	-57.5	0	0	0	112.9	N1283 Y1291	N1283-F1287 HydrophobicContact CB-CE2 4.45Å; N1283-F1287 WeakPolarHBondContact O-CD2 3.4Å; N1283-F1287 PolarHBondContact O-N 3.15Å; F1287-Y1291 WeakPolarHBondContact O-CB 3.3Å; F1287-Y1291 PolarHBondContact O-N 2.82Å
1288	A	43.6	Very low	41.3	Very low	59 Å²	59	97.6 Å²	97.6	49%	0.488	53%	0.525	S	S	.	.	H	α-helix	trans	-70.1	-41.2	174.6	0	0	0	0	0	112.5	S1284 R1285 Y1291 A1292	S1284-A1288 VanDerWaalsContact O-CB 3.28Å; S1284-A1288 WeakPolarHBondContact O-CB 3.41Å; S1284-A1288 PolarHBondContact O-N 3.47Å; R1285-A1288 PolarHBondContact O-N 2.82Å; A1288-Y1291 PolarHBondContact O-N 3.48Å; A1288-A1292 VanDerWaalsContact O-CB 3.25Å; A1288-A1292 WeakPolarHBondContact O-CB 3.33Å; A1288-A1292 PolarHBondContact O-N 2.88Å
1289	E	44.9	Very low	41.5	Very low	103 Å²	103	93.6 Å²	93.6	48%	0.481	52%	0.515	S	S	.	.	H	α-helix	trans	-70.7	-35.3	175.5	-75.3	172.7	-177.1	0	0	111.2	R1285 I1286 A1292 A1293	R1285-E1289 HydrophobicContact CG-CG 4.48Å; R1285-E1289 IonicContact CZ-OE1 2.98Å; R1285-E1289 IonicContact NE-OE1 2.63Å; R1285-E1289 PolarHBondContact NE-OE1 3.34Å; R1285-E1289 VanDerWaalsContact NE-OE1 3.13Å; R1285-E1289 IonicContact NH2-OE1 3.07Å; R1285-E1289 WeakPolarHBondContact O-CB 3.34Å; R1285-E1289 PolarHBondContact O-N 2.91Å; I1286-E1289 PolarHBondContact O-N 2.91Å; E1289-A1292 CarbonylContact O-C 3.53Å; E1289-A1292 PolarHBondContact O-N 3.16Å; E1289-A1293 WeakPolarHBondContact O-CB 3.21Å; E1289-A1293 PolarHBondContact O-N 3.13Å
1290	A	52.3	Low	41.6	Very low	52 Å²	52	90.7 Å²	90.7	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-64.8	-43	169.8	0	0	0	0	0	112.1	I1286 A1293 A1294	I1286-A1290 WeakPolarHBondContact O-CB 3.38Å; I1286-A1290 PolarHBondContact O-N 2.86Å; A1290-A1293 PolarHBondContact O-N 3.03Å; A1290-A1294 WeakPolarHBondContact O-CB 3.12Å; A1290-A1294 PolarHBondContact O-N 2.98Å
1291	Y	55.2	Low	41.4	Very low	191 Å²	191	90.4 Å²	90.4	75%	0.749	51%	0.506	S	S	*	.	H	α-helix	trans	-65.4	-38.4	172.7	-109.4	-86.3	0	0	0	112.2	F1287 A1288 A1295	F1287-Y1291 WeakPolarHBondContact O-CB 3.3Å; F1287-Y1291 PolarHBondContact O-N 2.82Å; A1288-Y1291 PolarHBondContact O-N 3.48Å; Y1291-A1295 WeakPolarHBondContact O-CB 3.5Å; Y1291-A1295 PolarHBondContact O-N 3.31Å
1292	A	48	Very low	41.5	Very low	38 Å²	38	87.7 Å²	87.7	31%	0.314	50%	0.498	S	S	.	.	H	α-helix	trans	-75.2	-24.1	177.4	0	0	0	0	0	113.2	A1288 E1289 R1296	A1288-A1292 VanDerWaalsContact O-CB 3.25Å; A1288-A1292 WeakPolarHBondContact O-CB 3.33Å; A1288-A1292 PolarHBondContact O-N 2.88Å; E1289-A1292 CarbonylContact O-C 3.53Å; E1289-A1292 PolarHBondContact O-N 3.16Å; A1292-R1296 WeakPolarHBondContact O-CB 3.44Å; A1292-R1296 VanDerWaalsContact O-CG 3.32Å; A1292-R1296 WeakPolarHBondContact O-CG 3.38Å; A1292-R1296 PolarHBondContact O-N 2.81Å; A1292-R1296 PolarHBondContact O-NE 2.96Å
1293	A	44.9	Very low	41	Very low	53 Å²	53	88.7 Å²	88.7	44%	0.438	51%	0.511	S	S	.	.	H	α-helix	trans	-78.9	-44.2	170.5	0	0	0	0	0	110.6	E1289 A1290 A1295 R1296 A1297	E1289-A1293 WeakPolarHBondContact O-CB 3.21Å; E1289-A1293 PolarHBondContact O-N 3.13Å; A1290-A1293 PolarHBondContact O-N 3.03Å; A1293-A1295 PolarHBondContact O-N 3.12Å; A1293-R1296 CarbonylContact O-C 3.55Å; A1293-R1296 PolarHBondContact O-N 2.82Å; A1293-A1297 WeakPolarHBondContact O-CB 3.39Å; A1293-A1297 PolarHBondContact O-N 3.02Å
1294	A	46.2	Very low	40.5	Very low	61 Å²	61	87.8 Å²	87.8	50%	0.504	52%	0.521	S	S	.	.	H	α-helix	trans	-63.1	-39.3	173.3	0	0	0	0	0	111.9	A1290 A1297 A1298	A1290-A1294 WeakPolarHBondContact O-CB 3.12Å; A1290-A1294 PolarHBondContact O-N 2.98Å; A1294-A1297 PolarHBondContact O-N 2.85Å; A1294-A1298 VanDerWaalsContact O-CB 3.22Å; A1294-A1298 WeakPolarHBondContact O-CB 3.48Å; A1294-A1298 PolarHBondContact O-N 3.14Å
1295	A	44.2	Very low	40	Very low	59 Å²	59	88.9 Å²	88.9	49%	0.488	53%	0.529	S	S	.	.	H	α-helix	trans	-66.8	-37.6	173.2	0	0	0	0	0	112.3	Y1291 A1293 A1299	Y1291-A1295 WeakPolarHBondContact O-CB 3.5Å; Y1291-A1295 PolarHBondContact O-N 3.31Å; A1293-A1295 PolarHBondContact O-N 3.12Å; A1295-A1299 VanDerWaalsContact O-CB 3.27Å; A1295-A1299 WeakPolarHBondContact O-CB 3.38Å; A1295-A1299 PolarHBondContact O-N 3.07Å
1296	R	42.8	Very low	39.5	Very low	173 Å²	173	85.8 Å²	85.8	65%	0.653	53%	0.528	S	S	*	.	H	α-helix	trans	-70.9	-37.3	173.5	-81.5	179.5	-80.9	-169.7	-2.3	112.6	A1292 A1293 A1299 S1300	A1292-R1296 WeakPolarHBondContact O-CB 3.44Å; A1292-R1296 VanDerWaalsContact O-CG 3.32Å; A1292-R1296 WeakPolarHBondContact O-CG 3.38Å; A1292-R1296 PolarHBondContact O-N 2.81Å; A1292-R1296 PolarHBondContact O-NE 2.96Å; A1293-R1296 CarbonylContact O-C 3.55Å; A1293-R1296 PolarHBondContact O-N 2.82Å; R1296-A1299 PolarHBondContact O-N 2.83Å; R1296-S1300 PolarHBondContact O-N 2.89Å; R1296-S1300 PolarHBondContact O-OG 2.84Å
1297	A	41.9	Very low	38.6	Very low	44 Å²	44	85.8 Å²	85.8	36%	0.364	53%	0.529	S	S	.	.	H	α-helix	trans	-64.8	-45.4	172.9	0	0	0	0	0	111.2	A1293 A1294 A1299 S1300 L1301	A1293-A1297 WeakPolarHBondContact O-CB 3.39Å; A1293-A1297 PolarHBondContact O-N 3.02Å; A1294-A1297 PolarHBondContact O-N 2.85Å; A1297-A1299 PolarHBondContact O-N 3.45Å; A1297-S1300 WeakPolarHBondContact CA-OG 3.27Å; A1297-S1300 PolarHBondContact O-N 3.41Å; A1297-S1300 PolarHBondContact O-OG 3.13Å; A1297-L1301 WeakPolarHBondContact O-CB 3.25Å; A1297-L1301 WeakPolarHBondContact O-CG 3.38Å; A1297-L1301 PolarHBondContact O-N 3.48Å
1298	A	35.9	Very low	37.9	Very low	50 Å²	50	85.8 Å²	85.8	41%	0.413	53%	0.534	S	S	.	.	H	α-helix	trans	-61.3	-41.8	172.6	0	0	0	0	0	111.7	A1294 S1300 L1301 V1302	A1294-A1298 VanDerWaalsContact O-CB 3.22Å; A1294-A1298 WeakPolarHBondContact O-CB 3.48Å; A1294-A1298 PolarHBondContact O-N 3.14Å; A1298-S1300 PolarHBondContact O-N 2.93Å; A1298-L1301 PolarHBondContact O-N 3.39Å; A1298-V1302 WeakPolarHBondContact O-CB 3.41Å; A1298-V1302 VanDerWaalsContact O-CG2 3.3Å; A1298-V1302 WeakPolarHBondContact O-CG2 3.41Å; A1298-V1302 PolarHBondContact O-N 3.34Å
1299	A	32.5	Very low	36.9	Very low	53 Å²	53	93.9 Å²	93.9	44%	0.438	55%	0.554	S	S	.	*	H	α-helix	trans	-63.9	-37.4	174	0	0	0	0	0	112.4	A1295 R1296 A1297 S1303	A1295-A1299 VanDerWaalsContact O-CB 3.27Å; A1295-A1299 WeakPolarHBondContact O-CB 3.38Å; A1295-A1299 PolarHBondContact O-N 3.07Å; R1296-A1299 PolarHBondContact O-N 2.83Å; A1297-A1299 PolarHBondContact O-N 3.45Å; A1299-S1303 VanDerWaalsContact O-CB 3.29Å; A1299-S1303 WeakPolarHBondContact O-CB 3.47Å; A1299-S1303 PolarHBondContact O-N 3.16Å; A1299-S1303 PolarHBondContact O-OG 2.84Å
1300	S	33.7	Very low	35.9	Very low	76 Å²	76	92.2 Å²	92.2	53%	0.531	55%	0.554	S	S	.	*	H	α-helix	trans	-71	-33.5	174	60.4	0	0	0	0	113.5	R1296 A1297 A1298 S1303 G1304	R1296-S1300 PolarHBondContact O-N 2.89Å; R1296-S1300 PolarHBondContact O-OG 2.84Å; A1297-S1300 WeakPolarHBondContact CA-OG 3.27Å; A1297-S1300 PolarHBondContact O-N 3.41Å; A1297-S1300 PolarHBondContact O-OG 3.13Å; A1298-S1300 PolarHBondContact O-N 2.93Å; S1300-S1303 WeakPolarHBondContact O-CB 3.45Å; S1300-S1303 PolarHBondContact O-N 3.15Å; S1300-G1304 PolarHBondContact O-N 3.46Å
1301	L	32.1	Very low	34.6	Very low	119 Å²	119	95.8 Å²	95.8	62%	0.623	57%	0.573	S	S	*	*	H	α-helix	trans	-73.3	-38.2	175.1	-75.1	165.3	0	0	0	111.7	A1297 A1298 S1303 G1304 S1305	A1297-L1301 WeakPolarHBondContact O-CB 3.25Å; A1297-L1301 WeakPolarHBondContact O-CG 3.38Å; A1297-L1301 PolarHBondContact O-N 3.48Å; A1298-L1301 PolarHBondContact O-N 3.39Å; L1301-S1303 VanDerWaalsContact C-N 3.35Å; L1301-G1304 WeakPolarHBondContact O-CA 3.45Å; L1301-G1304 PolarHBondContact O-N 2.9Å; L1301-S1305 PolarHBondContact O-N 2.84Å
1302	V	33.3	Very low	33.1	Very low	89 Å²	89	92.2 Å²	92.2	54%	0.539	58%	0.575	S	S	.	*	H	α-helix	trans	-66.8	-37.5	170.4	171.8	0	0	0	0	110.7	A1298 G1304 S1305 T1306	A1298-V1302 WeakPolarHBondContact O-CB 3.41Å; A1298-V1302 VanDerWaalsContact O-CG2 3.3Å; A1298-V1302 WeakPolarHBondContact O-CG2 3.41Å; A1298-V1302 PolarHBondContact O-N 3.34Å; V1302-G1304 PolarHBondContact O-N 2.79Å; V1302-G1304 VanDerWaalsContact O-N 3.09Å; V1302-S1305 CarbonylContact O-C 3.52Å; V1302-S1305 PolarHBondContact O-N 2.91Å; V1302-T1306 HydrophobicContact CG1-CG2 3.7Å
1303	S	29.3	Very low	32	Very low	88 Å²	88	95 Å²	95	62%	0.615	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	-10.7	169.7	-57.8	0	0	0	0	113.6	A1299 S1300 L1301	A1299-S1303 VanDerWaalsContact O-CB 3.29Å; A1299-S1303 WeakPolarHBondContact O-CB 3.47Å; A1299-S1303 PolarHBondContact O-N 3.16Å; A1299-S1303 PolarHBondContact O-OG 2.84Å; S1300-S1303 WeakPolarHBondContact O-CB 3.45Å; S1300-S1303 PolarHBondContact O-N 3.15Å; L1301-S1303 VanDerWaalsContact C-N 3.35Å
1304	G	26.6	Very low	31	Very low	63 Å²	63	102.1 Å²	102.1	65%	0.649	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	-8.3	171.2	0	0	0	0	0	114.9	S1300 L1301 V1302	S1300-G1304 PolarHBondContact O-N 3.46Å; L1301-G1304 WeakPolarHBondContact O-CA 3.45Å; L1301-G1304 PolarHBondContact O-N 2.9Å; V1302-G1304 PolarHBondContact O-N 2.79Å; V1302-G1304 VanDerWaalsContact O-N 3.09Å
1305	S	25.7	Very low	30.1	Very low	93 Å²	93	104.3 Å²	104.3	65%	0.65	62%	0.624	S	S	*	*			trans	-158.4	68.1	-177.3	-174.6	0	0	0	0	114.1	L1301 V1302	L1301-S1305 PolarHBondContact O-N 2.84Å; V1302-S1305 CarbonylContact O-C 3.52Å; V1302-S1305 PolarHBondContact O-N 2.91Å
1306	T	28.4	Very low	29.1	Very low	100 Å²	100	108.1 Å²	108.1	61%	0.613	64%	0.641	S	S	*	*			trans	-117.7	33.6	163.7	55	0	0	0	0	113	V1302 I1308	V1302-T1306 HydrophobicContact CG1-CG2 3.7Å; T1306-I1308 PolarHBondContact O-N 2.82Å
1307	D	26.8	Very low	28.2	Very low	94 Å²	94	106.3 Å²	106.3	50%	0.503	64%	0.644	S	S	.	*			trans	-78	63.4	171.8	-69.3	-46.8	0	0	0	111.2
1308	I	27.1	Very low	27.3	Very low	144 Å²	144	110.9 Å²	110.9	74%	0.738	66%	0.663	S	S	*	*			trans	-123.3	41.1	167.4	-40.6	-177.1	0	0	0	110	T1306	T1306-I1308 PolarHBondContact O-N 2.82Å
1309	Y	24.4	Very low	26.8	Very low	228 Å²	228	113.5 Å²	113.5	89%	0.894	67%	0.669	S	S	*	*	S	Bend	trans	-148.7	41.9	161.3	-106.7	-69.1	0	0	0	111.2	P1311	Y1309-P1311 VanDerWaalsContact O-CD 3.26Å; Y1309-P1311 WeakPolarHBondContact O-CD 3.29Å
1310	S	23	Very low	26.3	Very low	68 Å²	68	115.2 Å²	115.2	48%	0.476	68%	0.678	S	S	.	*			trans	-93	110.3	177.5	-49.4	0	0	0	0	110.9	S1312	S1310-S1312 PolarHBondContact O-N 2.99Å
1311	P	24.7	Very low	25.9	Very low	128 Å²	128	115.5 Å²	115.5	83%	0.831	68%	0.68	S	S	*	*			trans	-74.5	79.5	167	31	-33.7	0	0	0	109.4	Y1309 S1313	Y1309-P1311 VanDerWaalsContact O-CD 3.26Å; Y1309-P1311 WeakPolarHBondContact O-CD 3.29Å; P1311-S1313 PolarHBondContact O-N 2.89Å
1312	S	23	Very low	25.6	Very low	115 Å²	115	117.9 Å²	117.9	80%	0.804	69%	0.688	S	S	*	*			trans	-77.9	84.5	-173.2	60.2	0	0	0	0	112.7	S1310	S1310-S1312 PolarHBondContact O-N 2.99Å
1313	S	27	Very low	25.3	Very low	96 Å²	96	119.7 Å²	119.7	67%	0.671	69%	0.694	S	S	*	*			trans	-150.7	80	162.2	65	0	0	0	0	113.2	P1311 V1315	P1311-S1313 PolarHBondContact O-N 2.89Å; S1313-V1315 PolarHBondContact O-N 2.8Å; S1313-V1315 VanDerWaalsContact O-N 3.07Å
1314	Q	23.1	Very low	25.1	Very low	204 Å²	204	121.6 Å²	121.6	95%	0.953	70%	0.698	S	S	*	*			trans	-69	89.8	142.6	-84.9	-172.4	-17.6	0	0	107.7
1315	V	26.9	Very low	25.1	Very low	107 Å²	107	124.9 Å²	124.9	65%	0.648	70%	0.696	S	S	*	*			trans	-129.5	89.4	162.3	-178.3	0	0	0	0	107.3	S1313 N1317	S1313-V1315 PolarHBondContact O-N 2.8Å; S1313-V1315 VanDerWaalsContact O-N 3.07Å; V1315-N1317 VanDerWaalsContact C-N 3.29Å; V1315-N1317 HydrophobicContact CG1-CB 4.13Å; V1315-N1317 PolarHBondContact O-N 2.64Å; V1315-N1317 VanDerWaalsContact O-N 3.08Å
1316	T	22.5	Very low	25	Very low	138 Å²	138	127.2 Å²	127.2	85%	0.847	70%	0.697	S	S	*	*			trans	-71	91.2	159	47.9	0	0	0	0	107.7
1317	N	23.7	Very low	24.9	Very low	136 Å²	136	131.9 Å²	131.9	73%	0.727	70%	0.703	S	S	*	*			trans	-156.4	146.6	161.3	-95.7	-26.4	0	0	0	110.5	V1315	V1315-N1317 VanDerWaalsContact C-N 3.29Å; V1315-N1317 HydrophobicContact CG1-CB 4.13Å; V1315-N1317 PolarHBondContact O-N 2.64Å; V1315-N1317 VanDerWaalsContact O-N 3.08Å
1318	D	23.6	Very low	24.8	Very low	140 Å²	140	133.9 Å²	133.9	75%	0.749	71%	0.714	S	S	*	*			trans	-58.1	157.8	-168.6	-57.3	-57.7	0	0	0	117.3
1319	L	25	Very low	24.7	Very low	105 Å²	105	138.7 Å²	138.7	55%	0.55	72%	0.723	S	S	.	*			trans	54.9	92.9	143.9	-91.6	47	0	0	0	118.7	F1525	L1319-F1525 HydrophobicContact CD1-CE2 4.37Å; L1319-F1525 HydrophobicContact CD1-CZ 4.21Å; L1319-F1525 HydrophobicContact CD2-CD1 4.41Å; L1319-F1525 HydrophobicContact CD2-CD2 3.46Å; L1319-F1525 VanDerWaalsContact CD2-CD2 3.46Å; L1319-F1525 HydrophobicContact CD2-CE1 4.37Å; L1319-F1525 HydrophobicContact CD2-CE2 3.41Å; L1319-F1525 VanDerWaalsContact CD2-CE2 3.41Å; L1319-F1525 HydrophobicContact CD2-CG 3.99Å; L1319-F1525 HydrophobicContact CD2-CZ 3.9Å; L1319-F1525 HydrophobicContact CG-CD2 4.18Å; L1319-F1525 HydrophobicContact CG-CE2 3.62Å; L1319-F1525 HydrophobicContact CG-CZ 3.96Å
1320	S	22.9	Very low	24.8	Very low	89 Å²	89	133.2 Å²	133.2	62%	0.622	72%	0.718	S	S	*	*				26.1	111.3	124	61.6	0	0	0	0	118.7
1321	S	25.4	Very low	24.8	Very low	81 Å²	81	138.8 Å²	138.8	57%	0.566	74%	0.736	S	S	*	*				179.7	168.4	100.4	53.8	0	0	0	0	113.7
1322	Q	24.6	Very low	25	Very low	170 Å²	170	141.8 Å²	141.8	79%	0.794	74%	0.739	S	S	*	*			trans	-79.7	157.8	-170.1	-73.2	172.3	-64.5	0	0	115.7
1323	N	27	Very low	25.1	Very low	126 Å²	126	140.8 Å²	140.8	67%	0.674	73%	0.731	S	S	*	*			trans	90	96.1	145.1	-63.1	-11.8	0	0	0	121.8
1324	N	26.7	Very low	25	Very low	129 Å²	129	144.9 Å²	144.9	69%	0.69	75%	0.745	S	S	*	*				78.6	123.5	114.1	-63.4	11.8	0	0	0	122.8
1325	E	25.5	Very low	25	Very low	132 Å²	132	141.9 Å²	141.9	62%	0.617	74%	0.735	S	S	*	*				46.7	104.4	125.3	-63.1	177.3	165.7	0	0	118.2	L1441	E1325-L1441 WeakPolarHBondContact OE1-CD1 3.32Å
1326	E	24.6	Very low	24.9	Very low	142 Å²	142	148.1 Å²	148.1	66%	0.664	75%	0.748	S	S	*	*				90.7	115.4	83.5	-87.7	-137.2	119.6	0	0	114.2
1327	R	25.6	Very low	24.9	Very low	197 Å²	197	146 Å²	146	74%	0.743	74%	0.739	S	S	*	*				41.8	137.1	124.1	-75.1	164.2	155.5	177.6	0.3	119.2
1328	N	25.8	Very low	24.9	Very low	136 Å²	136	147.3 Å²	147.3	73%	0.727	74%	0.743	S	S	*	*			cis	-169.7	165.5	18	-128	-22.9	0	0	0	113.2
1329	R	23.6	Very low	25	Very low	246 Å²	246	146.7 Å²	146.7	93%	0.928	74%	0.74	S	S	*	*			trans	96.1	145.7	177.1	-63	174.7	168.9	154.7	-1.2	114.2
1330	S	26	Very low	25	Very low	113 Å²	113	150.8 Å²	150.8	79%	0.79	76%	0.756	S	S	*	*			cis	-112.6	166.5	13.5	56.5	0	0	0	0	115.1
1331	Q	24.1	Very low	25	Very low	185 Å²	185	155.9 Å²	155.9	86%	0.864	77%	0.77	S	S	*	*			trans	-90.2	139.1	164.6	-62.8	169.5	-75.5	0	0	108.7
1332	H	27.7	Very low	25.1	Very low	191 Å²	191	160.5 Å²	160.5	88%	0.884	79%	0.786	S	S	*	*			trans	-141.5	152.8	146	-121.9	-89.5	0	0	0	110.3
1333	S	25.4	Very low	25	Very low	93 Å²	93	159.3 Å²	159.3	65%	0.65	79%	0.786	S	S	*	*			trans	-92.6	140.2	-161.8	54.4	0	0	0	0	114.4
1334	L	25.2	Very low	24.9	Very low	183 Å²	183	160.7 Å²	160.7	96%	0.958	79%	0.793	S	S	*	*			trans	-116.6	144.4	134.2	-83.9	175.1	0	0	0	108.9
1335	L	22.7	Very low	24.9	Very low	140 Å²	140	158.1 Å²	158.1	73%	0.733	80%	0.797	S	S	*	*			trans	-138	107.8	-171.8	-154.4	-178.8	0	0	0	108
1336	Y	26.3	Very low	24.8	Very low	238 Å²	238	161.2 Å²	161.2	93%	0.933	81%	0.809	S	S	*	*			trans	-149.7	143.8	158.8	-112.2	-76.1	0	0	0	109.5
1337	S	21	Very low	24.8	Very low	94 Å²	94	161.5 Å²	161.5	66%	0.657	81%	0.813	S	S	*	*			trans	-107.7	135.5	-177.7	-53.8	0	0	0	0	110.9
1338	M	25	Very low	24.8	Very low	163 Å²	163	159.5 Å²	159.5	80%	0.803	82%	0.817	S	S	*	*				-165.3	140.3	127.4	-111.1	-179.3	-80.9	0	0	112
1339	N	25.5	Very low	24.8	Very low	128 Å²	128	156 Å²	156	68%	0.684	81%	0.813	S	S	*	*			trans	36.6	103.4	149	-47.8	-13.5	0	0	0	117.3
1340	Q	24.4	Very low	25	Very low	190 Å²	190	150.2 Å²	150.2	89%	0.888	81%	0.81	S	S	*	*				57	91	84.3	-75.1	-165.1	-40.3	0	0	114.7
1341	E	23.1	Very low	24.9	Very low	197 Å²	197	151.7 Å²	151.7	92%	0.921	80%	0.802	S	S	*	*			trans	-149.5	67.7	150.1	-147.6	169.7	-121.8	0	0	110.9
1342	I	26.6	Very low	24.9	Very low	177 Å²	177	149.4 Å²	149.4	91%	0.908	79%	0.792	S	S	*	*			trans	-128.1	88.4	161.1	-57.5	-177.8	0	0	0	108.3
1343	N	23.1	Very low	25	Very low	146 Å²	146	145.2 Å²	145.2	78%	0.781	79%	0.791	S	S	*	*			trans	-151	110.5	150.4	-158.7	18.9	0	0	0	107.6
1344	N	24	Very low	25	Very low	154 Å²	154	147.9 Å²	147.9	82%	0.824	80%	0.797	S	S	*	*			trans	172.1	70.6	160.1	-89.5	-18.7	0	0	0	110.3	F1346	N1344-F1346 PolarHBondContact O-N 2.9Å
1345	G	27.6	Very low	25.2	Very low	75 Å²	75	145.1 Å²	145.1	77%	0.773	78%	0.782	S	S	*	*			trans	-90.8	86.5	169	0	0	0	0	0	111.1
1346	F	24.4	Very low	25.5	Very low	198 Å²	198	146 Å²	146	87%	0.868	79%	0.787	S	S	*	*			trans	-16.9	119.3	178.3	-78.4	-100.5	0	0	0	118.5	N1344	N1344-F1346 PolarHBondContact O-N 2.9Å
1347	I	24.7	Very low	25.5	Very low	147 Å²	147	140.3 Å²	140.3	75%	0.754	78%	0.778	S	S	*	*			trans	-135.6	136.3	149.6	-68.9	-175.2	0	0	0	108.2
1348	N	24.3	Very low	25.8	Very low	156 Å²	156	143.7 Å²	143.7	83%	0.834	78%	0.783	S	S	*	*			trans	64.9	150.1	179.2	-60.3	-20.6	0	0	0	117.1
1349	G	26.6	Very low	25.9	Very low	62 Å²	62	142.7 Å²	142.7	64%	0.639	78%	0.781	S	S	*	*			cis	151.4	172.4	-11.7	0	0	0	0	0	115
1350	S	27.2	Very low	25.9	Very low	124 Å²	124	143.3 Å²	143.3	87%	0.867	79%	0.79	S	S	*	*			trans	73.6	128.9	162.6	76.9	0	0	0	0	121.2
1351	K	23.5	Very low	26.2	Very low	144 Å²	144	138.1 Å²	138.1	63%	0.626	79%	0.787	S	S	*	*			trans	-131.4	141.5	130.6	-99.3	170.9	163.3	-88.1	0	104.3
1352	E	25.5	Very low	26.5	Very low	137 Å²	137	131.9 Å²	131.9	64%	0.64	78%	0.776	S	S	*	*	S	Bend	cis	-156.8	121.8	5.8	-152.4	154.6	-126.7	0	0	111.8
1353	A	28.6	Very low	26.6	Very low	104 Å²	104	128.9 Å²	128.9	86%	0.86	75%	0.753	S	S	*	*			trans	-164.4	140.6	154.6	0	0	0	0	0	107
1354	N	25.9	Very low	26.9	Very low	148 Å²	148	126.5 Å²	126.5	79%	0.791	74%	0.736	S	S	*	*			trans	-149	167.8	-163.7	-160.5	-0.6	0	0	0	111.7
1355	I	29.5	Very low	27.2	Very low	126 Å²	126	124.6 Å²	124.6	65%	0.646	72%	0.72	S	S	*	*			trans	76.2	86	164.9	-51.7	155.9	0	0	0	115.4
1356	N	27.6	Very low	27.4	Very low	157 Å²	157	128.8 Å²	128.8	84%	0.84	71%	0.714	S	S	*	*				-170.4	164.5	98.5	-97.7	-41	0	0	0	112.6
1357	T	26.2	Very low	27.6	Very low	119 Å²	119	125.6 Å²	125.6	73%	0.73	71%	0.706	S	S	*	*			trans	-145.4	173.5	-154	-29.8	0	0	0	0	112.6
1358	E	28.6	Very low	27.8	Very low	165 Å²	165	124.4 Å²	124.4	77%	0.771	70%	0.701	S	S	*	*			trans	82.5	121	165.9	-63.5	176.8	-168	0	0	116.1
1359	N	26.2	Very low	27.8	Very low	143 Å²	143	122.1 Å²	122.1	77%	0.765	70%	0.697	S	S	*	*				81.9	143.8	62.5	-66.1	-35.5	0	0	0	112.2
1360	T	26.9	Very low	28	Very low	141 Å²	141	125.7 Å²	125.7	87%	0.865	70%	0.701	S	S	*	*			cis	-162	152.7	24.7	-27.8	0	0	0	0	114.1
1361	G	29.6	Very low	28.1	Very low	80 Å²	80	124 Å²	124	83%	0.825	69%	0.69	S	S	*	*			trans	90.2	158.9	151.5	0	0	0	0	0	119.6
1362	G	29.9	Very low	28.2	Very low	66 Å²	66	122.2 Å²	122.2	68%	0.68	70%	0.696	S	S	*	*			cis	164.3	134.7	-15.8	0	0	0	0	0	118.1
1363	W	28.5	Very low	28.3	Very low	115 Å²	115	122.8 Å²	122.8	44%	0.436	70%	0.701	S	S	.	*			trans	81.2	171.6	158.5	-62	52.8	0	0	0	116.6	H1162 D1163 L1165	H1162-W1363 HydrophobicContact CB-CH2 4.4Å; H1162-W1363 HydrophobicContact CB-CZ3 4.31Å; H1162-W1363 AromaticContact CE1-CZ3 3.38Å; H1162-W1363 WeakPolarHBondContact CE1-CZ3 3.07Å; H1162-W1363 AromaticContact CG-CZ3 3.64Å; H1162-W1363 AromaticContact ND1-CH2 3.49Å; H1162-W1363 WeakPolarHBondContact ND1-CH2 3.49Å; H1162-W1363 AromaticContact ND1-CZ3 3.16Å; H1162-W1363 WeakPolarHBondContact ND1-CZ3 3.29Å; H1162-W1363 AromaticContact NE2-CZ3 3.93Å; H1162-W1363 WeakPolarHBondContact O-CZ3 3.37Å; D1163-W1363 VanDerWaalsContact CA-CG 3.41Å; D1163-W1363 HydrophobicContact CB-CD2 3.93Å; D1163-W1363 HydrophobicContact CB-CE3 3.47Å; D1163-W1363 VanDerWaalsContact CB-CE3 3.47Å; D1163-W1363 HydrophobicContact CB-CH2 2.58Å; D1163-W1363 HydrophobicContact CB-CZ2 3.14Å; D1163-W1363 HydrophobicContact CB-CZ3 2.77Å; D1163-W1363 WeakPolarHBondContact OD2-CH2 3.47Å; D1163-W1363 WeakPolarHBondContact OD2-CZ2 3.39Å; L1165-W1363 VanDerWaalsContact N-C 3.3Å
1364	K	29.3	Very low	28.1	Very low	96 Å²	96	123.1 Å²	123.1	42%	0.417	70%	0.696	S	S	.	*			cis	-152.7	128.7	6.2	-166.9	147.8	-167.6	145.7	0	119.3	H1162 D1163 S1164	H1162-K1364 PolarHBondContact CD2-NZ 2.91Å; H1162-K1364 PolarHBondContact NE2-NZ 3.3Å; H1162-K1364 PolarHBondContact O-NZ 2.87Å; D1163-K1364 WeakPolarHBondContact O-CA 3.5Å; S1164-K1364 CarbonylContact O-C 3.54Å; S1164-K1364 WeakPolarHBondContact O-CA 3.42Å; S1164-K1364 PolarHBondContact O-N 3.34Å
1365	K	30.5	Very low	28.3	Very low	114 Å²	114	123.1 Å²	123.1	50%	0.496	70%	0.696	S	S	.	*			trans	89.5	114.9	151.7	-89.1	179.5	169.9	-166.8	0	125.3	S1164	S1164-K1365 PolarHBondContact O-N 2.83Å; S1164-K1365 PolarHBondContact OG-N 2.78Å
1366	Y	31.3	Very low	28.2	Very low	162 Å²	162	125 Å²	125	64%	0.635	70%	0.699	S	S	*	*				94.8	112.7	127.7	-74.7	-36.9	0	0	0	125.7
1367	N	30.2	Very low	28.3	Very low	131 Å²	131	124.2 Å²	124.2	70%	0.701	70%	0.695	S	S	*	*				62	150.9	125.1	-68.8	21.9	0	0	0	121.9
1368	N	27.5	Very low	28.5	Very low	123 Å²	123	129.3 Å²	129.3	66%	0.658	70%	0.701	S	S	*	*			cis	-149.5	164.4	6.5	-142.5	24.9	0	0	0	113.1
1369	S	25.4	Very low	28.6	Very low	108 Å²	108	127.3 Å²	127.3	76%	0.755	70%	0.695	S	S	*	*			trans	-130.8	125.9	165.5	56.7	0	0	0	0	111.4
1370	N	30	Very low	28.5	Very low	136 Å²	136	130.2 Å²	130.2	73%	0.727	70%	0.701	S	S	*	*			trans	-139	116.8	175.7	-99.1	5.8	0	0	0	106.7
1371	S	29.1	Very low	28.6	Very low	90 Å²	90	135.5 Å²	135.5	63%	0.629	71%	0.705	S	S	*	*				79.4	99.6	79.3	77.5	0	0	0	0	114.3
1372	S	24.9	Very low	28.4	Very low	106 Å²	106	141.4 Å²	141.4	74%	0.741	71%	0.708	S	S	*	*				31.9	156.6	129.3	61.1	0	0	0	0	122.6
1373	I	29.3	Very low	28.1	Very low	148 Å²	148	142.6 Å²	142.6	76%	0.759	71%	0.711	S	S	*	*			trans	93.6	94.1	172.3	-54.5	167	0	0	0	111.4
1374	C	22.9	Very low	27.9	Very low	112 Å²	112	145.1 Å²	145.1	76%	0.757	73%	0.734	S	S	*	*				91.4	157.7	59.1	-73.9	0	0	0	0	113.4
1375	L	30.2	Very low	27.7	Very low	148 Å²	148	148.9 Å²	148.9	78%	0.775	75%	0.753	S	S	*	*			trans	78.6	133.2	-172.5	-46.1	168.8	0	0	0	113.1
1376	K	28.2	Very low	27.6	Very low	164 Å²	164	150.9 Å²	150.9	71%	0.713	77%	0.767	S	S	*	*			cis	-154.8	137.4	-3.2	-123.9	166.4	178.6	169.1	0	112.2
1377	N	30.1	Very low	27.4	Very low	141 Å²	141	147.9 Å²	147.9	75%	0.754	77%	0.77	S	S	*	*			trans	47.4	115.9	147.2	-55.2	0.5	0	0	0	121.1
1378	R	30.1	Very low	27.2	Very low	227 Å²	227	149.1 Å²	149.1	86%	0.857	77%	0.769	S	S	*	*				-157.2	127.7	93	-145.3	164.6	-173	163.3	0.6	114
1379	D	31	Very low	27.1	Very low	123 Å²	123	152.9 Å²	152.9	66%	0.658	78%	0.775	S	S	*	*			trans	10.5	128.9	146.2	-41.9	-39.5	0	0	0	117.9
1380	K	24.7	Very low	27.1	Very low	204 Å²	204	156.8 Å²	156.8	89%	0.887	78%	0.779	S	S	*	*			cis	58.4	105.1	23.6	-95	-172.6	-177.5	178	0	116.2
1381	R	28.4	Very low	26.9	Very low	251 Å²	251	157.6 Å²	157.6	95%	0.947	78%	0.783	S	S	*	*			trans	-154.9	159.4	149.6	-108.3	168.4	-153.7	-139.9	2.4	111.7
1382	K	23.9	Very low	26.7	Very low	204 Å²	204	158.2 Å²	158.2	89%	0.887	79%	0.787	S	S	*	*			trans	-107.6	157.7	179.2	-69.1	-176.7	175.9	-176.8	0	111.1
1383	A	23.8	Very low	26.7	Very low	91 Å²	91	159.5 Å²	159.5	75%	0.752	79%	0.785	S	S	*	*			trans	29.2	122.2	146.7	0	0	0	0	0	120.4
1384	N	26.2	Very low	26.4	Very low	169 Å²	169	160.9 Å²	160.9	90%	0.904	79%	0.789	S	S	*	*				-162.1	163.4	120.9	-108.8	1.3	0	0	0	111.2
1385	E	24.6	Very low	26.5	Very low	175 Å²	175	158.6 Å²	158.6	82%	0.818	78%	0.784	S	S	*	*			trans	-77.9	165.7	171.9	-54.9	178.2	110.5	0	0	112
1386	I	28.7	Very low	26.4	Very low	155 Å²	155	158.4 Å²	158.4	80%	0.795	78%	0.782	S	S	*	*				158.4	135.3	128.8	-82	160.4	0	0	0	113.3
1387	S	27.2	Very low	26.3	Very low	100 Å²	100	161.9 Å²	161.9	70%	0.699	79%	0.791	S	S	*	*			trans	25.2	117	163.8	69.7	0	0	0	0	123.9
1388	K	25.2	Very low	26.2	Very low	157 Å²	157	162.5 Å²	162.5	68%	0.683	79%	0.787	S	S	*	*				44.9	140.3	101.3	-113.3	173.8	-177.2	172.5	0	121
1389	Y	25.8	Very low	26	Very low	201 Å²	201	159.2 Å²	159.2	79%	0.788	78%	0.781	S	S	*	*			trans	75.4	152.6	166.6	-65.6	-64.1	0	0	0	116.5
1390	K	25.9	Very low	25.7	Very low	190 Å²	190	157.8 Å²	157.8	83%	0.826	78%	0.78	S	S	*	*			cis	-145	153.5	8	-149.3	173.8	-177.3	178.6	0	113.2
1391	N	25.3	Very low	25.5	Very low	153 Å²	153	159.3 Å²	159.3	82%	0.818	78%	0.78	S	S	*	*			trans	-77.5	149.9	167.4	-57.4	-27.3	0	0	0	112.2
1392	S	24	Very low	25.4	Very low	103 Å²	103	155 Å²	155	72%	0.72	78%	0.775	S	S	*	*			trans	-167.7	124.1	143.8	-168.6	0	0	0	0	107
1393	L	24.6	Very low	25.3	Very low	133 Å²	133	149.9 Å²	149.9	70%	0.696	76%	0.764	S	S	*	*				48.6	132	77.8	-72	82.9	0	0	0	112.1
1394	Q	24	Very low	25.3	Very low	178 Å²	178	153.1 Å²	153.1	83%	0.832	77%	0.768	S	S	*	*			cis	-166	172.7	27.1	-136.7	164.5	12.3	0	0	110.7
1395	G	25.2	Very low	25.2	Very low	63 Å²	63	151 Å²	151	65%	0.649	77%	0.767	S	S	*	*			trans	163.8	34.3	160.3	0	0	0	0	0	126
1396	I	27.1	Very low	25.3	Very low	144 Å²	144	146.2 Å²	146.2	74%	0.738	76%	0.764	S	S	*	*			trans	56	105.6	142.1	-53.8	155.6	0	0	0	119.7
1397	R	27.6	Very low	25	Very low	238 Å²	238	147.8 Å²	147.8	90%	0.898	77%	0.768	S	S	*	*				-178.9	148.3	114.4	-93.6	179.4	-164	-176.4	4.6	110.1
1398	K	27.6	Very low	24.9	Very low	154 Å²	154	150.1 Å²	150.1	67%	0.67	77%	0.772	S	S	*	*			cis	-171.9	122.1	-37	-121	-167.9	170.5	-168	0	109.5
1399	H	26.2	Very low	24.9	Very low	158 Å²	158	150.9 Å²	150.9	73%	0.731	78%	0.778	S	S	*	*			trans	62	161.4	155.9	-53.3	-51.7	0	0	0	119.6
1400	S	23.4	Very low	25.7	Very low	92 Å²	92	146.1 Å²	146.1	64%	0.643	77%	0.772	S	S	*	*			cis	-173.4	142.9	-29.4	57.8	0	0	0	0	114.9
1401	R	21.5	Very low	25.8	Very low	236 Å²	236	149.3 Å²	149.3	89%	0.891	78%	0.778	S	S	*	*			trans	69.3	165.1	149.4	-69.1	177.8	-177.6	-171.5	2.7	120.5
1402	I	25.9	Very low	25.8	Very low	161 Å²	161	145.8 Å²	145.8	83%	0.826	78%	0.779	S	S	*	*			trans	77.6	132	170.5	-51.7	178.2	0	0	0	114.4
1403	S	22.7	Very low	25.8	Very low	96 Å²	96	146.3 Å²	146.3	67%	0.671	78%	0.782	S	S	*	*			cis	-164.9	157.3	-25	-99.2	0	0	0	0	111.2
1404	L	22.9	Very low	25.8	Very low	160 Å²	160	148.5 Å²	148.5	84%	0.838	79%	0.789	S	S	*	*			trans	49.4	119.4	148.3	-78.5	156.8	0	0	0	122.9
1405	S	23.7	Very low	26	Very low	124 Å²	124	148.8 Å²	148.8	87%	0.867	80%	0.795	S	S	*	*			trans	75.8	150.6	132.8	-152.6	0	0	0	0	120.5
1406	G	26.1	Very low	25.9	Very low	74 Å²	74	150.1 Å²	150.1	76%	0.763	79%	0.794	S	S	*	*			trans	143.2	21.5	159.4	0	0	0	0	0	121.1
1407	Q	23.8	Very low	25.9	Very low	189 Å²	189	150.7 Å²	150.7	88%	0.883	80%	0.804	S	S	*	*			trans	-148.1	118.3	173	-152.3	175.1	21.2	0	0	114.7
1408	L	25.1	Very low	25.8	Very low	149 Å²	149	147.8 Å²	147.8	78%	0.78	80%	0.801	S	S	*	*			trans	-159.4	155.2	159.1	-116.3	165	0	0	0	108.4
1409	E	24.8	Very low	25.6	Very low	172 Å²	172	148.9 Å²	148.9	80%	0.804	81%	0.81	S	S	*	*			trans	-129.1	-155.5	-151.1	-143.8	-159.3	-161.1	0	0	112.2
1410	P	43.1	Very low	25.5	Very low	102 Å²	102	146.9 Å²	146.9	66%	0.662	81%	0.811	S	S	*	*			trans	-112.8	-164.1	-139.9	40.9	-21.1	0	0	0	112.7
1411	R	26.3	Very low	25.6	Very low	256 Å²	256	148.3 Å²	148.3	97%	0.966	82%	0.821	S	S	*	*			trans	-165.7	153.5	149.5	-113.2	159.8	-175.8	-175.2	-0.2	113.3
1412	G	26.9	Very low	25.8	Very low	80 Å²	80	145.9 Å²	145.9	83%	0.825	82%	0.817	S	S	*	*			trans	-155.2	-39.4	-176.8	0	0	0	0	0	118.1
1413	S	23.3	Very low	25.9	Very low	113 Å²	113	145.9 Å²	145.9	79%	0.79	81%	0.813	S	S	*	*			trans	-156	120.2	-176.6	59.4	0	0	0	0	115.1
1414	H	25.4	Very low	25.9	Very low	180 Å²	180	146.8 Å²	146.8	83%	0.833	82%	0.82	S	S	*	*			trans	-163	124.3	159.4	-117.9	-81.8	0	0	0	109.4
1415	L	27.5	Very low	26	Very low	183 Å²	183	146.1 Å²	146.1	96%	0.958	82%	0.816	S	S	*	*			trans	-147.1	107	159.6	-102.1	176.4	0	0	0	109.2
1416	S	22.7	Very low	26	Very low	92 Å²	92	147.6 Å²	147.6	64%	0.643	81%	0.814	S	S	*	*			trans	-125.7	127.2	168.7	52.4	0	0	0	0	107.1	Q1418	S1416-Q1418 PolarHBondContact O-N 3.02Å
1417	V	26.9	Very low	26	Very low	155 Å²	155	149.3 Å²	149.3	94%	0.939	80%	0.798	S	S	*	*			trans	-62.9	133.9	-169	178.6	0	0	0	0	111.5
1418	Q	25.9	Very low	26.2	Very low	177 Å²	177	143.5 Å²	143.5	83%	0.827	78%	0.779	S	S	*	*			trans	-110.5	113.1	-173.2	-174.3	175	4.9	0	0	111.5	S1416	S1416-Q1418 PolarHBondContact O-N 3.02Å
1419	M	22.6	Very low	26.2	Very low	178 Å²	178	143.1 Å²	143.1	88%	0.877	77%	0.773	S	S	*	*			trans	-78.6	132.8	165.1	-83	-74.9	-157.6	0	0	110.2
1420	P	24.9	Very low	26.2	Very low	115 Å²	115	144.8 Å²	144.8	75%	0.747	77%	0.772	S	S	*	*			trans	-90.5	107	-176.5	33.1	-33.1	0	0	0	113
1421	S	24.8	Very low	25.4	Very low	122 Å²	122	145.6 Å²	145.6	85%	0.853	78%	0.78	S	S	*	*			trans	-87.7	135.1	163.1	56.9	0	0	0	0	110.5
1422	K	26.6	Very low	25.4	Very low	186 Å²	186	140 Å²	140	81%	0.809	77%	0.769	S	S	*	*			trans	-112.5	125.8	-179.7	-95	-171.8	175.3	-178.3	0	112.5
1423	H	27.6	Very low	25.3	Very low	161 Å²	161	141.3 Å²	141.3	75%	0.745	77%	0.773	S	S	*	*			trans	54.7	103.1	159.3	-66.4	-76.6	0	0	0	119.2
1424	S	22.6	Very low	25.3	Very low	115 Å²	115	141.2 Å²	141.2	80%	0.804	77%	0.772	S	S	*	*			trans	-71.4	142.3	134.6	54.8	0	0	0	0	110.8
1425	L	26.3	Very low	25.3	Very low	145 Å²	145	136.2 Å²	136.2	76%	0.759	77%	0.769	S	S	*	*			trans	-145.2	130.5	156.3	-105.7	170.8	0	0	0	107.3
1426	N	23.6	Very low	25.2	Very low	156 Å²	156	131.8 Å²	131.8	83%	0.834	76%	0.759	S	S	*	*			trans	-153.9	122	164.4	-155.8	7.1	0	0	0	109.4
1427	Y	26.4	Very low	25.3	Very low	109 Å²	109	132.5 Å²	132.5	43%	0.427	76%	0.764	S	S	.	*			trans	-107.4	138.1	175.1	-151.3	-62.1	0	0	0	108.4	N1748 Q1749	Y1427-N1748 PolarHBondContact OH-O 3.27Å; Y1427-Q1749 HydrophobicContact CD2-CB 4.27Å; Y1427-Q1749 HydrophobicContact CD2-CG 4.21Å; Y1427-Q1749 HydrophobicContact CE2-CB 3.53Å; Y1427-Q1749 VanDerWaalsContact CE2-CD 3.47Å; Y1427-Q1749 HydrophobicContact CE2-CG 3.47Å; Y1427-Q1749 VanDerWaalsContact CE2-CG 3.47Å; Y1427-Q1749 PolarHBondContact OH-N 3.14Å
1428	S	26.8	Very low	25.3	Very low	68 Å²	68	136.2 Å²	136.2	48%	0.476	76%	0.763	S	S	.	*			trans	-66	138.7	-176	59.5	0	0	0	0	114.4
1429	Q	25.5	Very low	25.1	Very low	141 Å²	141	132.8 Å²	132.8	66%	0.659	76%	0.758	S	S	*	*				55.1	151.3	119.8	-65.8	171.3	-25.9	0	0	120.1
1430	W	24.5	Very low	25.3	Very low	207 Å²	207	129 Å²	129	78%	0.784	75%	0.75	S	S	*	*			cis	-153.3	157.6	4.4	-100.2	-49.9	0	0	0	109.4
1431	S	25.4	Very low	25.3	Very low	119 Å²	119	130 Å²	130	83%	0.832	75%	0.748	S	S	*	*			trans	-150.4	88.5	142	64.3	0	0	0	0	111.8
1432	N	26.4	Very low	25.3	Very low	137 Å²	137	130.1 Å²	130.1	73%	0.733	74%	0.743	S	S	*	*			trans	13.6	113.8	156.3	-56.6	-6.5	0	0	0	119.9
1433	A	26.2	Very low	25.3	Very low	109 Å²	109	126.5 Å²	126.5	90%	0.901	74%	0.741	S	S	*	*			trans	-149.8	80.4	139.1	0	0	0	0	0	109
1434	S	23.1	Very low	25.3	Very low	111 Å²	111	124.9 Å²	124.9	78%	0.776	75%	0.745	S	S	*	*			trans	-113.5	108.5	-176.7	57	0	0	0	0	111.9
1435	G	25.4	Very low	25.6	Very low	75 Å²	75	123.9 Å²	123.9	77%	0.773	74%	0.738	S	S	*	*			trans	-90.6	118	162	0	0	0	0	0	110.1
1436	A	26.1	Very low	25.7	Very low	89 Å²	89	125.1 Å²	125.1	74%	0.736	74%	0.74	S	S	*	*			trans	-67.6	137.4	168.9	0	0	0	0	0	108.8
1437	S	23.5	Very low	26.1	Very low	107 Å²	107	121.8 Å²	121.8	75%	0.748	73%	0.725	S	S	*	*			cis	64.3	106.5	49.9	-56.2	0	0	0	0	113.4
1438	Y	26.2	Very low	26.5	Very low	233 Å²	233	122.5 Å²	122.5	91%	0.914	74%	0.737	S	S	*	*			trans	-135.4	123.2	148.9	-103.4	-77.4	0	0	0	110.3
1439	S	23.6	Very low	27	Very low	106 Å²	106	125 Å²	125	74%	0.741	74%	0.744	S	S	*	*			trans	-81.2	172.9	160.2	60.2	0	0	0	0	108.9
1440	S	24.8	Very low	27.3	Very low	99 Å²	99	125 Å²	125	69%	0.692	74%	0.744	S	S	*	*			cis	-162.6	152.9	19.2	51.8	0	0	0	0	111.2
1441	L	25.3	Very low	28	Very low	135 Å²	135	119.2 Å²	119.2	71%	0.707	73%	0.731	S	S	*	*			trans	-129.8	163.9	145.9	-103.8	172.6	0	0	0	110.6	E1325	E1325-L1441 WeakPolarHBondContact OE1-CD1 3.32Å
1442	V	26.4	Very low	28.3	Very low	124 Å²	124	116.2 Å²	116.2	75%	0.752	71%	0.713	S	S	*	*			trans	-108.5	142.6	-158.4	175.6	0	0	0	0	112.2
1443	S	25.2	Very low	28.7	Very low	110 Å²	110	112.6 Å²	112.6	77%	0.769	70%	0.703	S	S	*	*			trans	-133.1	153.4	164.5	-74.5	0	0	0	0	109.6
1444	P	27.8	Very low	29.3	Very low	128 Å²	128	113.8 Å²	113.8	83%	0.831	69%	0.69	S	S	*	*			trans	-76.1	165.5	-156.4	28.8	-36.1	0	0	0	115.6
1445	S	28.6	Very low	30.2	Very low	93 Å²	93	112.9 Å²	112.9	65%	0.65	68%	0.679	S	S	*	*			trans	-67	139	-174.6	50.1	0	0	0	0	114.2	T1447	S1445-T1447 VanDerWaalsContact C-N 3.27Å; S1445-T1447 PolarHBondContact O-N 3.1Å; S1445-T1447 PolarHBondContact O-OG1 2.71Å
1446	Q	29.6	Very low	30.6	Very low	172 Å²	172	112.1 Å²	112.1	80%	0.804	67%	0.666	S	S	*	*	S	Bend	trans	-76.9	61.2	-176.6	-166.2	176.3	17.3	0	0	113
1447	T	32.2	Very low	30.9	Very low	85 Å²	85	110.7 Å²	110.7	52%	0.521	65%	0.654	S	S	.	*			trans	-97.1	-35.1	-176.9	37.1	0	0	0	0	114.6	S1445	S1445-T1447 VanDerWaalsContact C-N 3.27Å; S1445-T1447 PolarHBondContact O-N 3.1Å; S1445-T1447 PolarHBondContact O-OG1 2.71Å
1448	D	34	Very low	31.5	Very low	125 Å²	125	108.3 Å²	108.3	67%	0.668	64%	0.641	S	S	*	*	H	α-helix	trans	-85.6	-26	-169.3	-55.1	-53.3	0	0	0	113.7	Q1450 V1451 A1452	D1448-Q1450 VanDerWaalsContact C-N 3.33Å; D1448-Q1450 PolarHBondContact O-N 3.41Å; D1448-V1451 PolarHBondContact O-N 2.91Å; D1448-A1452 WeakPolarHBondContact O-CB 3.38Å; D1448-A1452 PolarHBondContact O-N 3.04Å
1449	L	36.4	Very low	32	Very low	121 Å²	121	99.9 Å²	99.9	63%	0.634	62%	0.619	S	S	*	*	H	α-helix	trans	-66.8	-33.1	-177.6	-149.9	77.4	0	0	0	112.8	A1453	L1449-A1453 WeakPolarHBondContact O-CB 3.37Å; L1449-A1453 PolarHBondContact O-N 3.19Å; L1449-A1453 VanDerWaalsContact O-N 3.07Å
1450	Q	33	Very low	32.5	Very low	141 Å²	141	96.9 Å²	96.9	66%	0.659	60%	0.601	S	S	*	*	H	α-helix	trans	-78.2	-30.8	178.8	-164	167.6	26.1	0	0	112	D1448 Q1454	D1448-Q1450 VanDerWaalsContact C-N 3.33Å; D1448-Q1450 PolarHBondContact O-N 3.41Å; Q1450-Q1454 WeakPolarHBondContact O-CG 3.31Å; Q1450-Q1454 PolarHBondContact O-N 2.81Å
1451	V	38.3	Very low	32.9	Very low	84 Å²	84	96.7 Å²	96.7	51%	0.509	60%	0.595	S	S	.	*	H	α-helix	trans	-70.4	-45.2	170.8	179.8	0	0	0	0	110.1	D1448 A1453 Q1454 V1455	D1448-V1451 PolarHBondContact O-N 2.91Å; V1451-A1453 VanDerWaalsContact C-N 3.34Å; V1451-A1453 PolarHBondContact O-N 2.92Å; V1451-Q1454 PolarHBondContact O-N 3.46Å; V1451-Q1454 VanDerWaalsContact O-N 3.17Å; V1451-V1455 HydrophobicContact CG1-CG2 4.1Å; V1451-V1455 WeakPolarHBondContact O-CB 3.13Å; V1451-V1455 WeakPolarHBondContact O-CG2 3.35Å; V1451-V1455 PolarHBondContact O-N 3.3Å
1452	A	32.5	Very low	33.4	Very low	56 Å²	56	93.9 Å²	93.9	46%	0.463	58%	0.583	S	S	.	*	H	α-helix	trans	-56.7	-45.2	175.5	0	0	0	0	0	112.1	D1448 Q1454 V1455 A1456	D1448-A1452 WeakPolarHBondContact O-CB 3.38Å; D1448-A1452 PolarHBondContact O-N 3.04Å; A1452-Q1454 PolarHBondContact O-N 2.92Å; A1452-V1455 PolarHBondContact O-N 3.11Å; A1452-A1456 VanDerWaalsContact O-CB 3.24Å; A1452-A1456 WeakPolarHBondContact O-CB 3.46Å; A1452-A1456 PolarHBondContact O-N 3.27Å
1453	A	35.1	Very low	33.7	Very low	62 Å²	62	91.1 Å²	91.1	51%	0.512	57%	0.569	S	S	.	*	H	α-helix	trans	-63.3	-38.9	176.4	0	0	0	0	0	113.3	L1449 V1451 A1457	L1449-A1453 WeakPolarHBondContact O-CB 3.37Å; L1449-A1453 PolarHBondContact O-N 3.19Å; L1449-A1453 VanDerWaalsContact O-N 3.07Å; V1451-A1453 VanDerWaalsContact C-N 3.34Å; V1451-A1453 PolarHBondContact O-N 2.92Å; A1453-A1457 WeakPolarHBondContact O-CB 3.24Å; A1453-A1457 PolarHBondContact O-N 3.47Å
1454	Q	38.2	Very low	34.2	Very low	134 Å²	134	90.2 Å²	90.2	63%	0.626	56%	0.559	S	S	*	*	H	α-helix	trans	-74.1	-36.9	177.8	-74.1	-178	-16.5	0	0	112.8	Q1450 V1451 A1452 A1457 A1458	Q1450-Q1454 WeakPolarHBondContact O-CG 3.31Å; Q1450-Q1454 PolarHBondContact O-N 2.81Å; V1451-Q1454 PolarHBondContact O-N 3.46Å; V1451-Q1454 VanDerWaalsContact O-N 3.17Å; A1452-Q1454 PolarHBondContact O-N 2.92Å; Q1454-A1457 PolarHBondContact O-N 2.9Å; Q1454-A1458 WeakPolarHBondContact O-CB 3.3Å; Q1454-A1458 PolarHBondContact O-N 3.46Å
1455	V	42.2	Very low	34.5	Very low	92 Å²	92	88.3 Å²	88.3	56%	0.558	55%	0.545	S	S	*	.	H	α-helix	trans	-69.3	-40.3	174.8	172.6	0	0	0	0	110.9	V1451 A1452 A1458 A1459	V1451-V1455 HydrophobicContact CG1-CG2 4.1Å; V1451-V1455 WeakPolarHBondContact O-CB 3.13Å; V1451-V1455 WeakPolarHBondContact O-CG2 3.35Å; V1451-V1455 PolarHBondContact O-N 3.3Å; A1452-V1455 PolarHBondContact O-N 3.11Å; V1455-A1458 PolarHBondContact O-N 3.42Å; V1455-A1459 VanDerWaalsContact O-CB 3.31Å; V1455-A1459 WeakPolarHBondContact O-CB 3.41Å; V1455-A1459 PolarHBondContact O-N 3.03Å
1456	A	34.2	Very low	34.7	Very low	59 Å²	59	91.1 Å²	91.1	49%	0.488	55%	0.548	S	S	.	.	H	α-helix	trans	-63.5	-42.3	173.8	0	0	0	0	0	112.1	A1452 A1459 A1460	A1452-A1456 VanDerWaalsContact O-CB 3.24Å; A1452-A1456 WeakPolarHBondContact O-CB 3.46Å; A1452-A1456 PolarHBondContact O-N 3.27Å; A1456-A1459 PolarHBondContact O-N 2.82Å; A1456-A1460 WeakPolarHBondContact O-CB 3.34Å; A1456-A1460 PolarHBondContact O-N 3.38Å
1457	A	32.8	Very low	34.7	Very low	59 Å²	59	89.1 Å²	89.1	49%	0.488	54%	0.543	S	S	.	.	H	α-helix	trans	-63.7	-40.3	174.6	0	0	0	0	0	112.4	A1453 Q1454 V1461	A1453-A1457 WeakPolarHBondContact O-CB 3.24Å; A1453-A1457 PolarHBondContact O-N 3.47Å; Q1454-A1457 PolarHBondContact O-N 2.9Å; A1457-V1461 WeakPolarHBondContact O-CG2 3.26Å; A1457-V1461 PolarHBondContact O-N 2.84Å
1458	A	35.5	Very low	34.6	Very low	57 Å²	57	91.1 Å²	91.1	47%	0.471	55%	0.548	S	S	.	.	H	α-helix	trans	-66	-45	174.9	0	0	0	0	0	112.1	Q1454 V1455 A1460 V1461 V1462	Q1454-A1458 WeakPolarHBondContact O-CB 3.3Å; Q1454-A1458 PolarHBondContact O-N 3.46Å; V1455-A1458 PolarHBondContact O-N 3.42Å; A1458-A1460 PolarHBondContact O-N 2.78Å; A1458-V1461 PolarHBondContact O-N 3.09Å; A1458-V1462 WeakPolarHBondContact O-CG2 3.3Å; A1458-V1462 PolarHBondContact O-N 3.29Å
1459	A	35.8	Very low	34.3	Very low	56 Å²	56	92.7 Å²	92.7	46%	0.463	56%	0.556	S	S	.	*	H	α-helix	trans	-64.3	-39	178.8	0	0	0	0	0	112.5	V1455 A1456 V1462 S1463	V1455-A1459 VanDerWaalsContact O-CB 3.31Å; V1455-A1459 WeakPolarHBondContact O-CB 3.41Å; V1455-A1459 PolarHBondContact O-N 3.03Å; A1456-A1459 PolarHBondContact O-N 2.82Å; A1459-V1462 PolarHBondContact O-N 2.63Å; A1459-S1463 VanDerWaalsContact O-CB 3.29Å; A1459-S1463 WeakPolarHBondContact O-CB 3.36Å; A1459-S1463 PolarHBondContact O-N 2.87Å
1460	A	34.1	Very low	33.8	Very low	42 Å²	42	94.7 Å²	94.7	35%	0.347	57%	0.566	S	S	.	*	H	α-helix	trans	-64.2	-38.6	174.6	0	0	0	0	0	112.2	A1456 A1458 V1464	A1456-A1460 WeakPolarHBondContact O-CB 3.34Å; A1456-A1460 PolarHBondContact O-N 3.38Å; A1458-A1460 PolarHBondContact O-N 2.78Å; A1460-V1464 WeakPolarHBondContact O-CG2 3.24Å; A1460-V1464 PolarHBondContact O-N 3.31Å; A1460-V1464 VanDerWaalsContact O-N 3.16Å
1461	V	34.2	Very low	33.5	Very low	95 Å²	95	93.4 Å²	93.4	58%	0.576	57%	0.573	S	S	*	*	H	α-helix	trans	-67.5	-41.9	174.5	170.6	0	0	0	0	111.4	A1457 A1458 V1464 V1465	A1457-V1461 WeakPolarHBondContact O-CG2 3.26Å; A1457-V1461 PolarHBondContact O-N 2.84Å; A1458-V1461 PolarHBondContact O-N 3.09Å; V1461-V1464 PolarHBondContact O-N 3.34Å; V1461-V1465 HydrophobicContact CG1-CG2 4.44Å; V1461-V1465 WeakPolarHBondContact O-CB 3.14Å; V1461-V1465 VanDerWaalsContact O-CG2 3.26Å; V1461-V1465 WeakPolarHBondContact O-CG2 3.22Å; V1461-V1465 PolarHBondContact O-N 3.14Å
1462	V	35.9	Very low	32.9	Very low	76 Å²	76	95.9 Å²	95.9	46%	0.461	58%	0.583	S	S	.	*	H	α-helix	trans	-62.7	-47.4	175.5	172.9	0	0	0	0	111.1	A1458 A1459 V1464 V1465 E1466	A1458-V1462 WeakPolarHBondContact O-CG2 3.3Å; A1458-V1462 PolarHBondContact O-N 3.29Å; A1459-V1462 PolarHBondContact O-N 2.63Å; V1462-V1464 VanDerWaalsContact C-N 3.29Å; V1462-V1464 PolarHBondContact O-N 3.39Å; V1462-V1465 PolarHBondContact O-N 2.67Å; V1462-E1466 HydrophobicContact CG1-CG 4.08Å; V1462-E1466 WeakPolarHBondContact O-CG 3.13Å; V1462-E1466 PolarHBondContact O-N 3.49Å
1463	S	32.8	Very low	32.6	Very low	66 Å²	66	97.4 Å²	97.4	46%	0.462	60%	0.596	S	S	.	*	H	α-helix	trans	-57.2	-37.2	178.2	178.6	0	0	0	0	113.7	A1459 N1467	A1459-S1463 VanDerWaalsContact O-CB 3.29Å; A1459-S1463 WeakPolarHBondContact O-CB 3.36Å; A1459-S1463 PolarHBondContact O-N 2.87Å; S1463-N1467 PolarHBondContact O-ND2 2.9Å
1464	V	35.1	Very low	32.2	Very low	91 Å²	91	103 Å²	103	55%	0.552	61%	0.613	S	S	*	*	H	α-helix	trans	-78.3	-29.5	176.4	170.9	0	0	0	0	112.3	A1460 V1461 V1462 M1468	A1460-V1464 WeakPolarHBondContact O-CG2 3.24Å; A1460-V1464 PolarHBondContact O-N 3.31Å; A1460-V1464 VanDerWaalsContact O-N 3.16Å; V1461-V1464 PolarHBondContact O-N 3.34Å; V1462-V1464 VanDerWaalsContact C-N 3.29Å; V1462-V1464 PolarHBondContact O-N 3.39Å; V1464-M1468 HydrophobicContact CG1-CE 3.99Å; V1464-M1468 WeakPolarHBondContact O-CE 3.4Å
1465	V	33.7	Very low	31.6	Very low	88 Å²	88	101.8 Å²	101.8	53%	0.533	61%	0.611	S	S	.	*	H	α-helix	trans	-77.2	-38.8	176	168.8	0	0	0	0	111.9	V1461 V1462 N1467 M1468	V1461-V1465 HydrophobicContact CG1-CG2 4.44Å; V1461-V1465 WeakPolarHBondContact O-CB 3.14Å; V1461-V1465 VanDerWaalsContact O-CG2 3.26Å; V1461-V1465 WeakPolarHBondContact O-CG2 3.22Å; V1461-V1465 PolarHBondContact O-N 3.14Å; V1462-V1465 PolarHBondContact O-N 2.67Å; V1465-N1467 PolarHBondContact O-N 3.28Å; V1465-M1468 PolarHBondContact O-N 2.58Å
1466	E	33.1	Very low	30.9	Very low	152 Å²	152	105.9 Å²	105.9	71%	0.71	62%	0.624	S	S	*	*	H	α-helix	trans	-66.7	-19.4	178.4	-72.9	-177.7	142.4	0	0	113.5	V1462	V1462-E1466 HydrophobicContact CG1-CG 4.08Å; V1462-E1466 WeakPolarHBondContact O-CG 3.13Å; V1462-E1466 PolarHBondContact O-N 3.49Å
1467	N	30.7	Very low	30.5	Very low	131 Å²	131	108 Å²	108	70%	0.701	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	-3.4	175.5	-74.9	-77.5	0	0	0	114.3	S1463 V1465 N1469	S1463-N1467 PolarHBondContact O-ND2 2.9Å; V1465-N1467 PolarHBondContact O-N 3.28Å; N1467-N1469 PolarHBondContact O-N 2.83Å; N1467-N1469 VanDerWaalsContact O-N 3.16Å
1468	M	29	Very low	30	Very low	127 Å²	127	110.6 Å²	110.6	63%	0.626	66%	0.656	S	S	*	*			trans	-86.5	79.4	171	-85.7	-172.5	-80.8	0	0	110.8	V1464 V1465 L1470	V1464-M1468 HydrophobicContact CG1-CE 3.99Å; V1464-M1468 WeakPolarHBondContact O-CE 3.4Å; V1465-M1468 PolarHBondContact O-N 2.58Å; M1468-L1470 PolarHBondContact O-N 2.84Å
1469	N	26.9	Very low	29.5	Very low	157 Å²	157	113.5 Å²	113.5	84%	0.84	67%	0.673	S	S	*	*			trans	-74.1	63.6	175.7	-165.2	10.9	0	0	0	112.1	N1467	N1467-N1469 PolarHBondContact O-N 2.83Å; N1467-N1469 VanDerWaalsContact O-N 3.16Å
1470	L	26.9	Very low	29	Very low	163 Å²	163	117.8 Å²	117.8	85%	0.853	69%	0.687	S	S	*	*			trans	-98.4	97.8	170.8	-137.7	88	0	0	0	108.6	M1468 L1472	M1468-L1470 PolarHBondContact O-N 2.84Å; L1470-L1472 PolarHBondContact O-N 2.85Å
1471	S	27.6	Very low	28.5	Very low	114 Å²	114	122.1 Å²	122.1	80%	0.797	71%	0.705	S	S	*	*			trans	-61.9	118.1	-176.3	55.6	0	0	0	0	112
1472	L	24.4	Very low	28.1	Very low	136 Å²	136	124.6 Å²	124.6	71%	0.712	71%	0.714	S	S	*	*			trans	-76.8	128.5	-172.9	-172	79	0	0	0	113.5	L1470	L1470-L1472 PolarHBondContact O-N 2.85Å
1473	A	26.8	Very low	27.6	Very low	89 Å²	89	127.6 Å²	127.6	74%	0.736	73%	0.733	S	S	*	*			trans	-146	136.6	146.6	0	0	0	0	0	106.8
1474	M	26.1	Very low	27.3	Very low	178 Å²	178	128 Å²	128	88%	0.877	75%	0.747	S	S	*	*			cis	-114.4	160.4	24.4	-62.4	157.6	59	0	0	113.6
1475	N	25.3	Very low	26.8	Very low	109 Å²	109	130.3 Å²	130.3	58%	0.583	76%	0.756	S	S	*	*			trans	-112.2	167.1	174.9	-87.8	-40.7	0	0	0	112
1476	H	28.3	Very low	26.5	Very low	178 Å²	178	135.3 Å²	135.3	82%	0.824	77%	0.767	S	S	*	*			trans	77.4	144.8	170.4	-45.3	-67.8	0	0	0	115.7
1477	A	25.6	Very low	26.1	Very low	104 Å²	104	133.5 Å²	133.5	86%	0.86	77%	0.77	S	S	*	*			cis	-118.4	156.6	12	0	0	0	0	0	114.7
1478	S	21.4	Very low	25.9	Very low	114 Å²	114	135.4 Å²	135.4	80%	0.797	78%	0.779	S	S	*	*			trans	-143.3	128.6	172.6	52.7	0	0	0	0	110.7
1479	S	27	Very low	25.6	Very low	118 Å²	118	137.8 Å²	137.8	83%	0.825	79%	0.791	S	S	*	*			trans	178.1	139.8	-179.3	161.8	0	0	0	0	109.9
1480	L	24	Very low	25.6	Very low	145 Å²	145	136.2 Å²	136.2	76%	0.759	79%	0.789	S	S	*	*			cis	-161.5	157.5	-23.3	-141.1	130.4	0	0	0	109.5
1481	N	23.9	Very low	25.5	Very low	134 Å²	134	139.4 Å²	139.4	72%	0.717	79%	0.79	S	S	*	*			trans	-24.3	131.6	-178.7	-51.3	-21.8	0	0	0	120.8
1482	N	26.9	Very low	25.3	Very low	146 Å²	146	140.4 Å²	140.4	78%	0.781	79%	0.794	S	S	*	*				-167	120.1	115.5	-99.5	-31.8	0	0	0	110.8
1483	V	24.6	Very low	25.4	Very low	139 Å²	139	138.1 Å²	138.1	84%	0.842	79%	0.794	S	S	*	*				58.7	98.7	95.3	-179.5	0	0	0	0	112.9
1484	G	25.9	Very low	25.3	Very low	74 Å²	74	139.7 Å²	139.7	76%	0.763	80%	0.8	S	S	*	*			trans	-170.7	6.3	-172.4	0	0	0	0	0	122.1
1485	N	25.1	Very low	25.2	Very low	140 Å²	140	142.8 Å²	142.8	75%	0.749	80%	0.802	S	S	*	*			trans	61.1	139	164.8	-100.3	-8.3	0	0	0	122.4
1486	Y	26.8	Very low	25.2	Very low	194 Å²	194	142.8 Å²	142.8	76%	0.761	82%	0.817	S	S	*	*			trans	66.2	80.7	157.9	-60.4	-58.8	0	0	0	122.3
1487	C	24.2	Very low	25	Very low	114 Å²	114	139 Å²	139	77%	0.77	82%	0.817	S	S	*	*				20.7	134.5	113	-51.7	0	0	0	0	120.4
1488	L	28.1	Very low	25	Very low	171 Å²	171	139.5 Å²	139.5	90%	0.895	81%	0.814	S	S	*	*				-164.1	109	111.1	-107	167.9	0	0	0	112.4
1489	M	21.7	Very low	25.2	Very low	177 Å²	177	139.9 Å²	139.9	87%	0.872	81%	0.811	S	S	*	*			trans	-106.3	139	161.5	-86.9	-161.6	169.3	0	0	110.3
1490	P	27.9	Very low	25.3	Very low	123 Å²	123	141 Å²	141	80%	0.799	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-79.5	123.9	179.3	31.1	-33	0	0	0	112
1491	R	24	Very low	25.4	Very low	231 Å²	231	137.1 Å²	137.1	87%	0.872	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-75.2	142.7	170.5	-64	171.6	174.3	159.2	-5	110.8	A1493	R1491-A1493 PolarHBondContact O-N 2.88Å
1492	P	24.1	Very low	25.7	Very low	135 Å²	135	137.1 Å²	137.1	88%	0.877	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-64.1	119.2	154.4	-12.6	28.2	0	0	0	108.4
1493	A	25.3	Very low	25.8	Very low	88 Å²	88	136.3 Å²	136.3	73%	0.727	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-89.4	118.3	-175.3	0	0	0	0	0	111.7	R1491	R1491-A1493 PolarHBondContact O-N 2.88Å
1494	S	24.7	Very low	25.9	Very low	121 Å²	121	135.6 Å²	135.6	85%	0.846	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-65.9	140.2	160.6	45.9	0	0	0	0	110.3
1495	R	25.7	Very low	26.1	Very low	244 Å²	244	142.2 Å²	142.2	92%	0.921	81%	0.814	S	S	*	*			trans	-145.1	103.8	174.1	-102.7	-169.5	170.7	-163.5	-2.9	112.1
1496	A	23.5	Very low	26.2	Very low	108 Å²	108	142.5 Å²	142.5	89%	0.893	82%	0.815	S	S	*	*			trans	-140.5	80.5	156.9	0	0	0	0	0	108.2
1497	A	24.8	Very low	26.2	Very low	100 Å²	100	138.8 Å²	138.8	83%	0.826	81%	0.807	S	S	*	*			trans	-155.5	89.8	174.7	0	0	0	0	0	110.4
1498	S	25	Very low	26.3	Very low	114 Å²	114	140.9 Å²	140.9	80%	0.797	81%	0.811	S	S	*	*			trans	-78.3	156.4	145.7	-153.8	0	0	0	0	106.1
1499	V	27.1	Very low	26.2	Very low	122 Å²	122	141 Å²	141	74%	0.739	80%	0.804	S	S	*	*			cis	-156	142.6	45.4	175.6	0	0	0	0	109.7
1500	T	27.5	Very low	26.3	Very low	141 Å²	141	138.2 Å²	138.2	87%	0.865	79%	0.792	S	S	*	*				173	125.6	128.2	29.3	0	0	0	0	111.8
1501	G	27.1	Very low	26.1	Very low	63 Å²	63	141.2 Å²	141.2	65%	0.649	79%	0.788	S	S	*	*			trans	-118.4	163.8	163.7	0	0	0	0	0	110.5
1502	P	28.9	Very low	26.2	Very low	134 Å²	134	138.2 Å²	138.2	87%	0.87	79%	0.786	S	S	*	*			trans	-88.6	144.7	-177.9	34.3	-33.6	0	0	0	113.2
1503	T	28.9	Very low	26.2	Very low	130 Å²	130	137 Å²	137	80%	0.798	77%	0.768	S	S	*	*			trans	-127.2	150.5	-178.3	52.6	0	0	0	0	113.5
1504	T	28.3	Very low	26.2	Very low	124 Å²	124	139.1 Å²	139.1	76%	0.761	77%	0.768	S	S	*	*			trans	-170	146.3	165.8	37	0	0	0	0	109.4
1505	R	29.4	Very low	26.3	Very low	213 Å²	213	140.5 Å²	140.5	80%	0.804	76%	0.76	S	S	*	*			cis	-173.6	154.1	-23.3	-147.8	-177	-164.4	-172.4	4	108.5
1506	N	27.4	Very low	26.4	Very low	146 Å²	146	136.6 Å²	136.6	78%	0.781	76%	0.758	S	S	*	*			trans	133.9	157.4	154.8	-70.8	-5.2	0	0	0	113.9
1507	I	27.4	Very low	26.5	Very low	116 Å²	116	134.8 Å²	134.8	60%	0.595	75%	0.75	S	S	*	*				-175.6	152	-54	-102.3	165.4	0	0	0	110.3
1508	N	26.3	Very low	26.5	Very low	157 Å²	157	139.3 Å²	139.3	84%	0.84	75%	0.754	S	S	*	*			trans	71.4	144.3	-178.7	-54.6	-29.7	0	0	0	115.3
1509	K	26.2	Very low	26.4	Very low	173 Å²	173	138.1 Å²	138.1	75%	0.752	75%	0.746	S	S	*	*			cis	-144.3	161.2	4.8	-149.8	-171.1	151.2	-88.6	0	106.4
1510	L	24	Very low	26.3	Very low	120 Å²	120	139.6 Å²	139.6	63%	0.628	75%	0.747	S	S	*	*			cis	69.9	146	30.4	-83.3	68.6	0	0	0	113.5
1511	W	23	Very low	26.2	Very low	185 Å²	185	142.1 Å²	142.1	70%	0.701	75%	0.745	S	S	*	*			cis	-170.2	-172.3	-13	-115.9	-6.9	0	0	0	107.7	E1513	W1511-E1513 WeakPolarHBondContact CB-OE2 3.38Å; W1511-E1513 VanDerWaalsContact CD1-CD 3.45Å; W1511-E1513 VanDerWaalsContact CD1-OE2 3.22Å
1512	M	26	Very low	26	Very low	169 Å²	169	145.4 Å²	145.4	83%	0.833	75%	0.748	S	S	*	*			trans	78.2	100.4	-165.3	-43.2	-63.3	-71.2	0	0	111.9
1513	E	24.2	Very low	25.9	Very low	108 Å²	108	142.2 Å²	142.2	51%	0.505	74%	0.739	S	S	.	*			cis	69.6	139.3	32.3	-57.9	88.4	-113.6	0	0	114	W1511	W1511-E1513 WeakPolarHBondContact CB-OE2 3.38Å; W1511-E1513 VanDerWaalsContact CD1-CD 3.45Å; W1511-E1513 VanDerWaalsContact CD1-OE2 3.22Å
1514	N	24.3	Very low	25.8	Very low	134 Å²	134	144 Å²	144	72%	0.717	74%	0.743	S	S	*	*			cis	-100.3	-114.5	24.3	-39.9	-70.1	0	0	0	116.3
1515	E	27.2	Very low	25.6	Very low	149 Å²	149	145.5 Å²	145.5	70%	0.696	74%	0.739	S	S	*	*			cis	-156.1	-171.6	15.7	-129.2	75.1	-135.4	0	0	111.7
1516	D	27.5	Very low	25.4	Very low	162 Å²	162	141.2 Å²	141.2	87%	0.866	74%	0.737	S	S	*	*			trans	-57.6	154.3	-175	-53.6	-38.4	0	0	0	115.7
1517	G	26.3	Very low	25.5	Very low	71 Å²	71	139.4 Å²	139.4	73%	0.732	73%	0.733	S	S	*	*			cis	120.2	130.8	7.1	0	0	0	0	0	111.7
1518	E	25.5	Very low	25.4	Very low	194 Å²	194	145.3 Å²	145.3	91%	0.907	75%	0.748	S	S	*	*			cis	-151.2	-178	-3.7	-84.7	-155	126.6	0	0	110.9
1519	S	22.7	Very low	25.4	Very low	90 Å²	90	146 Å²	146	63%	0.629	75%	0.751	S	S	*	*			trans	-68.8	178.2	167.2	68.2	0	0	0	0	113.3
1520	M	24.3	Very low	25.4	Very low	153 Å²	153	142.5 Å²	142.5	75%	0.754	76%	0.755	S	S	*	*			cis	-170.7	167.3	31.5	-151.2	-174.8	-74.9	0	0	113
1521	K	24.9	Very low	25.6	Very low	193 Å²	193	142.1 Å²	142.1	84%	0.839	76%	0.763	S	S	*	*			trans	75.4	143.4	161.5	-67.3	-176.8	173.4	176.2	0	119.7
1522	L	23.2	Very low	25.9	Very low	133 Å²	133	140 Å²	140	70%	0.696	77%	0.77	S	S	*	*			trans	-115.2	149.2	170.1	-157.4	145.3	0	0	0	109
1523	G	27.7	Very low	26.1	Very low	67 Å²	67	135.7 Å²	135.7	69%	0.691	77%	0.769	S	S	*	*			trans	-158	95.4	-176.7	0	0	0	0	0	115.1
1524	L	26.6	Very low	26.4	Very low	166 Å²	166	139.8 Å²	139.8	87%	0.869	79%	0.788	S	S	*	*			trans	56.1	170	161.3	-97.1	68.6	0	0	0	119.3
1525	F	23.5	Very low	26.7	Very low	156 Å²	156	137.3 Å²	137.3	68%	0.684	79%	0.786	S	S	*	*			trans	-83.2	164	-170.6	-93.7	-131.7	0	0	0	113.9	L1319	L1319-F1525 HydrophobicContact CD1-CE2 4.37Å; L1319-F1525 HydrophobicContact CD1-CZ 4.21Å; L1319-F1525 HydrophobicContact CD2-CD1 4.41Å; L1319-F1525 HydrophobicContact CD2-CD2 3.46Å; L1319-F1525 VanDerWaalsContact CD2-CD2 3.46Å; L1319-F1525 HydrophobicContact CD2-CE1 4.37Å; L1319-F1525 HydrophobicContact CD2-CE2 3.41Å; L1319-F1525 VanDerWaalsContact CD2-CE2 3.41Å; L1319-F1525 HydrophobicContact CD2-CG 3.99Å; L1319-F1525 HydrophobicContact CD2-CZ 3.9Å; L1319-F1525 HydrophobicContact CG-CD2 4.18Å; L1319-F1525 HydrophobicContact CG-CE2 3.62Å; L1319-F1525 HydrophobicContact CG-CZ 3.96Å
1526	T	25.3	Very low	26.7	Very low	124 Å²	124	136.8 Å²	136.8	76%	0.761	79%	0.793	S	S	*	*			trans	-76.6	-175.6	-177.2	67.3	0	0	0	0	112
1527	P	30.4	Very low	26.9	Very low	108 Å²	108	134 Å²	134	70%	0.701	78%	0.784	S	S	*	*			cis	-134.3	162.2	-7.7	37.9	-22.1	0	0	0	115.5
1528	R	23.9	Very low	26.9	Very low	239 Å²	239	137.2 Å²	137.2	90%	0.902	79%	0.79	S	S	*	*				179.3	144.4	122.9	-102.3	170.9	179.6	-179	0.4	113.7
1529	N	26.4	Very low	27.1	Very low	171 Å²	171	132.4 Å²	132.4	91%	0.914	78%	0.783	S	S	*	*			trans	-75.7	133.4	163.5	-68.1	-13.3	0	0	0	110
1530	A	25.7	Very low	27.3	Very low	100 Å²	100	133.1 Å²	133.1	83%	0.826	79%	0.788	S	S	*	*			trans	-162.4	83.9	163	0	0	0	0	0	112.3	T1532	A1530-T1532 PolarHBondContact O-N 3.46Å
1531	S	29.1	Very low	27.5	Very low	113 Å²	113	132 Å²	132	79%	0.79	79%	0.789	S	S	*	*			trans	-87.3	97.3	164.2	56.2	0	0	0	0	110.5
1532	T	29.5	Very low	27.7	Very low	139 Å²	139	129.9 Å²	129.9	85%	0.853	79%	0.787	S	S	*	*			trans	39.2	109.8	145.5	56.8	0	0	0	0	119.3	A1530	A1530-T1532 PolarHBondContact O-N 3.46Å
1533	G	30.7	Very low	27.9	Very low	79 Å²	79	129.3 Å²	129.3	81%	0.814	79%	0.79	S	S	*	*			trans	-167.6	126.6	168.8	0	0	0	0	0	113.8
1534	Q	30.7	Very low	28	Very low	194 Å²	194	132.2 Å²	132.2	91%	0.907	79%	0.794	S	S	*	*			trans	-69.1	137.1	-161.2	-68.3	157.2	-58.1	0	0	118.3
1535	A	29.6	Very low	28	Very low	82 Å²	82	131.8 Å²	131.8	68%	0.678	79%	0.792	S	S	*	*				46	119.3	125.7	0	0	0	0	0	123.9
1536	T	27	Very low	28.3	Very low	138 Å²	138	128.9 Å²	128.9	85%	0.847	79%	0.789	S	S	*	*			trans	74.8	154.8	138.5	44.9	0	0	0	0	120.7
1537	P	32.1	Very low	28.4	Very low	103 Å²	103	130.1 Å²	130.1	67%	0.669	79%	0.791	S	S	*	*			trans	-129.6	-176.3	-138.8	45.3	-32.2	0	0	0	117.6
1538	T	26	Very low	28.1	Very low	140 Å²	140	132.3 Å²	132.3	86%	0.859	80%	0.796	S	S	*	*			trans	67.1	134	166.4	44.9	0	0	0	0	117
1539	A	29	Very low	28.2	Very low	93 Å²	93	130.2 Å²	130.2	77%	0.769	80%	0.797	S	S	*	*			cis	-152.9	-162.7	-2.4	0	0	0	0	0	108.5
1540	S	27.5	Very low	28.1	Very low	104 Å²	104	130 Å²	130	73%	0.727	79%	0.793	S	S	*	*			cis	-161.3	155.6	8.4	51.2	0	0	0	0	112.5
1541	V	27.9	Very low	28	Very low	129 Å²	129	131 Å²	131	78%	0.782	80%	0.795	S	S	*	*			trans	27.5	114	147.3	-175.2	0	0	0	0	119
1542	D	30	Very low	27.8	Very low	149 Å²	149	132 Å²	132	80%	0.797	80%	0.796	S	S	*	*				-152.2	162.4	113.3	-128.8	-30.9	0	0	0	113
1543	T	27.8	Very low	28.2	Very low	122 Å²	122	130.4 Å²	130.4	75%	0.748	79%	0.788	S	S	*	*			trans	-59.6	160	-173.3	52.9	0	0	0	0	115.2
1544	V	30	Very low	27.9	Very low	128 Å²	128	131.9 Å²	131.9	78%	0.776	79%	0.786	S	S	*	*			cis	-151.5	136.4	43.2	172.3	0	0	0	0	113.6
1545	D	24.9	Very low	28.3	Very low	156 Å²	156	127.7 Å²	127.7	83%	0.834	78%	0.776	S	S	*	*			trans	20.7	163	150.6	-85.7	-10.4	0	0	0	126.1
1546	P	30.8	Very low	28.2	Very low	95 Å²	95	131.1 Å²	131.1	62%	0.617	78%	0.781	S	S	*	*			trans	-126.5	-178.9	-154.1	44.2	-30.1	0	0	0	115.6
1547	N	27.4	Very low	28.3	Very low	150 Å²	150	128.1 Å²	128.1	80%	0.802	77%	0.766	S	S	*	*				178.3	163.9	115.5	-98.2	-64	0	0	0	114.1
1548	L	24.4	Very low	28.2	Very low	155 Å²	155	130.5 Å²	130.5	81%	0.812	77%	0.768	S	S	*	*			trans	-72.5	149.5	167.5	-74.6	64.5	0	0	0	110.6
1549	Q	26	Very low	28.5	Very low	195 Å²	195	129.8 Å²	129.8	91%	0.911	76%	0.755	S	S	*	*				-162.7	156.4	125.4	-112	169.5	26.7	0	0	113.5
1550	I	23.6	Very low	28.8	Very low	165 Å²	165	130 Å²	130	85%	0.846	74%	0.74	S	S	*	*			trans	-100.4	122.9	174.3	-63.8	166.9	0	0	0	107.7
1551	S	23.7	Very low	29	Very low	122 Å²	122	133.1 Å²	133.1	85%	0.853	74%	0.743	S	S	*	*			trans	-168.5	147.3	157.1	-85.3	0	0	0	0	112.8
1552	T	25.2	Very low	29.2	Very low	134 Å²	134	135.4 Å²	135.4	82%	0.822	74%	0.739	S	S	*	*			trans	-114.1	168.9	175.4	45.7	0	0	0	0	110
1553	P	37	Very low	29.2	Very low	106 Å²	106	133.2 Å²	133.2	69%	0.688	74%	0.735	S	S	*	*			cis	-139.4	166.3	-23.3	33.2	-14	0	0	0	116.1
1554	S	25.9	Very low	29.5	Very low	109 Å²	109	132.4 Å²	132.4	76%	0.762	73%	0.726	S	S	*	*			trans	69.8	162.5	145.5	76.6	0	0	0	0	120.9
1555	P	38	Very low	29.5	Very low	107 Å²	107	132.8 Å²	132.8	70%	0.695	72%	0.724	S	S	*	*			cis	-135.3	-164	-29	32	-10.7	0	0	0	114.3
1556	I	27.6	Very low	29.8	Very low	154 Å²	154	130.9 Å²	130.9	79%	0.79	72%	0.718	S	S	*	*			trans	81.1	139.8	161.9	-73.9	168.8	0	0	0	116
1557	S	28.6	Very low	29.7	Very low	75 Å²	75	132.3 Å²	132.3	52%	0.524	72%	0.72	S	S	.	*			cis	-172.4	-178.8	-15.7	62.8	0	0	0	0	112
1558	Q	31.6	Very low	29.8	Very low	152 Å²	152	130.9 Å²	130.9	71%	0.71	71%	0.712	S	S	*	*			trans	71.6	164.7	154.7	-74	178.9	90.7	0	0	118
1559	Q	31.3	Very low	30	Very low	125 Å²	125	129.6 Å²	129.6	58%	0.584	71%	0.706	S	S	*	*			cis	-158.5	175.4	-13.7	-111.5	-154.4	62.6	0	0	107.9
1560	Q	34.8	Very low	30.2	Very low	98 Å²	98	126.5 Å²	126.5	46%	0.458	70%	0.696	S	S	.	*			cis	-174.2	-157.8	-48.1	-106.7	178.6	0.4	0	0	111	N1579	Q1560-N1579 PolarHBondContact NE2-OD1 3.34Å; Q1560-N1579 VanDerWaalsContact OE1-CG 3.28Å; Q1560-N1579 PolarHBondContact OE1-ND2 3.49Å; Q1560-N1579 PolarHBondContact OE1-OD1 2.92Å
1561	Q	33	Very low	30.5	Very low	170 Å²	170	125.3 Å²	125.3	79%	0.794	69%	0.692	S	S	*	*			trans	75	165.2	176.1	-71.8	-177.5	-112.1	0	0	117
1562	Y	31.4	Very low	30.7	Very low	177 Å²	177	129.4 Å²	129.4	69%	0.694	69%	0.688	S	S	*	*			cis	-171.8	167.9	-46.7	-126.7	-91.1	0	0	0	104.2	N1564	Y1562-N1564 WeakPolarHBondContact CD1-OD1 3.19Å; Y1562-N1564 VanDerWaalsContact CE1-OD1 3.23Å; Y1562-N1564 WeakPolarHBondContact CE1-OD1 3.49Å
1563	S	31.2	Very low	30.8	Very low	103 Å²	103	129.7 Å²	129.7	72%	0.72	69%	0.685	S	S	*	*			cis	-161.4	-178.8	17.5	-32	0	0	0	0	107.2
1564	N	32.9	Very low	30.1	Very low	105 Å²	105	133.2 Å²	133.2	56%	0.561	69%	0.692	S	S	*	*			cis	-167.8	164.6	-22.9	-118.8	49.8	0	0	0	110.2	Y1562	Y1562-N1564 WeakPolarHBondContact CD1-OD1 3.19Å; Y1562-N1564 VanDerWaalsContact CE1-OD1 3.23Å; Y1562-N1564 WeakPolarHBondContact CE1-OD1 3.49Å
1565	D	30.5	Very low	30.2	Very low	135 Å²	135	135.9 Å²	135.9	72%	0.722	70%	0.697	S	S	*	*			trans	58.9	-155.2	148.9	-68	-41.8	0	0	0	118.9
1566	V	30	Very low	29.5	Very low	117 Å²	117	135 Å²	135	71%	0.709	69%	0.693	S	S	*	*				-140.6	150.3	-83.7	147.4	0	0	0	0	107.8
1567	N	30.3	Very low	29.5	Very low	125 Å²	125	134.5 Å²	134.5	67%	0.668	69%	0.691	S	S	*	*			cis	-126.1	-154.7	6.8	-142.2	0.2	0	0	0	109.8
1568	N	28	Very low	29.3	Very low	119 Å²	119	137.2 Å²	137.2	64%	0.636	70%	0.7	S	S	*	*			cis	-150.5	-172.6	14.1	-155.5	2.8	0	0	0	112.7
1569	N	29.8	Very low	29	Very low	128 Å²	128	134 Å²	134	68%	0.684	69%	0.688	S	S	*	*			trans	-39.3	135.1	174.3	-65.9	-12	0	0	0	115.1
1570	N	29.6	Very low	28.8	Very low	130 Å²	130	135.3 Å²	135.3	70%	0.695	69%	0.694	S	S	*	*	S	Bend	cis	-140.6	146.3	10.8	-85.3	-41.4	0	0	0	112.8
1571	N	30.1	Very low	28.5	Very low	140 Å²	140	139.7 Å²	139.7	75%	0.749	71%	0.714	S	S	*	*			trans	40.4	92.5	154.4	-57.7	-14.8	0	0	0	117.7
1572	R	28.3	Very low	28.2	Very low	209 Å²	209	139.2 Å²	139.2	79%	0.789	72%	0.716	S	S	*	*				60.6	124.8	64.5	-59.5	-170.9	168.5	165.6	-3	113.9
1573	N	27.7	Very low	28.1	Very low	140 Å²	140	139 Å²	139	75%	0.749	73%	0.727	S	S	*	*			cis	-145.1	136.9	0.1	-87.9	-19.4	0	0	0	112.1
1574	Q	22.7	Very low	28	Very low	180 Å²	180	136.5 Å²	136.5	84%	0.841	72%	0.716	S	S	*	*			trans	-121.1	177.8	139.5	-84.7	-170.8	-20.4	0	0	107.1
1575	L	26.8	Very low	27.9	Very low	165 Å²	165	136.4 Å²	136.4	86%	0.864	72%	0.724	S	S	*	*			trans	75.3	158.9	-175.7	-53.6	163.2	0	0	0	115
1576	S	24.4	Very low	27.9	Very low	87 Å²	87	138.9 Å²	138.9	61%	0.608	73%	0.729	S	S	*	*				-177.1	164.7	-54.1	53.4	0	0	0	0	110.2
1577	L	26.4	Very low	27.7	Very low	144 Å²	144	140.9 Å²	140.9	75%	0.754	73%	0.734	S	S	*	*			trans	66.2	115.8	171.4	-79.7	99	0	0	0	118.6
1578	N	25.7	Very low	27.6	Very low	133 Å²	133	139.8 Å²	139.8	71%	0.711	74%	0.736	S	S	*	*				39.4	116.5	129.8	-55.1	-9.2	0	0	0	119.5
1579	N	24.4	Very low	27.5	Very low	84 Å²	84	143 Å²	143	45%	0.449	75%	0.747	S	S	.	*				-155.2	159.1	95.1	-139.2	-12.7	0	0	0	116.5	Q1560	Q1560-N1579 PolarHBondContact NE2-OD1 3.34Å; Q1560-N1579 VanDerWaalsContact OE1-CG 3.28Å; Q1560-N1579 PolarHBondContact OE1-ND2 3.49Å; Q1560-N1579 PolarHBondContact OE1-OD1 2.92Å
1580	Q	26.6	Very low	27.3	Very low	152 Å²	152	146 Å²	146	71%	0.71	75%	0.754	S	S	*	*	S	Bend	trans	68.8	134.5	164.7	-65.6	-174.4	-13.2	0	0	120.7
1581	Q	28.5	Very low	27.2	Very low	190 Å²	190	146.5 Å²	146.5	89%	0.888	76%	0.757	S	S	*	*			trans	52.2	96.1	160.2	-67	-177.4	-37.8	0	0	119.2
1582	I	28	Very low	27	Very low	161 Å²	161	144 Å²	144	83%	0.826	76%	0.756	S	S	*	*			trans	-116.9	126	156.5	-65.2	175.1	0	0	0	108.8
1583	N	27.7	Very low	27.1	Very low	173 Å²	173	140.8 Å²	140.8	93%	0.925	76%	0.759	S	S	*	*			trans	-160.9	114	157.8	-117.7	-5.9	0	0	0	107.2
1584	G	29.5	Very low	27.4	Very low	49 Å²	49	139.4 Å²	139.4	51%	0.505	76%	0.758	S	S	.	*			cis	-178.6	-166.4	-4.5	0	0	0	0	0	111.1
1585	S	30.2	Very low	27.6	Very low	103 Å²	103	139 Å²	139	72%	0.72	76%	0.756	S	S	*	*			trans	67.7	149.1	176.6	78.6	0	0	0	0	116.2
1586	F	30.9	Very low	27.6	Very low	187 Å²	187	136.6 Å²	136.6	82%	0.82	75%	0.749	S	S	*	*			cis	-133.5	143.5	8.2	-89	-90.6	0	0	0	113
1587	I	25.6	Very low	27.6	Very low	160 Å²	160	141.1 Å²	141.1	82%	0.821	76%	0.757	S	S	*	*			trans	-142.3	124.5	152.8	-63.7	-177.4	0	0	0	109.1
1588	S	29.1	Very low	27.7	Very low	102 Å²	102	141.7 Å²	141.7	71%	0.713	76%	0.76	S	S	*	*			trans	160.5	134.6	153.8	36.5	0	0	0	0	107.1
1589	Q	25.8	Very low	27.8	Very low	186 Å²	186	142.5 Å²	142.5	87%	0.869	77%	0.765	S	S	*	*			cis	85.6	151.3	42.6	-70.4	-167	-26.1	0	0	114.8
1590	F	26.6	Very low	28	Very low	190 Å²	190	144.6 Å²	144.6	83%	0.833	78%	0.776	S	S	*	*			trans	-91.8	146.2	-155.5	-85.9	-115.2	0	0	0	115.1
1591	N	25.6	Very low	28.2	Very low	141 Å²	141	146.6 Å²	146.6	75%	0.754	78%	0.777	S	S	*	*			trans	52.9	111.1	139.9	-62.3	6.7	0	0	0	123.2
1592	A	26.8	Very low	28.2	Very low	88 Å²	88	147.4 Å²	147.4	73%	0.727	77%	0.773	S	S	*	*				67	104.2	114.8	0	0	0	0	0	123.5
1593	V	31.3	Very low	28.3	Very low	141 Å²	141	147.1 Å²	147.1	86%	0.855	77%	0.768	S	S	*	*				39.3	121.4	106.3	179.8	0	0	0	0	119.2
1594	P	34.1	Very low	28.3	Very low	112 Å²	112	145.5 Å²	145.5	73%	0.727	76%	0.755	S	S	*	*				-137.9	167.5	100.6	40	-26.7	0	0	0	112.5
1595	Q	26.8	Very low	28.2	Very low	172 Å²	172	148.5 Å²	148.5	80%	0.804	76%	0.759	S	S	*	*			cis	-158.9	148.6	43.3	-88.1	-176.4	-15.7	0	0	113.6
1596	T	26.8	Very low	28.1	Very low	114 Å²	114	153.4 Å²	153.4	70%	0.699	76%	0.764	S	S	*	*			trans	9.8	156.2	133.2	62.4	0	0	0	0	122.3
1597	K	24.5	Very low	28	Very low	181 Å²	181	151.5 Å²	151.5	79%	0.787	76%	0.762	S	S	*	*			cis	-166.6	176	5.2	-125.8	173.2	-178.2	178.7	0	112.9
1598	L	28	Very low	28.6	Very low	157 Å²	157	148.5 Å²	148.5	82%	0.822	75%	0.753	S	S	*	*			trans	85.4	144.5	161.7	-107.8	72.7	0	0	0	119.6
1599	D	26.2	Very low	28.7	Very low	150 Å²	150	150.4 Å²	150.4	80%	0.802	76%	0.755	S	S	*	*			trans	-113.8	155.9	-168.9	-46.2	-100.7	0	0	0	111.8
1600	D	29.9	Very low	28.9	Very low	127 Å²	127	152 Å²	152	68%	0.679	75%	0.753	S	S	*	*				-165.9	174.1	104.2	-134.9	-20.9	0	0	0	115.5
1601	R	30.3	Very low	29	Very low	195 Å²	195	147.7 Å²	147.7	74%	0.736	75%	0.746	S	S	*	*			trans	-79	139.1	-154.4	-76.1	158.6	-79.3	168.6	1.4	120.6
1602	Y	28.9	Very low	29.2	Very low	207 Å²	207	144.8 Å²	144.8	81%	0.812	74%	0.742	S	S	*	*				65.2	156.2	129.6	-84.6	-108.3	0	0	0	125.2
1603	H	29.7	Very low	29.4	Very low	154 Å²	154	148 Å²	148	71%	0.713	75%	0.747	S	S	*	*			trans	80.6	139	167.3	-68.3	-85.9	0	0	0	118.3
1604	Q	27.2	Very low	29.5	Very low	139 Å²	139	147.2 Å²	147.2	65%	0.65	75%	0.748	S	S	*	*			cis	-170.5	161.2	-23.9	-134.3	-177.3	-18.8	0	0	111.3
1605	N	27.9	Very low	29.4	Very low	113 Å²	113	150.3 Å²	150.3	60%	0.604	75%	0.752	S	S	*	*			trans	77.5	124.9	143.8	-69.8	-15.4	0	0	0	125.4
1606	Y	28.7	Very low	29.6	Very low	206 Å²	206	149.6 Å²	149.6	81%	0.808	75%	0.754	S	S	*	*			trans	85.6	83.7	133.9	-83.3	-114.6	0	0	0	124.1
1607	N	27.9	Very low	29.9	Very low	146 Å²	146	150.7 Å²	150.7	78%	0.781	75%	0.754	S	S	*	*				17.6	142.8	108.4	-154.4	31.8	0	0	0	121.7
1608	P	38.6	Very low	30.1	Very low	97 Å²	97	146.7 Å²	146.7	63%	0.63	75%	0.749	S	S	*	*			trans	-141.3	145.7	150	38.3	-22.7	0	0	0	118.3
1609	N	30.9	Very low	30.2	Very low	142 Å²	142	146 Å²	146	76%	0.759	75%	0.746	S	S	*	*			trans	73.6	143	155.4	-59.3	-34.4	0	0	0	120.3
1610	R	30.2	Very low	30.3	Very low	221 Å²	221	145.7 Å²	145.7	83%	0.834	74%	0.744	S	S	*	*			cis	-161.1	158.5	-9.6	-124.9	-176	-178.7	-177.8	-1.6	113.7
1611	S	29.2	Very low	30.2	Very low	98 Å²	98	150.4 Å²	150.4	69%	0.685	75%	0.754	S	S	*	*			trans	-11.5	160.7	151.5	55.2	0	0	0	0	121.8
1612	A	29.7	Very low	30.3	Very low	80 Å²	80	145.9 Å²	145.9	66%	0.661	76%	0.758	S	S	*	*			cis	-177.3	176.2	-13.9	0	0	0	0	0	111.5
1613	D	30.6	Very low	30.3	Very low	155 Å²	155	146.7 Å²	146.7	83%	0.829	76%	0.761	S	S	*	*			trans	60.6	112.3	154.4	-56.5	-27.1	0	0	0	123.9
1614	S	34.2	Very low	30.4	Very low	126 Å²	126	146.4 Å²	146.4	88%	0.881	76%	0.76	S	S	*	*				179.9	158.4	115.5	40.1	0	0	0	0	111.6
1615	Q	30.9	Very low	30.4	Very low	176 Å²	176	146.6 Å²	146.6	82%	0.822	76%	0.761	S	S	*	*			trans	-127.3	146.4	-169.7	-64.6	-179.4	-13.2	0	0	113.3
1616	N	31.8	Very low	30.4	Very low	158 Å²	158	149.2 Å²	149.2	85%	0.845	77%	0.77	S	S	*	*			trans	-158.9	81.5	155.1	-128.4	-10.2	0	0	0	114.2
1617	I	32	Very low	30.3	Very low	136 Å²	136	147.4 Å²	147.4	70%	0.697	77%	0.769	S	S	*	*				17.6	128.2	127.2	-61.1	171.7	0	0	0	115.6
1618	S	28.7	Very low	30.1	Very low	97 Å²	97	148 Å²	148	68%	0.678	77%	0.769	S	S	*	*			cis	-160.6	140.3	15.8	-128.2	0	0	0	0	113.3
1619	N	30.4	Very low	29.6	Very low	143 Å²	143	152.7 Å²	152.7	77%	0.765	78%	0.775	S	S	*	*				169.1	121.9	125.6	-88.5	-24.7	0	0	0	113.4
1620	L	28.2	Very low	29.4	Very low	143 Å²	143	151.4 Å²	151.4	75%	0.749	78%	0.775	S	S	*	*	S	Bend	trans	18.3	129	160.6	-56	90.9	0	0	0	120.2
1621	Y	29.1	Very low	29.3	Very low	226 Å²	226	146.3 Å²	146.3	89%	0.886	76%	0.763	S	S	*	*			cis	-157.4	157.2	-14.6	-121.4	-74.4	0	0	0	108.1
1622	A	30.5	Very low	29.4	Very low	100 Å²	100	150.1 Å²	150.1	83%	0.826	77%	0.769	S	S	*	*			trans	-87.4	167.2	-158.3	0	0	0	0	0	117.7
1623	Y	30.4	Very low	29.4	Very low	225 Å²	225	149 Å²	149	88%	0.882	77%	0.766	S	S	*	*			trans	-93.9	164.1	178.4	-127.5	-105.3	0	0	0	112.3
1624	Q	30.6	Very low	29.5	Very low	148 Å²	148	147.9 Å²	147.9	69%	0.692	77%	0.767	S	S	*	*			trans	118.5	119.7	136.1	-158.9	160.1	-24.1	0	0	120.7
1625	Q	28.6	Very low	29.4	Very low	142 Å²	142	153.7 Å²	153.7	66%	0.664	77%	0.769	S	S	*	*			trans	64.3	106.2	149.8	-76.1	164.7	-17.7	0	0	124.3
1626	Q	27.2	Very low	29.3	Very low	168 Å²	168	148.4 Å²	148.4	79%	0.785	76%	0.762	S	S	*	*				76.3	137.8	122.1	-67.2	-175.5	0.7	0	0	123.5
1627	Q	26.7	Very low	29.4	Very low	169 Å²	169	146.4 Å²	146.4	79%	0.79	76%	0.758	S	S	*	*			trans	76	102.2	167.7	-53.8	-154.3	15.2	0	0	120.1
1628	M	22.6	Very low	29.4	Very low	159 Å²	159	150.2 Å²	150.2	78%	0.783	77%	0.765	S	S	*	*			trans	49.9	107	150.1	-63.8	-165.9	-76	0	0	121.8
1629	Y	28.2	Very low	29.2	Very low	194 Å²	194	150.3 Å²	150.3	76%	0.761	77%	0.765	S	S	*	*			trans	42.6	130.7	142	-63.2	-74.8	0	0	0	120.5	I1631	Y1629-I1631 HydrophobicContact CD1-CD1 3.68Å; Y1629-I1631 HydrophobicContact CD1-CG1 4.09Å; Y1629-I1631 HydrophobicContact CE1-CD1 4.07Å
1630	P	26.7	Very low	28.9	Very low	116 Å²	116	148.8 Å²	148.8	75%	0.753	76%	0.761	S	S	*	*			cis	-125.8	173	46.7	42.5	-29.1	0	0	0	112.3
1631	I	28.3	Very low	28.9	Very low	114 Å²	114	150 Å²	150	59%	0.585	76%	0.761	S	S	*	*			cis	69.5	128.8	38.2	-60.1	168.8	0	0	0	111.7	Y1629	Y1629-I1631 HydrophobicContact CD1-CD1 3.68Å; Y1629-I1631 HydrophobicContact CD1-CG1 4.09Å; Y1629-I1631 HydrophobicContact CE1-CD1 4.07Å
1632	H	31.6	Very low	28.7	Very low	178 Å²	178	146.2 Å²	146.2	82%	0.824	76%	0.755	S	S	*	*			cis	-91.4	-172.8	-1.2	-64.1	-91.8	0	0	0	111.3
1633	G	29.1	Very low	28.4	Very low	57 Å²	57	146.5 Å²	146.5	59%	0.588	75%	0.75	S	S	*	*			cis	102.8	162.1	2.5	0	0	0	0	0	113.7
1634	P	34.7	Very low	28.6	Very low	130 Å²	130	140.7 Å²	140.7	84%	0.844	74%	0.741	S	S	*	*			cis	-75.4	-156	-10.6	37.1	-37.9	0	0	0	110.6
1635	R	30.8	Very low	28.5	Very low	248 Å²	248	139.9 Å²	139.9	94%	0.936	75%	0.746	S	S	*	*			cis	-160.1	147.1	8.9	-161.8	176.5	-172.2	165.4	1.6	107.7
1636	G	29.5	Very low	28.5	Very low	65 Å²	65	137.2 Å²	137.2	67%	0.67	74%	0.743	S	S	*	*			cis	-169.8	155.6	-9.6	0	0	0	0	0	109
1637	P	34.2	Very low	28.6	Very low	117 Å²	117	137.8 Å²	137.8	76%	0.76	75%	0.746	S	S	*	*			trans	-105.1	155.5	-157.7	38.3	-34.4	0	0	0	115.3
1638	Y	31.1	Very low	28.7	Very low	216 Å²	216	134.9 Å²	134.9	85%	0.847	74%	0.74	S	S	*	*			trans	-142.5	140.8	156.6	-92.3	-75.5	0	0	0	112.8
1639	S	24.2	Very low	28.9	Very low	98 Å²	98	133.6 Å²	133.6	69%	0.685	74%	0.736	S	S	*	*			trans	-125.2	169.8	148.6	64	0	0	0	0	107.3
1640	T	24.7	Very low	28.9	Very low	111 Å²	111	131.6 Å²	131.6	68%	0.681	74%	0.737	S	S	*	*			trans	74.8	171.9	-175.5	77.5	0	0	0	0	116.1
1641	F	28.2	Very low	29	Very low	170 Å²	170	131.2 Å²	131.2	75%	0.746	74%	0.737	S	S	*	*			trans	71.2	128.1	-168.1	-56.7	-77.5	0	0	0	114.7
1642	I	24.7	Very low	29	Very low	145 Å²	145	130.7 Å²	130.7	74%	0.744	74%	0.743	S	S	*	*			cis	73.2	95.8	18.1	-48.9	-176.3	0	0	0	114.8
1643	S	23.7	Very low	29.2	Very low	106 Å²	106	127.3 Å²	127.3	74%	0.741	74%	0.737	S	S	*	*			trans	73.2	177.4	151.7	-51.7	0	0	0	0	116.3
1644	P	35.9	Very low	29.2	Very low	104 Å²	104	129.1 Å²	129.1	68%	0.675	74%	0.741	S	S	*	*				-135.5	-163.6	-83.9	41.8	-24.4	0	0	0	113
1645	T	27.7	Very low	28.9	Very low	131 Å²	131	129.7 Å²	129.7	80%	0.804	74%	0.737	S	S	*	*			trans	66	145.3	163.3	46.8	0	0	0	0	117.2
1646	S	29.8	Very low	28.7	Very low	86 Å²	86	125.3 Å²	125.3	60%	0.601	73%	0.731	S	S	*	*			cis	-169.4	140.1	-9.8	43.9	0	0	0	0	110.5
1647	Q	29.1	Very low	28.8	Very low	180 Å²	180	128.5 Å²	128.5	84%	0.841	74%	0.743	S	S	*	*			trans	59.5	150.2	145.6	-62.6	173.8	-11.5	0	0	118.7
1648	T	27.2	Very low	28.4	Very low	108 Å²	108	126 Å²	126	66%	0.663	74%	0.738	S	S	*	*			cis	-166.6	142.9	-19.8	21.8	0	0	0	0	106.4
1649	N	28.6	Very low	28.4	Very low	132 Å²	132	122.7 Å²	122.7	71%	0.706	74%	0.735	S	S	*	*				163.3	136.9	126.4	-85.3	-24.5	0	0	0	113.9
1650	I	27.9	Very low	28.6	Very low	151 Å²	151	125.6 Å²	125.6	77%	0.774	74%	0.738	S	S	*	*				41.7	121.5	125.6	-51.3	166.8	0	0	0	116.3
1651	S	29.1	Very low	29	Very low	108 Å²	108	128.5 Å²	128.5	76%	0.755	74%	0.744	S	S	*	*			cis	-157	169.3	26	54.3	0	0	0	0	115.2
1652	S	26.5	Very low	29	Very low	104 Å²	104	127.9 Å²	127.9	73%	0.727	75%	0.749	S	S	*	*			trans	-77.3	-178.8	155.4	57	0	0	0	0	111.6
1653	P	37.1	Very low	29.4	Very low	107 Å²	107	125.8 Å²	125.8	70%	0.695	74%	0.744	S	S	*	*			cis	-142.2	179.9	7.9	40.4	-19	0	0	0	118.4
1654	S	28.2	Very low	29.6	Very low	94 Å²	94	125.5 Å²	125.5	66%	0.657	74%	0.742	S	S	*	*			trans	67.7	127.3	140.1	64.6	0	0	0	0	124.8
1655	N	28.5	Very low	29.3	Very low	142 Å²	142	127.3 Å²	127.3	76%	0.759	75%	0.746	S	S	*	*			trans	102.9	115.5	131	-72.3	2.3	0	0	0	123.7
1656	L	27.1	Very low	29.4	Very low	157 Å²	157	129.1 Å²	129.1	82%	0.822	75%	0.747	S	S	*	*			trans	48.4	113.2	137.1	-77.6	78.5	0	0	0	121.4
1657	S	30.7	Very low	29.4	Very low	132 Å²	132	128.6 Å²	128.6	92%	0.923	75%	0.748	S	S	*	*				-154.3	178.2	109.3	70	0	0	0	0	109.3
1658	G	27.4	Very low	29.6	Very low	64 Å²	64	128.3 Å²	128.3	66%	0.66	74%	0.74	S	S	*	*			trans	177.3	172.7	172.7	0	0	0	0	0	113.4
1659	N	29.7	Very low	29.9	Very low	146 Å²	146	131.1 Å²	131.1	78%	0.781	74%	0.74	S	S	*	*			trans	-166.3	136	149.8	-114.3	11.3	0	0	0	113.3
1660	E	28.8	Very low	30	Very low	159 Å²	159	134.4 Å²	134.4	74%	0.743	74%	0.742	S	S	*	*			trans	60.7	159.8	144	-58.4	-170.4	159.8	0	0	124.1
1661	Q	33.8	Very low	30.2	Very low	173 Å²	173	132.9 Å²	132.9	81%	0.808	73%	0.734	S	S	*	*			trans	76.6	78.6	164.9	-47.4	-155.9	7.1	0	0	119.7
1662	N	27.1	Very low	30.3	Very low	157 Å²	157	131.9 Å²	131.9	84%	0.84	72%	0.72	S	S	*	*				31.5	155.3	112.3	-84.1	-13.3	0	0	0	121.7
1663	P	33.5	Very low	30.6	Very low	101 Å²	101	130 Å²	130	66%	0.656	71%	0.711	S	S	*	*			cis	-142.1	-172.3	-22.2	34.5	-12.1	0	0	0	115
1664	S	27.2	Very low	30.4	Very low	99 Å²	99	132.5 Å²	132.5	69%	0.692	71%	0.713	S	S	*	*	S	Bend	trans	52.3	63.3	144.2	65.1	0	0	0	0	120.7
1665	L	29.7	Very low	30.5	Very low	143 Å²	143	131.5 Å²	131.5	75%	0.749	70%	0.701	S	S	*	*	S	Bend	trans	-145.8	-30.4	141.9	-147	71.7	0	0	0	114.2	A1667	L1665-A1667 PolarHBondContact O-N 3.22Å
1666	M	31.2	Very low	30.7	Very low	168 Å²	168	132.2 Å²	132.2	83%	0.828	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	3.2	179.6	-70.5	-166.3	176.5	0	0	115.9
1667	A	29.4	Very low	31	Very low	75 Å²	75	133 Å²	133	62%	0.62	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-38.3	171.4	0	0	0	0	0	112.2	L1665 R1670	L1665-A1667 PolarHBondContact O-N 3.22Å; A1667-R1670 PolarHBondContact O-N 3.14Å
1668	Y	32.1	Very low	31.2	Very low	174 Å²	174	131 Å²	131	68%	0.682	68%	0.68	S	S	*	*	H	α-helix	trans	-66.7	-43.5	-177.1	-161.7	-106.1	0	0	0	112	R1670 I1671 L1672	Y1668-R1670 VanDerWaalsContact C-N 3.27Å; Y1668-R1670 PolarHBondContact O-N 3.4Å; Y1668-I1671 PolarHBondContact O-N 3Å; Y1668-L1672 HydrophobicContact CD1-CD1 3.85Å; Y1668-L1672 HydrophobicContact CE1-CD1 3.72Å; Y1668-L1672 PolarHBondContact O-N 3.24Å
1669	Y	34.1	Very low	31.5	Very low	167 Å²	167	132 Å²	132	66%	0.655	67%	0.669	S	S	*	*	H	α-helix	trans	-69.9	-14.3	-179.3	-80.1	-76.5	0	0	0	115.1	A1673	Y1669-A1673 PolarHBondContact O-N 3.5Å
1670	R	31.6	Very low	31.9	Very low	202 Å²	202	135.4 Å²	135.4	76%	0.762	67%	0.671	S	S	*	*	H	α-helix	trans	-81.8	-23.9	171.5	-77.8	-174.5	171.3	170.6	-0.4	113.7	A1667 Y1668	A1667-R1670 PolarHBondContact O-N 3.14Å; Y1668-R1670 VanDerWaalsContact C-N 3.27Å; Y1668-R1670 PolarHBondContact O-N 3.4Å
1671	I	31.6	Very low	32.4	Very low	118 Å²	118	133.8 Å²	133.8	61%	0.605	66%	0.664	S	S	*	*	H	α-helix	trans	-80.5	-29.6	173.5	-64.3	177.6	0	0	0	111.2	Y1668 N1675	Y1668-I1671 PolarHBondContact O-N 3Å; I1671-N1675 PolarHBondContact O-ND2 2.87Å
1672	L	31.6	Very low	32.5	Very low	88 Å²	88	130.7 Å²	130.7	46%	0.461	65%	0.647	S	S	.	*	H	α-helix	trans	-72.6	-30.7	172.3	-85.4	155.7	0	0	0	113.5	Y1668 N1675	Y1668-L1672 HydrophobicContact CD1-CD1 3.85Å; Y1668-L1672 HydrophobicContact CE1-CD1 3.72Å; Y1668-L1672 PolarHBondContact O-N 3.24Å; L1672-N1675 PolarHBondContact O-N 2.71Å
1673	A	31.3	Very low	33.1	Very low	65 Å²	65	129.5 Å²	129.5	54%	0.537	64%	0.641	S	S	.	*	H	α-helix	trans	-69.3	-38	177.7	0	0	0	0	0	113.7	Y1669 N1675 Q1676	Y1669-A1673 PolarHBondContact O-N 3.5Å; A1673-N1675 VanDerWaalsContact C-N 3.25Å; A1673-N1675 PolarHBondContact O-N 2.74Å; A1673-Q1676 PolarHBondContact O-N 2.86Å
1674	Q	33.7	Very low	33.5	Very low	159 Å²	159	131.7 Å²	131.7	74%	0.743	64%	0.642	S	S	*	*	H	α-helix	trans	-71.6	-18.1	177.8	-76.1	-176.1	-37.4	0	0	113.5	Q1676	Q1674-Q1676 VanDerWaalsContact C-N 3.31Å; Q1674-Q1676 PolarHBondContact O-N 2.82Å
1675	N	31.2	Very low	34.4	Very low	72 Å²	72	132.6 Å²	132.6	39%	0.385	64%	0.635	S	S	.	*	H	α-helix	trans	-78.9	-5.6	178.3	-86.5	-71.5	0	0	0	114.7	I1671 L1672 A1673 N1679	I1671-N1675 PolarHBondContact O-ND2 2.87Å; L1672-N1675 PolarHBondContact O-N 2.71Å; A1673-N1675 VanDerWaalsContact C-N 3.25Å; A1673-N1675 PolarHBondContact O-N 2.74Å; N1675-N1679 PolarHBondContact O-ND2 3.15Å
1676	Q	32.8	Very low	34.8	Very low	158 Å²	158	131.9 Å²	131.9	74%	0.738	63%	0.626	S	S	*	*	H	α-helix	trans	-93.2	-26.6	177.8	-71.4	-170.4	-20.4	0	0	114.5	A1673 Q1674	A1673-Q1676 PolarHBondContact O-N 2.86Å; Q1674-Q1676 VanDerWaalsContact C-N 3.31Å; Q1674-Q1676 PolarHBondContact O-N 2.82Å
1677	M	31.7	Very low	35.4	Very low	172 Å²	172	130.2 Å²	130.2	85%	0.847	62%	0.616	S	S	*	*	H	α-helix	trans	-73.5	-31.8	169.9	-71.7	-162.9	178.9	0	0	112.5	N1679	M1677-N1679 PolarHBondContact O-N 2.84Å
1678	L	35.2	Very low	36.1	Very low	92 Å²	92	132.9 Å²	132.9	48%	0.482	62%	0.616	S	S	.	*	H	α-helix	trans	-68.2	-20.8	177	-164.8	61.9	0	0	0	113.1	K1682	L1678-K1682 PolarHBondContact O-N 3.13Å
1679	N	33.4	Very low	36.6	Very low	83 Å²	83	131.9 Å²	131.9	44%	0.444	61%	0.612	S	S	.	*	H	α-helix	trans	-90.8	-15.8	-171.9	-88.8	-48.3	0	0	0	116	N1675 M1677 L1683	N1675-N1679 PolarHBondContact O-ND2 3.15Å; M1677-N1679 PolarHBondContact O-N 2.84Å; N1679-L1683 WeakPolarHBondContact O-CB 3.47Å; N1679-L1683 PolarHBondContact O-N 3.48Å; N1679-L1683 VanDerWaalsContact O-N 3.17Å
1680	R	38.1	Very low	37.2	Very low	218 Å²	218	128.4 Å²	128.4	82%	0.823	60%	0.602	S	S	*	*	H	α-helix	trans	-70.6	-39.8	164.9	-84.7	-170.2	173.5	-172.2	-1	111.7	L1683 Q1684	R1680-L1683 PolarHBondContact O-N 3.09Å; R1680-Q1684 PolarHBondContact O-N 2.81Å
1681	H	39.9	Very low	38.2	Very low	126 Å²	126	124.1 Å²	124.1	58%	0.583	59%	0.593	S	S	*	*	H	α-helix	trans	-66.9	-40.9	174.9	-105.9	-69.1	0	0	0	112.6	L1683 Q1685	H1681-L1683 VanDerWaalsContact C-N 3.34Å; H1681-L1683 PolarHBondContact O-N 3.23Å; H1681-Q1685 WeakPolarHBondContact O-CB 3.32Å; H1681-Q1685 WeakPolarHBondContact O-CG 3.35Å; H1681-Q1685 PolarHBondContact O-N 3.06Å
1682	K	35.5	Very low	39.1	Very low	107 Å²	107	122.4 Å²	122.4	47%	0.465	58%	0.584	S	S	.	*	H	α-helix	trans	-61.7	-37.3	173.6	-76.4	-179.4	174.2	-177.9	0	112.9	L1678 Q1685 F1686	L1678-K1682 PolarHBondContact O-N 3.13Å; K1682-Q1685 PolarHBondContact O-N 3.46Å; K1682-F1686 WeakPolarHBondContact O-CB 3.29Å; K1682-F1686 PolarHBondContact O-N 3.28Å
1683	L	39.5	Very low	39.7	Very low	133 Å²	133	122 Å²	122	70%	0.696	58%	0.58	S	S	*	*	H	α-helix	trans	-70.7	-39.8	-178.2	-156.4	71.7	0	0	0	113	N1679 R1680 H1681 F1686 H1687	N1679-L1683 WeakPolarHBondContact O-CB 3.47Å; N1679-L1683 PolarHBondContact O-N 3.48Å; N1679-L1683 VanDerWaalsContact O-N 3.17Å; R1680-L1683 PolarHBondContact O-N 3.09Å; H1681-L1683 VanDerWaalsContact C-N 3.34Å; H1681-L1683 PolarHBondContact O-N 3.23Å; L1683-F1686 PolarHBondContact O-N 2.87Å; L1683-H1687 PolarHBondContact O-N 3.14Å
1684	Q	42.9	Very low	40.6	Very low	147 Å²	147	125.6 Å²	125.6	69%	0.687	59%	0.586	S	S	*	*	H	α-helix	trans	-68.1	-39.3	171.5	-80.9	-176.2	-34.4	0	0	112.2	R1680 F1686 Q1688	R1680-Q1684 PolarHBondContact O-N 2.81Å; Q1684-F1686 PolarHBondContact O-N 3.39Å; Q1684-Q1688 PolarHBondContact O-N 2.68Å
1685	Q	45.2	Very low	41.3	Very low	118 Å²	118	123.9 Å²	123.9	55%	0.551	58%	0.578	S	S	*	*	H	α-helix	trans	-61.3	-42.3	172.8	-78	-179.4	-16.3	0	0	111.9	H1681 K1682 H1687 Q1688 Y1689	H1681-Q1685 WeakPolarHBondContact O-CB 3.32Å; H1681-Q1685 WeakPolarHBondContact O-CG 3.35Å; H1681-Q1685 PolarHBondContact O-N 3.06Å; K1682-Q1685 PolarHBondContact O-N 3.46Å; Q1685-H1687 PolarHBondContact O-N 3.03Å; Q1685-Q1688 PolarHBondContact O-N 3.01Å; Q1685-Y1689 WeakPolarHBondContact O-CB 3.39Å; Q1685-Y1689 PolarHBondContact O-N 3.17Å
1686	F	39	Very low	42.1	Very low	128 Å²	128	125 Å²	125	56%	0.561	58%	0.581	S	S	*	*	H	α-helix	trans	-63.9	-41.3	-178.2	-158.7	-91.4	0	0	0	112.4	K1682 L1683 Q1684 Y1689 Q1690	K1682-F1686 WeakPolarHBondContact O-CB 3.29Å; K1682-F1686 PolarHBondContact O-N 3.28Å; L1683-F1686 PolarHBondContact O-N 2.87Å; Q1684-F1686 PolarHBondContact O-N 3.39Å; F1686-Y1689 WeakPolarHBondContact O-CB 3.16Å; F1686-Y1689 PolarHBondContact O-N 3.35Å; F1686-Q1690 HydrophobicContact CD1-CG 4.11Å; F1686-Q1690 HydrophobicContact CE1-CG 4.03Å; F1686-Q1690 WeakPolarHBondContact O-CG 3.44Å; F1686-Q1690 PolarHBondContact O-N 3.03Å
1687	H	44.1	Very low	42.6	Very low	133 Å²	133	122.9 Å²	122.9	62%	0.616	57%	0.571	S	S	*	*	H	α-helix	trans	-70.3	-34.5	178.3	-140.6	45.1	0	0	0	112.2	L1683 Q1685 Q1690 L1691	L1683-H1687 PolarHBondContact O-N 3.14Å; Q1685-H1687 PolarHBondContact O-N 3.03Å; H1687-Q1690 PolarHBondContact ND1-OE1 3.18Å; H1687-Q1690 PolarHBondContact O-N 3.09Å; H1687-L1691 PolarHBondContact O-N 2.79Å
1688	Q	44.4	Very low	43.2	Very low	131 Å²	131	123 Å²	123	61%	0.612	57%	0.569	S	S	*	*	H	α-helix	trans	-67.8	-36.1	170.1	-161.9	171.9	23.4	0	0	111.8	Q1684 Q1685 I1692	Q1684-Q1688 PolarHBondContact O-N 2.68Å; Q1685-Q1688 PolarHBondContact O-N 3.01Å; Q1688-I1692 HydrophobicContact CG-CD1 4.21Å; Q1688-I1692 VanDerWaalsContact O-CG1 3.32Å; Q1688-I1692 WeakPolarHBondContact O-CG1 3.44Å; Q1688-I1692 PolarHBondContact O-N 2.87Å; Q1688-I1692 VanDerWaalsContact O-N 3.17Å
1689	Y	42.1	Very low	43.4	Very low	152 Å²	152	127.9 Å²	127.9	60%	0.596	58%	0.581	S	S	*	*	H	α-helix	trans	-65.9	-39.6	175.1	-142.8	-103	0	0	0	111.8	Q1685 F1686 I1692 Q1693	Q1685-Y1689 WeakPolarHBondContact O-CB 3.39Å; Q1685-Y1689 PolarHBondContact O-N 3.17Å; F1686-Y1689 WeakPolarHBondContact O-CB 3.16Å; F1686-Y1689 PolarHBondContact O-N 3.35Å; Y1689-I1692 PolarHBondContact O-N 3.27Å; Y1689-Q1693 HydrophobicContact CD1-CG 3.85Å; Y1689-Q1693 HydrophobicContact CE1-CG 4.2Å; Y1689-Q1693 VanDerWaalsContact O-CB 3.24Å; Y1689-Q1693 WeakPolarHBondContact O-CB 3.37Å; Y1689-Q1693 WeakPolarHBondContact O-CG 3.43Å; Y1689-Q1693 PolarHBondContact O-N 3.29Å
1690	Q	47.3	Very low	43.7	Very low	95 Å²	95	130.5 Å²	130.5	44%	0.444	59%	0.591	S	S	.	*	H	α-helix	trans	-64.7	-42	177.8	-76.3	-178.4	-53.9	0	0	113	F1686 H1687 Q1693 Q1694	F1686-Q1690 HydrophobicContact CD1-CG 4.11Å; F1686-Q1690 HydrophobicContact CE1-CG 4.03Å; F1686-Q1690 WeakPolarHBondContact O-CG 3.44Å; F1686-Q1690 PolarHBondContact O-N 3.03Å; H1687-Q1690 PolarHBondContact ND1-OE1 3.18Å; H1687-Q1690 PolarHBondContact O-N 3.09Å; Q1690-Q1693 PolarHBondContact O-N 2.85Å; Q1690-Q1694 PolarHBondContact O-N 3.37Å
1691	L	51	Low	44	Very low	111 Å²	111	126.8 Å²	126.8	58%	0.581	58%	0.583	S	S	*	*	H	α-helix	trans	-66.7	-37.2	175.4	-89.6	161.5	0	0	0	112.5	H1687 Q1695	H1687-L1691 PolarHBondContact O-N 2.79Å; L1691-Q1695 PolarHBondContact O-N 2.81Å
1692	I	51	Low	43.9	Very low	82 Å²	82	129.5 Å²	129.5	42%	0.421	60%	0.596	S	S	.	*	H	α-helix	trans	-70.5	-42	175.4	-68.8	169.8	0	0	0	110.9	Q1688 Y1689 Q1694 Q1695 Q1696	Q1688-I1692 HydrophobicContact CG-CD1 4.21Å; Q1688-I1692 VanDerWaalsContact O-CG1 3.32Å; Q1688-I1692 WeakPolarHBondContact O-CG1 3.44Å; Q1688-I1692 PolarHBondContact O-N 2.87Å; Q1688-I1692 VanDerWaalsContact O-N 3.17Å; Y1689-I1692 PolarHBondContact O-N 3.27Å; I1692-Q1694 PolarHBondContact O-N 2.8Å; I1692-Q1695 PolarHBondContact O-N 3.4Å; I1692-Q1696 HydrophobicContact CG2-CG 4.34Å; I1692-Q1696 WeakPolarHBondContact O-CB 3.46Å; I1692-Q1696 WeakPolarHBondContact O-CG 3.31Å; I1692-Q1696 PolarHBondContact O-N 3.08Å
1693	Q	43.8	Very low	43.9	Very low	80 Å²	80	131.1 Å²	131.1	37%	0.374	61%	0.605	S	S	.	*	H	α-helix	trans	-59	-44	174.2	-78.2	-85.3	-24.2	0	0	111.8	Y1689 Q1690 Q1695 Q1696 H1697	Y1689-Q1693 HydrophobicContact CD1-CG 3.85Å; Y1689-Q1693 HydrophobicContact CE1-CG 4.2Å; Y1689-Q1693 VanDerWaalsContact O-CB 3.24Å; Y1689-Q1693 WeakPolarHBondContact O-CB 3.37Å; Y1689-Q1693 WeakPolarHBondContact O-CG 3.43Å; Y1689-Q1693 PolarHBondContact O-N 3.29Å; Q1690-Q1693 PolarHBondContact O-N 2.85Å; Q1693-Q1695 PolarHBondContact O-N 2.94Å; Q1693-Q1696 PolarHBondContact O-N 3.42Å; Q1693-H1697 WeakPolarHBondContact O-CB 3.08Å; Q1693-H1697 PolarHBondContact O-N 2.8Å
1694	Q	50.4	Low	43.4	Very low	140 Å²	140	131.9 Å²	131.9	65%	0.654	61%	0.605	S	S	*	*	H	α-helix	trans	-61.9	-42.3	176.7	-80	-172.8	-20	0	0	112.6	Q1690 I1692 Q1698	Q1690-Q1694 PolarHBondContact O-N 3.37Å; I1692-Q1694 PolarHBondContact O-N 2.8Å; Q1694-Q1698 PolarHBondContact O-N 3.41Å
1695	Q	49.3	Very low	42.9	Very low	124 Å²	124	131.9 Å²	131.9	58%	0.579	61%	0.605	S	S	*	*	H	α-helix	trans	-74.5	-22.9	176.4	-70.5	-163.5	-0.5	0	0	114	L1691 I1692 Q1693	L1691-Q1695 PolarHBondContact O-N 2.81Å; I1692-Q1695 PolarHBondContact O-N 3.4Å; Q1693-Q1695 PolarHBondContact O-N 2.94Å
1696	Q	46.6	Very low	42.1	Very low	95 Å²	95	129.4 Å²	129.4	44%	0.444	61%	0.611	S	S	.	*	H	α-helix	trans	-80.8	-40.5	174.1	-75.2	178.2	-26	0	0	112	I1692 Q1693 Q1698 R1699 Q1700	I1692-Q1696 HydrophobicContact CG2-CG 4.34Å; I1692-Q1696 WeakPolarHBondContact O-CB 3.46Å; I1692-Q1696 WeakPolarHBondContact O-CG 3.31Å; I1692-Q1696 PolarHBondContact O-N 3.08Å; Q1693-Q1696 PolarHBondContact O-N 3.42Å; Q1696-Q1698 VanDerWaalsContact C-N 3.35Å; Q1696-Q1698 PolarHBondContact O-N 3.45Å; Q1696-R1699 CarbonylContact O-C 3.56Å; Q1696-R1699 PolarHBondContact O-N 2.76Å; Q1696-Q1700 PolarHBondContact O-N 3.09Å
1697	H	44.6	Very low	41.7	Very low	113 Å²	113	132.7 Å²	132.7	52%	0.523	63%	0.625	S	S	.	*	H	α-helix	trans	-61.2	-41.6	173.9	-110.3	70.1	0	0	0	112	Q1693 R1699 Q1700 Q1701	Q1693-H1697 WeakPolarHBondContact O-CB 3.08Å; Q1693-H1697 PolarHBondContact O-N 2.8Å; H1697-R1699 PolarHBondContact O-N 3.02Å; H1697-R1699 VanDerWaalsContact O-N 3.14Å; H1697-Q1700 PolarHBondContact O-N 2.04Å; H1697-Q1701 PolarHBondContact O-N 2.9Å
1698	Q	43.7	Very low	41	Very low	176 Å²	176	132.7 Å²	132.7	82%	0.822	63%	0.63	S	S	*	*	H	α-helix	trans	-65.8	-9.8	173.5	-76.6	-169.8	-14.5	0	0	114.6	Q1694 Q1696	Q1694-Q1698 PolarHBondContact O-N 3.41Å; Q1696-Q1698 VanDerWaalsContact C-N 3.35Å; Q1696-Q1698 PolarHBondContact O-N 3.45Å
1699	R	40.3	Very low	40.3	Very low	193 Å²	193	132.3 Å²	132.3	73%	0.728	63%	0.632	S	S	*	*	H	α-helix	trans	-119.6	-3.9	178.4	-112.9	-172.4	-70.9	-170.9	-3.5	115.7	Q1696 H1697	Q1696-R1699 CarbonylContact O-C 3.56Å; Q1696-R1699 PolarHBondContact O-N 2.76Å; H1697-R1699 PolarHBondContact O-N 3.02Å; H1697-R1699 VanDerWaalsContact O-N 3.14Å
1700	Q	39.5	Very low	39.6	Very low	138 Å²	138	132.9 Å²	132.9	65%	0.645	64%	0.64	S	S	*	*	H	α-helix	trans	-120.2	4.4	178.7	-69.9	-173.4	-26.9	0	0	114.4	Q1696 H1697 Q1703	Q1696-Q1700 PolarHBondContact O-N 3.09Å; H1697-Q1700 PolarHBondContact O-N 2.04Å; Q1700-Q1703 WeakPolarHBondContact O-CG 3.35Å
1701	Q	43.3	Very low	38.8	Very low	140 Å²	140	133.9 Å²	133.9	65%	0.654	66%	0.657	S	S	*	*	S	Bend	trans	-97.2	16.7	159	-74.7	-167.6	-15.5	0	0	113.9	H1697	H1697-Q1701 PolarHBondContact O-N 2.9Å
1702	Q	39.3	Very low	37.7	Very low	184 Å²	184	136.7 Å²	136.7	86%	0.86	67%	0.665	S	S	*	*	S	Bend	trans	-99.3	79.7	141.4	-75.8	-173.8	-19.2	0	0	108
1703	Q	33.8	Very low	36.5	Very low	140 Å²	140	140.8 Å²	140.8	65%	0.654	68%	0.683	S	S	*	*			trans	-74.7	152	170.6	-67	-170.6	-11.9	0	0	109.6	Q1700	Q1700-Q1703 WeakPolarHBondContact O-CG 3.35Å
1704	Q	30.8	Very low	35.8	Very low	149 Å²	149	142.6 Å²	142.6	70%	0.696	70%	0.699	S	S	*	*			cis	-162.7	136.1	-5.4	-118	174.7	38.5	0	0	108
1705	H	31.3	Very low	34.6	Very low	147 Å²	147	145.3 Å²	145.3	68%	0.681	71%	0.709	S	S	*	*			trans	167.2	134	149.3	-99.8	67.3	0	0	0	109.1	Q1746	H1705-Q1746 PolarHBondContact CE1-NE2 3.15Å; H1705-Q1746 WeakPolarHBondContact NE2-CG 3.46Å; H1705-Q1746 PolarHBondContact NE2-NE2 2.92Å
1706	G	29.3	Very low	33.7	Very low	67 Å²	67	145.9 Å²	145.9	69%	0.691	72%	0.716	S	S	*	*			cis	179.6	123.7	-13.2	0	0	0	0	0	113.1
1707	K	30.1	Very low	32.5	Very low	196 Å²	196	150 Å²	150	85%	0.852	74%	0.738	S	S	*	*			trans	69.9	125.5	164.6	-67.3	-174.2	178.3	-179	0	120.8
1708	N	29.5	Very low	31.6	Very low	133 Å²	133	151.4 Å²	151.4	71%	0.711	75%	0.749	S	S	*	*			trans	63.2	137.2	138.1	-62.2	55.2	0	0	0	120.1
1709	D	29.2	Very low	30.7	Very low	123 Å²	123	153.4 Å²	153.4	66%	0.658	75%	0.749	S	S	*	*			cis	-162	164.6	-14.1	-131.5	-44.2	0	0	0	113.9
1710	Q	27.9	Very low	30.1	Very low	164 Å²	164	151.2 Å²	151.2	77%	0.766	75%	0.751	S	S	*	*			trans	52.7	127.5	159.5	-58.5	-166.8	6.6	0	0	124
1711	S	30	Very low	29.5	Very low	116 Å²	116	152.8 Å²	152.8	81%	0.811	76%	0.758	S	S	*	*			trans	81.4	156.5	141.1	81.4	0	0	0	0	121.6
1712	K	28.5	Very low	28.7	Very low	170 Å²	170	154 Å²	154	74%	0.739	76%	0.764	S	S	*	*			cis	-168.2	111.9	-45.8	-161.5	180	-176.7	-177.9	0	109.8
1713	Q	25.4	Very low	28.1	Very low	169 Å²	169	151.1 Å²	151.1	79%	0.79	75%	0.75	S	S	*	*			trans	62.8	151.5	169.2	-63.1	163	-62.7	0	0	114.3
1714	T	29.2	Very low	27.9	Very low	117 Å²	117	150.8 Å²	150.8	72%	0.718	75%	0.752	S	S	*	*				-172.1	133.4	62.1	-60.7	0	0	0	0	110.9
1715	F	24.8	Very low	27.6	Very low	197 Å²	197	151.5 Å²	151.5	86%	0.864	76%	0.76	S	S	*	*			trans	61.2	161.3	160.6	-92.7	-111.8	0	0	0	123
1716	N	30.3	Very low	27.4	Very low	137 Å²	137	147.8 Å²	147.8	73%	0.733	76%	0.762	S	S	*	*			trans	85.4	112.5	151.1	-120.7	-21.8	0	0	0	120.2	N1718	N1716-N1718 PolarHBondContact O-N 3.25Å
1717	M	22.4	Very low	27.4	Very low	181 Å²	181	150.1 Å²	150.1	89%	0.892	77%	0.767	S	S	*	*			trans	-70.2	105.7	166.4	-94.8	-84.5	-76.1	0	0	110.4
1718	N	24.5	Very low	27.3	Very low	142 Å²	142	149.2 Å²	149.2	76%	0.759	76%	0.763	S	S	*	*			trans	-156	138.2	161.5	-106.9	-57.3	0	0	0	112.3	N1716	N1716-N1718 PolarHBondContact O-N 3.25Å
1719	R	25.9	Very low	27.2	Very low	218 Å²	218	149.9 Å²	149.9	82%	0.823	77%	0.767	S	S	*	*			trans	60.1	105	172.8	-65.1	178.7	167.1	177.8	-4.9	118.6
1720	L	27.4	Very low	27	Very low	148 Å²	148	153.6 Å²	153.6	78%	0.775	78%	0.778	S	S	*	*				-161.4	146.2	123.6	-126.4	66.6	0	0	0	106.5
1721	H	26.7	Very low	27.2	Very low	171 Å²	171	153.5 Å²	153.5	79%	0.792	78%	0.781	S	S	*	*			cis	-137.1	144.8	20.5	-67	71.8	0	0	0	113.5
1722	Q	25.5	Very low	27.2	Very low	165 Å²	165	152.4 Å²	152.4	77%	0.771	77%	0.773	S	S	*	*				-158.3	150.2	129	-92.2	-163.9	-3.5	0	0	105
1723	Q	27.4	Very low	27.4	Very low	124 Å²	124	149.8 Å²	149.8	58%	0.579	77%	0.767	S	S	*	*			cis	-162.7	169.3	11	-133.3	-179.8	-4	0	0	111.2
1724	I	29.6	Very low	27.6	Very low	133 Å²	133	149 Å²	149	68%	0.682	76%	0.764	S	S	*	*			trans	69.3	126.5	152.3	-67.3	160.2	0	0	0	116.5
1725	N	24.1	Very low	27.5	Very low	163 Å²	163	151 Å²	151	87%	0.872	76%	0.762	S	S	*	*			cis	87	131.8	31.8	-80.1	-10.7	0	0	0	117.7
1726	G	28.3	Very low	27.8	Very low	70 Å²	70	147.7 Å²	147.7	72%	0.722	75%	0.753	S	S	*	*			trans	119.6	134.4	166.6	0	0	0	0	0	113.4
1727	S	28.5	Very low	27.8	Very low	115 Å²	115	150 Å²	150	80%	0.804	76%	0.76	S	S	*	*			cis	-160.8	159.5	-8	-115.1	0	0	0	0	113
1728	K	28.1	Very low	28	Very low	177 Å²	177	150.3 Å²	150.3	77%	0.77	76%	0.756	S	S	*	*			trans	-7.7	149.9	137	-64.1	-175.5	178.7	-176.4	0	116.4
1729	N	27.9	Very low	28.3	Very low	148 Å²	148	149.8 Å²	149.8	79%	0.791	75%	0.753	S	S	*	*			cis	-161.9	175.7	8.6	-112.7	7.8	0	0	0	110.5
1730	F	25.8	Very low	28.6	Very low	200 Å²	200	145.9 Å²	145.9	88%	0.877	75%	0.749	S	S	*	*			trans	-97.6	139.8	172.8	-126.7	-81	0	0	0	112.2
1731	I	31.9	Very low	28.7	Very low	163 Å²	163	146 Å²	146	84%	0.836	75%	0.75	S	S	*	*			trans	177.9	155.6	130.7	-93.9	163.1	0	0	0	109.2
1732	S	29.9	Very low	29	Very low	92 Å²	92	146.2 Å²	146.2	64%	0.643	75%	0.751	S	S	*	*			trans	-88.4	177.1	-171.5	67.3	0	0	0	0	112.2
1733	D	31.4	Very low	29	Very low	116 Å²	116	145.7 Å²	145.7	62%	0.62	75%	0.753	S	S	*	*				-167.2	148.8	55.9	-137.4	35.7	0	0	0	113.9
1734	Q	30.1	Very low	29	Very low	153 Å²	153	145.1 Å²	145.1	72%	0.715	76%	0.762	S	S	*	*			trans	62.6	144.9	153.3	-74	-176.6	80.4	0	0	119.5
1735	K	27.3	Very low	29.1	Very low	159 Å²	159	144.8 Å²	144.8	69%	0.691	77%	0.766	S	S	*	*			cis	-169.6	166.4	-14.4	-141.9	-176.3	176.4	-178.6	0	110.9
1736	D	30.1	Very low	29.4	Very low	126 Å²	126	143.1 Å²	143.1	67%	0.674	75%	0.753	S	S	*	*			trans	86.3	144.2	155.3	-61.7	-25	0	0	0	121.5
1737	Q	31.6	Very low	29.6	Very low	187 Å²	187	144.4 Å²	144.4	87%	0.874	75%	0.749	S	S	*	*			trans	56.3	105.3	170.2	-60.7	177.4	34.6	0	0	116.6
1738	K	27	Very low	29.5	Very low	187 Å²	187	144.7 Å²	144.7	81%	0.813	74%	0.741	S	S	*	*			cis	70.6	95.7	28.3	-163.2	-165.5	178.1	-175.5	0	115.3
1739	N	31	Very low	29.6	Very low	130 Å²	130	141.2 Å²	141.2	70%	0.695	73%	0.728	S	S	*	*			trans	-178.8	127.2	132.3	-91.2	-12.9	0	0	0	111.7
1740	N	31.3	Very low	29.6	Very low	137 Å²	137	141.1 Å²	141.1	73%	0.733	72%	0.723	S	S	*	*			trans	75.7	141.2	138.1	-59.8	-2.7	0	0	0	120.1
1741	L	28.9	Very low	29.9	Very low	150 Å²	150	137.5 Å²	137.5	79%	0.785	72%	0.717	S	S	*	*			cis	-158.5	179.6	-16.7	-170.9	55.9	0	0	0	108.3
1742	E	32.5	Very low	29.8	Very low	175 Å²	175	136.5 Å²	136.5	82%	0.818	71%	0.708	S	S	*	*			trans	87.8	108.2	164.2	-52.8	-158.3	130	0	0	118.6
1743	N	27.5	Very low	29.6	Very low	155 Å²	155	136.3 Å²	136.3	83%	0.829	71%	0.705	S	S	*	*			trans	-71.9	171.2	165.7	-44.3	-59.1	0	0	0	109.8
1744	C	27.1	Very low	29.5	Very low	112 Å²	112	137.8 Å²	137.8	76%	0.757	71%	0.706	S	S	*	*			cis	-134.4	166.4	18.8	-75.2	0	0	0	0	109.6
1745	T	30.9	Very low	29.6	Very low	125 Å²	125	138.3 Å²	138.3	77%	0.767	71%	0.706	S	S	*	*				-170.9	165.4	53.9	-41.8	0	0	0	0	111.6
1746	Q	29.7	Very low	29.4	Very low	129 Å²	129	139.1 Å²	139.1	60%	0.603	72%	0.718	S	S	*	*			trans	97	145.3	166	-61.7	-72.5	-9.5	0	0	118	H1705	H1705-Q1746 PolarHBondContact CE1-NE2 3.15Å; H1705-Q1746 WeakPolarHBondContact NE2-CG 3.46Å; H1705-Q1746 PolarHBondContact NE2-NE2 2.92Å
1747	P	32.8	Very low	29.3	Very low	97 Å²	97	138.2 Å²	138.2	63%	0.63	71%	0.712	S	S	*	*			trans	-114.9	171.6	-169.1	43	-33.5	0	0	0	116.1
1748	N	27.6	Very low	29	Very low	120 Å²	120	137.8 Å²	137.8	64%	0.642	71%	0.708	S	S	*	*			trans	-101.9	138.7	-178.2	-68.1	9	0	0	0	115.2	Y1427 E1750	Y1427-N1748 PolarHBondContact OH-O 3.27Å; N1748-E1750 HydrophobicContact CB-CB 4.14Å; N1748-E1750 PolarHBondContact ND2-OE2 3.13Å
1749	Q	29.1	Very low	28.9	Very low	104 Å²	104	132 Å²	132	49%	0.486	69%	0.69	S	S	.	*				-136.5	136.7	119.4	-60.9	171.6	9.2	0	0	106.3	Y1427	Y1427-Q1749 HydrophobicContact CD2-CB 4.27Å; Y1427-Q1749 HydrophobicContact CD2-CG 4.21Å; Y1427-Q1749 HydrophobicContact CE2-CB 3.53Å; Y1427-Q1749 VanDerWaalsContact CE2-CD 3.47Å; Y1427-Q1749 HydrophobicContact CE2-CG 3.47Å; Y1427-Q1749 VanDerWaalsContact CE2-CG 3.47Å; Y1427-Q1749 PolarHBondContact OH-N 3.14Å
1750	E	28.5	Very low	28.6	Very low	147 Å²	147	132.5 Å²	132.5	69%	0.687	69%	0.692	S	S	*	*			cis	70.5	55.9	-1.5	-153.6	169.9	-157.4	0	0	117.6	N1748	N1748-E1750 HydrophobicContact CB-CB 4.14Å; N1748-E1750 PolarHBondContact ND2-OE2 3.13Å
1751	V	32.6	Very low	28.3	Very low	124 Å²	124	134.4 Å²	134.4	75%	0.752	70%	0.696	S	S	*	*			trans	-145.4	129.3	142.6	-174.2	0	0	0	0	107.2
1752	E	28.8	Very low	28.3	Very low	141 Å²	141	134.2 Å²	134.2	66%	0.659	69%	0.694	S	S	*	*			cis	-123.2	148.5	-5.1	-111.1	-131.3	134.6	0	0	110.9	K1754	E1752-K1754 WeakPolarHBondContact OE1-CE 3.43Å; E1752-K1754 IonicContact OE1-NZ 2.71Å; E1752-K1754 PolarHBondContact OE1-NZ 3.2Å; E1752-K1754 IonicContact OE2-NZ 3.13Å; E1752-K1754 PolarHBondContact OE2-NZ 2.69Å
1753	P	26.2	Very low	28	Very low	89 Å²	89	132.8 Å²	132.8	58%	0.578	69%	0.693	S	S	*	*			trans	-92.1	147.9	163.8	36.2	-31.7	0	0	0	111.8
1754	K	30.1	Very low	28	Very low	146 Å²	146	131.6 Å²	131.6	64%	0.635	68%	0.68	S	S	*	*			trans	-163.7	112.7	143.7	-92.5	126.8	-152.1	176.8	0	108.2	E1752	E1752-K1754 WeakPolarHBondContact OE1-CE 3.43Å; E1752-K1754 IonicContact OE1-NZ 2.71Å; E1752-K1754 PolarHBondContact OE1-NZ 3.2Å; E1752-K1754 IonicContact OE2-NZ 3.13Å; E1752-K1754 PolarHBondContact OE2-NZ 2.69Å
1755	K	31.6	Very low	28	Very low	164 Å²	164	133.8 Å²	133.8	71%	0.713	68%	0.682	S	S	*	*				71.3	91.1	81.2	-74.9	-175.6	179.1	-178.7	0	112.5	L1757	K1755-L1757 VanDerWaalsContact C-N 3.27Å; K1755-L1757 HydrophobicContact CB-CB 4.24Å; K1755-L1757 HydrophobicContact CD-CB 4.15Å; K1755-L1757 HydrophobicContact CG-CB 3.89Å
1756	D	23.4	Very low	27.6	Very low	176 Å²	176	133.8 Å²	133.8	94%	0.941	68%	0.682	S	S	*	*				-83.1	86	115.4	-103.8	-44.1	0	0	0	108.1
1757	L	27.3	Very low	27.6	Very low	107 Å²	107	132.1 Å²	132.1	56%	0.56	68%	0.684	S	S	*	*			trans	-116.4	85.5	158.4	-174.6	86.7	0	0	0	107.6	K1755	K1755-L1757 VanDerWaalsContact C-N 3.27Å; K1755-L1757 HydrophobicContact CB-CB 4.24Å; K1755-L1757 HydrophobicContact CD-CB 4.15Å; K1755-L1757 HydrophobicContact CG-CB 3.89Å
1758	K	25.8	Very low	27.1	Very low	179 Å²	179	136.2 Å²	136.2	78%	0.778	70%	0.695	S	S	*	*			trans	72.3	154.7	162.5	-57.1	174.6	-178.4	-177.2	0	113.8
1759	S	24.2	Very low	26.9	Very low	64 Å²	64	136 Å²	136	45%	0.448	70%	0.702	S	S	.	*			cis	-142.1	137.3	18.5	54.6	0	0	0	0	115
1760	I	25.2	Very low	26.8	Very low	141 Å²	141	136.6 Å²	136.6	72%	0.723	71%	0.712	S	S	*	*			trans	59.7	110.8	136.4	-60.3	169.3	0	0	0	116.2
1761	Q	24.7	Very low	26.7	Very low	177 Å²	177	135.9 Å²	135.9	83%	0.827	71%	0.713	S	S	*	*			trans	64.3	167.4	169.5	-62.5	162.2	-61.2	0	0	111.8
1762	I	28.6	Very low	26.3	Very low	146 Å²	146	139.8 Å²	139.8	75%	0.749	72%	0.72	S	S	*	*			cis	-131.2	123.6	15.5	-63.1	161.6	0	0	0	110
1763	N	27.5	Very low	26	Very low	146 Å²	146	141.5 Å²	141.5	78%	0.781	73%	0.728	S	S	*	*				176.5	137.4	120.4	-94.3	-73.5	0	0	0	106.2
1764	K	26.4	Very low	26	Very low	129 Å²	129	144.4 Å²	144.4	56%	0.561	74%	0.738	S	S	*	*	S	Bend	cis	-149.5	172.2	40.5	-131.9	167.8	-171.9	172.7	0	111.6	F50	F50-K1764 HydrophobicContact CE2-CD 4.39Å; F50-K1764 HydrophobicContact CZ-CD 4.27Å; F50-K1764 VanDerWaalsContact CZ-NZ 3.25Å
1765	I	26.6	Very low	25.8	Very low	158 Å²	158	143.5 Å²	143.5	81%	0.81	74%	0.74	S	S	*	*			trans	95.6	132	-179.6	-58.2	169.5	0	0	0	113.3
1766	V	23.8	Very low	25.5	Very low	126 Å²	126	141 Å²	141	76%	0.764	74%	0.74	S	S	*	*			trans	-105.2	157.6	176.7	171.8	0	0	0	0	108.5
1767	S	29.1	Very low	25.7	Very low	93 Å²	93	137.8 Å²	137.8	65%	0.65	73%	0.727	S	S	*	*			trans	91.5	123.5	-166.3	74.9	0	0	0	0	112
1768	E	21.3	Very low	25.7	Very low	184 Å²	184	139.8 Å²	139.8	86%	0.86	74%	0.739	S	S	*	*	S	Bend	cis	-60.9	160.1	-6.4	-67.8	167.3	148.8	0	0	112.8
1769	C	25	Very low	25.7	Very low	115 Å²	115	135.1 Å²	135.1	78%	0.777	73%	0.728	S	S	*	*	S	Bend	cis	-123.3	153.9	-18.3	-102.3	0	0	0	0	108.7
1770	V	26.9	Very low	26	Very low	117 Å²	117	138.2 Å²	138.2	71%	0.709	74%	0.74	S	S	*	*			trans	-94.5	171.1	179.1	-112.4	0	0	0	0	109.6
1771	D	26.3	Very low	26.1	Very low	132 Å²	132	139 Å²	139	71%	0.706	74%	0.738	S	S	*	*			cis	-150.8	161.8	35.2	-134.9	-46.5	0	0	0	116.5	Q1773	D1771-Q1773 PolarHBondContact OD1-N 3.04Å
1772	K	23.7	Very low	26.4	Very low	206 Å²	206	138 Å²	138	90%	0.896	73%	0.731	S	S	*	*			trans	-152.9	60.3	162	-156.3	-178.2	-174.7	179.8	0	112.4
1773	Q	23.7	Very low	26.4	Very low	177 Å²	177	138.1 Å²	138.1	83%	0.827	73%	0.729	S	S	*	*			trans	-146.5	131.3	155	-113.1	173.7	19.3	0	0	113.4	D1771	D1771-Q1773 PolarHBondContact OD1-N 3.04Å
1774	L	25.3	Very low	26.5	Very low	150 Å²	150	136.8 Å²	136.8	79%	0.785	72%	0.721	S	S	*	*			trans	-96.3	147.1	142.7	-77.5	155.1	0	0	0	105
1775	D	25.3	Very low	26.7	Very low	126 Å²	126	138 Å²	138	67%	0.674	73%	0.729	S	S	*	*			cis	-142.5	168.1	19.2	-105.9	-59.4	0	0	0	108.6
1776	P	26.1	Very low	26.9	Very low	111 Å²	111	134.1 Å²	134.1	72%	0.721	71%	0.71	S	S	*	*			cis	-144.6	157.4	35.4	42.3	-23	0	0	0	119.2
1777	V	26.6	Very low	27.3	Very low	110 Å²	110	132.7 Å²	132.7	67%	0.667	70%	0.697	S	S	*	*			trans	43.9	128.6	131.9	-177.4	0	0	0	0	120.3
1778	N	27.3	Very low	27.3	Very low	149 Å²	149	133.2 Å²	133.2	80%	0.797	69%	0.689	S	S	*	*			trans	81.2	137.3	163.8	-75.2	-15.8	0	0	0	119
1779	S	26.1	Very low	27.7	Very low	80 Å²	80	131.3 Å²	131.3	56%	0.559	68%	0.678	S	S	*	*			cis	-174.3	159.4	-20.6	46.4	0	0	0	0	110.5
1780	N	29.9	Very low	27.9	Very low	130 Å²	130	131.5 Å²	131.5	70%	0.695	68%	0.68	S	S	*	*			trans	72.9	144.1	171.8	-50.6	-77.6	0	0	0	115.6
1781	K	28.6	Very low	28.1	Very low	156 Å²	156	132.1 Å²	132.1	68%	0.678	68%	0.684	S	S	*	*			cis	-160.4	157	-14.9	-103.7	172.2	-176.1	-178.7	0	104.6
1782	F	29.7	Very low	28.1	Very low	157 Å²	157	132.4 Å²	132.4	69%	0.689	69%	0.686	S	S	*	*				-171.3	140.1	62.5	-103.8	-84.9	0	0	0	109.2
1783	Q	29.4	Very low	28.2	Very low	149 Å²	149	130.6 Å²	130.6	70%	0.696	68%	0.678	S	S	*	*			trans	45	156.5	133.8	-67.6	-162.3	-82.6	0	0	121.2
1784	D	29.7	Very low	28.3	Very low	117 Å²	117	130.2 Å²	130.2	63%	0.626	68%	0.676	S	S	*	*			cis	158.2	152.8	-9.9	-90	-13.9	0	0	0	103.8
1785	Q	30.4	Very low	28.3	Very low	155 Å²	155	132.5 Å²	132.5	72%	0.724	68%	0.682	S	S	*	*			cis	-159.3	164.1	-10.4	-118.4	-162.4	-51.1	0	0	108
1786	D	30.8	Very low	28.2	Very low	76 Å²	76	135.1 Å²	135.1	41%	0.406	69%	0.691	S	S	.	*			cis	-137	-57.2	-5.8	178.8	-93.9	0	0	0	111.6	K1789	D1786-K1789 WeakPolarHBondContact OD1-CE 3.47Å; D1786-K1789 IonicContact OD1-NZ 3.08Å; D1786-K1789 PolarHBondContact OD1-NZ 3.41Å; D1786-K1789 IonicContact OD2-NZ 2.7Å; D1786-K1789 PolarHBondContact OD2-NZ 2.93Å
1787	I	31.7	Very low	28.3	Very low	97 Å²	97	137.3 Å²	137.3	50%	0.497	70%	0.696	S	S	.	*			cis	-132.7	111.7	-43.1	-173	169.5	0	0	0	111.2	I1257	I1257-I1787 HydrophobicContact CD1-CG2 3.8Å; I1257-I1787 WeakPolarHBondContact CD1-O 3.1Å; I1257-I1787 WeakPolarHBondContact CG2-O 3.05Å
1788	Q	29.9	Very low	28.3	Very low	103 Å²	103	136.2 Å²	136.2	48%	0.481	69%	0.694	S	S	.	*			trans	52.6	92.6	165	-66.9	179	-1.5	0	0	115.9	H1255 I1257	H1255-Q1788 PolarHBondContact CE1-OE1 3.14Å; H1255-Q1788 PolarHBondContact NE2-OE1 2.67Å; I1257-Q1788 WeakPolarHBondContact CG2-O 3.21Å
1789	K	29.1	Very low	28.2	Very low	145 Å²	145	134 Å²	134	63%	0.63	69%	0.69	S	S	*	*			cis	53.5	123.5	41.2	-49.3	170.8	178.3	153.7	0	114.5	D1786	D1786-K1789 WeakPolarHBondContact OD1-CE 3.47Å; D1786-K1789 IonicContact OD1-NZ 3.08Å; D1786-K1789 PolarHBondContact OD1-NZ 3.41Å; D1786-K1789 IonicContact OD2-NZ 2.7Å; D1786-K1789 PolarHBondContact OD2-NZ 2.93Å
1790	S	28.7	Very low	28.4	Very low	118 Å²	118	136.9 Å²	136.9	83%	0.825	70%	0.697	S	S	*	*				-170.4	153.9	99.5	57.7	0	0	0	0	113
1791	V	31.2	Very low	28.3	Very low	131 Å²	131	136.8 Å²	136.8	79%	0.794	70%	0.697	S	S	*	*			trans	-150.1	136.1	170.4	170.7	0	0	0	0	107.1
1792	N	27.7	Very low	28.4	Very low	138 Å²	138	136.4 Å²	136.4	74%	0.738	70%	0.697	S	S	*	*			trans	178.3	136.6	141.4	-101.5	-59.7	0	0	0	115
1793	K	26.1	Very low	28.4	Very low	168 Å²	168	136.5 Å²	136.5	73%	0.73	70%	0.698	S	S	*	*			trans	66.5	130.2	140.4	-71.4	-179.8	177.6	-172.4	0	123.5
1794	H	24.8	Very low	28.4	Very low	169 Å²	169	135 Å²	135	78%	0.782	69%	0.694	S	S	*	*			trans	39.6	121.1	141.2	-61.1	-78.5	0	0	0	120.8
1795	E	25.4	Very low	28.4	Very low	197 Å²	197	137.4 Å²	137.4	92%	0.921	70%	0.702	S	S	*	*				-167.1	177.3	93.8	-105.1	-180	174.2	0	0	111.6
1796	E	24	Very low	28.3	Very low	181 Å²	181	137.3 Å²	137.3	85%	0.846	70%	0.701	S	S	*	*			trans	-102.4	147.3	-176.2	-61.4	174.6	112.6	0	0	112.2
1797	N	26.9	Very low	28.3	Very low	157 Å²	157	139.6 Å²	139.6	84%	0.84	71%	0.714	S	S	*	*			trans	147.3	150.2	154.2	-87.5	-58.2	0	0	0	110.4
1798	S	27	Very low	28.3	Very low	87 Å²	87	145.1 Å²	145.1	61%	0.608	73%	0.728	S	S	*	*			cis	176.2	107.2	-34.4	42.3	0	0	0	0	106.3
1799	S	25.4	Very low	28.2	Very low	102 Å²	102	144.5 Å²	144.5	71%	0.713	74%	0.735	S	S	*	*			trans	41.5	131.8	145	64.6	0	0	0	0	122.6
1800	I	29.3	Very low	28.2	Very low	141 Å²	141	144.8 Å²	144.8	72%	0.723	74%	0.743	S	S	*	*				163.6	111.4	113.1	-83.8	158	0	0	0	111.5
1801	N	28.6	Very low	28.3	Very low	128 Å²	128	145.4 Å²	145.4	68%	0.684	74%	0.735	S	S	*	*				175.8	129	113.4	-106.3	-46.8	0	0	0	114.7
1802	Q	30.5	Very low	28.2	Very low	148 Å²	148	147.5 Å²	147.5	69%	0.692	74%	0.738	S	S	*	*			trans	69.4	116.1	141.8	-71.4	172.5	46.9	0	0	123.5
1803	K	29.3	Very low	28.2	Very low	160 Å²	160	148.1 Å²	148.1	70%	0.696	74%	0.742	S	S	*	*			trans	73.8	144.5	131.9	-62.3	-177.3	148.3	-71.7	0	119.7
1804	D	29.8	Very low	28.8	Very low	117 Å²	117	145.2 Å²	145.2	63%	0.626	74%	0.74	S	S	*	*			cis	-167.3	137.2	-17.1	-82.3	-30.7	0	0	0	105.6
1805	E	29.4	Very low	29	Very low	168 Å²	168	144 Å²	144	79%	0.785	74%	0.739	S	S	*	*			cis	-117.1	-98.6	-20.9	-64.4	179.3	-33.4	0	0	109.7
1806	H	29.6	Very low	29.1	Very low	153 Å²	153	141.3 Å²	141.3	71%	0.708	73%	0.731	S	S	*	*			cis	-157.2	172.2	-16.6	-158.8	70.7	0	0	0	109.9
1807	D	29.9	Very low	29.3	Very low	124 Å²	124	138.8 Å²	138.8	66%	0.663	72%	0.723	S	S	*	*			trans	-139.6	-167.3	-164.7	-90.4	-58.3	0	0	0	114.6
1808	R	31.2	Very low	29.2	Very low	213 Å²	213	138.4 Å²	138.4	80%	0.804	72%	0.716	S	S	*	*				178.1	127.3	-58.3	-176.4	178.7	175.5	-165.6	4.2	113.4
1809	S	28.1	Very low	29.2	Very low	89 Å²	89	140.1 Å²	140.1	62%	0.622	72%	0.717	S	S	*	*			trans	44.2	120.8	152.9	76.9	0	0	0	0	125.5
1810	L	29.5	Very low	29.4	Very low	152 Å²	152	140.7 Å²	140.7	80%	0.796	71%	0.712	S	S	*	*				89.9	122	125.1	-69.1	170.5	0	0	0	125.6
1811	I	30	Very low	29.5	Very low	131 Å²	131	141.5 Å²	141.5	67%	0.672	71%	0.713	S	S	*	*			trans	80.3	96.8	138.3	-58.5	160.5	0	0	0	121.2
1812	M	28.9	Very low	29.5	Very low	174 Å²	174	140.4 Å²	140.4	86%	0.857	71%	0.711	S	S	*	*				-177.9	161.9	111.2	-96.1	-53.4	172.1	0	0	112.7
1813	N	29	Very low	29.6	Very low	152 Å²	152	140.2 Å²	140.2	81%	0.813	71%	0.713	S	S	*	*			trans	-82.7	174.7	-177.9	-75.8	1.4	0	0	0	114.1
1814	P	38.2	Very low	29.7	Very low	106 Å²	106	138.7 Å²	138.7	69%	0.688	71%	0.713	S	S	*	*			cis	-131.9	177.7	-6.7	33.6	-13.2	0	0	0	116.4
1815	D	29.7	Very low	29.7	Very low	144 Å²	144	139.1 Å²	139.1	77%	0.77	71%	0.714	S	S	*	*			trans	51	130.2	147.5	-68	-26.9	0	0	0	125.2
1816	L	27.9	Very low	29.7	Very low	141 Å²	141	137.3 Å²	137.3	74%	0.738	71%	0.71	S	S	*	*			trans	57.7	107.6	140.7	-70.4	165.9	0	0	0	121.5
1817	N	27.1	Very low	29.8	Very low	128 Å²	128	137.3 Å²	137.3	68%	0.684	72%	0.715	S	S	*	*			trans	70	155.8	132.7	-72.9	37.4	0	0	0	120.7
1818	E	25.5	Very low	30	Very low	149 Å²	149	135.4 Å²	135.4	70%	0.696	72%	0.717	S	S	*	*			cis	-175.2	174	-27.7	-166	-176.6	-169.2	0	0	107.4
1819	I	27.3	Very low	29.9	Very low	123 Å²	123	134.3 Å²	134.3	63%	0.631	72%	0.721	S	S	*	*			trans	66	132.3	160.1	-20.2	177.4	0	0	0	118.7
1820	N	29.3	Very low	29.9	Very low	114 Å²	114	134.3 Å²	134.3	61%	0.61	72%	0.721	S	S	*	*			trans	134	144.8	133.1	-73.8	-67.9	0	0	0	113.9
1821	Q	31.4	Very low	29.8	Very low	158 Å²	158	134.4 Å²	134.4	74%	0.738	72%	0.722	S	S	*	*			cis	-135.2	144	-2	-113.3	126.2	38.2	0	0	108.4
1822	T	27.2	Very low	29.8	Very low	104 Å²	104	135.8 Å²	135.8	64%	0.638	73%	0.729	S	S	*	*			cis	96.4	164.2	41.4	-57.5	0	0	0	0	112.2
1823	I	33.3	Very low	30.1	Very low	145 Å²	145	132.5 Å²	132.5	74%	0.744	72%	0.721	S	S	*	*			trans	95.6	127.3	176	-58.2	164.5	0	0	0	113.1
1824	N	30.6	Very low	30	Very low	128 Å²	128	134.5 Å²	134.5	68%	0.684	72%	0.722	S	S	*	*			cis	-167.2	171	-7	-109.1	15.2	0	0	0	107.9
1825	L	30.3	Very low	29.4	Very low	125 Å²	125	138 Å²	138	65%	0.654	73%	0.729	S	S	*	*			cis	-168	-171.7	-26.1	-155	63.2	0	0	0	107.9
1826	D	30.3	Very low	29.3	Very low	130 Å²	130	136.6 Å²	136.6	70%	0.695	73%	0.726	S	S	*	*			trans	64.1	127.9	162.1	-52.4	-29.2	0	0	0	118.7
1827	N	31.8	Very low	29.2	Very low	154 Å²	154	137 Å²	137	82%	0.824	73%	0.728	S	S	*	*			cis	-160.2	157.8	39.7	-116.9	-51	0	0	0	113.8
1828	A	32.8	Very low	29.1	Very low	84 Å²	84	136 Å²	136	69%	0.694	73%	0.727	S	S	*	*			trans	61	135	164	0	0	0	0	0	118.7
1829	Q	29	Very low	28.9	Very low	189 Å²	189	133.7 Å²	133.7	88%	0.883	72%	0.723	S	S	*	*			cis	70.6	138.2	24.3	-65.3	-174.2	-29.4	0	0	116.3
1830	S	27.9	Very low	28.7	Very low	89 Å²	89	135.9 Å²	135.9	62%	0.622	73%	0.73	S	S	*	*			cis	-168.5	-175.4	-12.4	58.4	0	0	0	0	111.7
1831	N	28.2	Very low	28.7	Very low	154 Å²	154	137 Å²	137	82%	0.824	74%	0.735	S	S	*	*			trans	102.9	131.9	152.4	-60.8	-9.8	0	0	0	122.4
1832	I	29.2	Very low	28.4	Very low	160 Å²	160	136.1 Å²	136.1	82%	0.821	74%	0.735	S	S	*	*			trans	-99.2	165	163.8	-73.6	158.5	0	0	0	105.9
1833	P	37.2	Very low	28.4	Very low	106 Å²	106	137 Å²	137	69%	0.688	74%	0.741	S	S	*	*			cis	-138.9	176.5	18.7	20.7	7.4	0	0	0	119.2
1834	K	25.7	Very low	28.2	Very low	193 Å²	193	135 Å²	135	84%	0.839	74%	0.739	S	S	*	*			trans	6.9	134.8	139.1	-46.9	171	-177.4	177.1	0	120.1
1835	Q	26.1	Very low	28.2	Very low	180 Å²	180	137.2 Å²	137.2	84%	0.841	74%	0.744	S	S	*	*				-177.5	134	111.8	-97.9	-171.3	-11.2	0	0	108.3
1836	V	26.4	Very low	28.1	Very low	114 Å²	114	139.9 Å²	139.9	69%	0.691	75%	0.751	S	S	*	*				102.6	148.2	52.6	154.7	0	0	0	0	111.2
1837	L	26.4	Very low	28.1	Very low	151 Å²	151	139.1 Å²	139.1	79%	0.791	75%	0.751	S	S	*	*			trans	69.1	145.9	-179.7	-97.5	61.3	0	0	0	115.1
1838	T	24.2	Very low	28	Very low	106 Å²	106	137.4 Å²	137.4	65%	0.65	75%	0.746	S	S	*	*			cis	-163.2	175.9	-23.1	9.5	0	0	0	0	110.9
1839	T	22.5	Very low	28	Very low	100 Å²	100	139.1 Å²	139.1	61%	0.613	74%	0.744	S	S	*	*			trans	-28.2	156.2	137.8	51	0	0	0	0	114.7
1840	E	22.8	Very low	28.1	Very low	169 Å²	169	137.7 Å²	137.7	79%	0.79	74%	0.737	S	S	*	*			cis	-166.4	-155.6	10.6	-128.5	157.8	-147.4	0	0	110.9
1841	I	28.8	Very low	28.3	Very low	139 Å²	139	140.3 Å²	140.3	71%	0.713	74%	0.743	S	S	*	*			trans	96.9	90.3	155.4	-51.2	-176.1	0	0	0	115.8
1842	N	25.2	Very low	28.5	Very low	139 Å²	139	137.2 Å²	137.2	74%	0.743	73%	0.733	S	S	*	*				50.4	136.5	120.1	-45.7	-24.3	0	0	0	118.8
1843	T	28.5	Very low	28.5	Very low	122 Å²	122	134.1 Å²	134.1	75%	0.748	73%	0.725	S	S	*	*			cis	-155.6	149.1	48.5	36.1	0	0	0	0	115
1844	C	28.1	Very low	28.2	Very low	104 Å²	104	134.8 Å²	134.8	70%	0.703	72%	0.723	S	S	*	*			trans	45.3	136.1	142.7	-51	0	0	0	0	120.9
1845	H	30.3	Very low	28.3	Very low	173 Å²	173	133 Å²	133	80%	0.801	72%	0.718	S	S	*	*			cis	-131.5	151.9	9.9	-70.7	-105.9	0	0	0	109.2
1846	K	28.1	Very low	28.4	Very low	181 Å²	181	130.3 Å²	130.3	79%	0.787	71%	0.714	S	S	*	*			cis	68.3	130.3	48.9	-77.5	-148	173.2	-177	0	114.4
1847	T	30.2	Very low	28.7	Very low	114 Å²	114	130.5 Å²	130.5	70%	0.699	72%	0.717	S	S	*	*			cis	-165.4	157.6	-7	3.9	0	0	0	0	108.8
1848	T	31.1	Very low	28.6	Very low	119 Å²	119	128.3 Å²	128.3	73%	0.73	72%	0.715	S	S	*	*			cis	-120.2	-84.1	-4.8	-49.1	0	0	0	0	111.1
1849	D	31.7	Very low	28.9	Very low	120 Å²	120	131.7 Å²	131.7	64%	0.642	73%	0.728	S	S	*	*			cis	-164.8	167.5	-24.1	-137.1	7	0	0	0	108.1
1850	Q	32	Very low	29.1	Very low	158 Å²	158	134.3 Å²	134.3	74%	0.738	74%	0.737	S	S	*	*			cis	-148.4	-167.8	0.1	-155.7	173.4	95.5	0	0	110.4
1851	I	32	Very low	29.5	Very low	145 Å²	145	133.1 Å²	133.1	74%	0.744	74%	0.735	S	S	*	*			trans	-64.6	147.1	-176.9	-66.6	165.1	0	0	0	115.1
1852	S	31.1	Very low	29.5	Very low	89 Å²	89	132.4 Å²	132.4	62%	0.622	73%	0.733	S	S	*	*			cis	-176.8	151.5	-17.5	62.4	0	0	0	0	113.3
1853	S	30.1	Very low	29.7	Very low	94 Å²	94	131.2 Å²	131.2	66%	0.657	73%	0.727	S	S	*	*			trans	39.8	150.7	135.7	66.7	0	0	0	0	123.9
1854	N	30.4	Very low	29.8	Very low	121 Å²	121	134.2 Å²	134.2	65%	0.647	73%	0.725	S	S	*	*			cis	-168.3	154	-1.2	-109.3	20.6	0	0	0	112.3
1855	E	29.2	Very low	29.9	Very low	156 Å²	156	135.8 Å²	135.8	73%	0.729	72%	0.721	S	S	*	*			trans	50.1	160.3	132.5	-58	174.5	145.9	0	0	124
1856	T	28.3	Very low	29.8	Very low	122 Å²	122	134.3 Å²	134.3	75%	0.748	72%	0.717	S	S	*	*			cis	-156.7	-157.8	-27.5	46.4	0	0	0	0	108
1857	P	32.9	Very low	29.9	Very low	118 Å²	118	132 Å²	132	77%	0.766	71%	0.712	S	S	*	*				-130.8	-177.7	-104.4	41.9	-21.1	0	0	0	117.5
1858	S	23.4	Very low	29.8	Very low	105 Å²	105	133.5 Å²	133.5	73%	0.734	72%	0.715	S	S	*	*			trans	-71.6	170.1	174.3	-36.5	0	0	0	0	115
1859	L	29.6	Very low	30.4	Very low	177 Å²	177	132.7 Å²	132.7	93%	0.927	71%	0.712	S	S	*	*				-174	174.3	117	-102.2	169	0	0	0	115.1
1860	L	27.6	Very low	30.4	Very low	156 Å²	156	132.2 Å²	132.2	82%	0.817	71%	0.714	S	S	*	*			trans	-122.5	161.1	-172.9	-87.1	165	0	0	0	113.8
1861	L	30.6	Very low	30.3	Very low	143 Å²	143	131 Å²	131	75%	0.749	71%	0.712	S	S	*	*			trans	-16.6	123.3	173.6	-88.7	69.5	0	0	0	122
1862	N	28.8	Very low	30.3	Very low	124 Å²	124	130.3 Å²	130.3	66%	0.663	71%	0.709	S	S	*	*				72.6	136.5	113.2	-81.4	48.9	0	0	0	126.6
1863	D	29.8	Very low	30.3	Very low	114 Å²	114	132 Å²	132	61%	0.61	71%	0.711	S	S	*	*			trans	69.3	142.2	141	-63.5	-41.9	0	0	0	120
1864	R	29.9	Very low	30.3	Very low	186 Å²	186	133.5 Å²	133.5	70%	0.702	71%	0.711	S	S	*	*			cis	-169.1	145.1	-6.2	-115	168.9	-162.2	-127.9	13.8	114.1
1865	Q	30.2	Very low	30.2	Very low	136 Å²	136	135 Å²	135	64%	0.636	71%	0.714	S	S	*	*			trans	49.2	148.9	131.5	-66.9	178.3	-47.4	0	0	121.6
1866	M	28.2	Very low	30.2	Very low	142 Å²	142	133.5 Å²	133.5	70%	0.7	71%	0.712	S	S	*	*			cis	-171.1	163.3	1.9	-121.8	172.8	141	0	0	115.5
1867	I	30.5	Very low	30.2	Very low	133 Å²	133	133.6 Å²	133.6	68%	0.682	71%	0.712	S	S	*	*			trans	78.1	106	147	-68.5	160.4	0	0	0	121.4
1868	N	28.2	Very low	30.2	Very low	146 Å²	146	133.9 Å²	133.9	78%	0.781	71%	0.714	S	S	*	*				42.7	156.5	103.4	-84.1	29.7	0	0	0	121.7
1869	P	44.4	Very low	30.3	Very low	101 Å²	101	135.9 Å²	135.9	66%	0.656	72%	0.717	S	S	*	*			cis	-155.6	170.8	46.1	43.6	-22	0	0	0	122
1870	T	31.4	Very low	30.3	Very low	111 Å²	111	134.1 Å²	134.1	68%	0.681	71%	0.708	S	S	*	*			trans	61.1	145.7	144.5	52.3	0	0	0	0	120.4
1871	D	30.7	Very low	30.5	Very low	132 Å²	132	135 Å²	135	71%	0.706	71%	0.705	S	S	*	*			cis	-173.7	173.4	2.1	-108.9	1.9	0	0	0	109.6
1872	I	32.2	Very low	30.5	Very low	131 Å²	131	133.6 Å²	133.6	67%	0.672	70%	0.698	S	S	*	*			cis	-171.3	-179.9	-15.6	-165.3	161.5	0	0	0	109.9
1873	N	30.7	Very low	30.6	Very low	125 Å²	125	135.9 Å²	135.9	67%	0.668	70%	0.703	S	S	*	*			trans	79.3	94.9	159.1	-78.4	-8.4	0	0	0	122.9
1874	N	29.5	Very low	30.6	Very low	125 Å²	125	137.2 Å²	137.2	67%	0.668	71%	0.71	S	S	*	*				74.3	113.5	113.3	-73.9	30.9	0	0	0	124.9
1875	E	28.8	Very low	30.4	Very low	151 Å²	151	136.8 Å²	136.8	71%	0.706	72%	0.716	S	S	*	*				94.7	142.8	120.1	-80	-172.9	-160.3	0	0	123.8
1876	N	28.4	Very low	30.5	Very low	126 Å²	126	135.4 Å²	135.4	67%	0.674	72%	0.719	S	S	*	*			trans	74.2	100.1	159.4	-60.5	-43.4	0	0	0	120.4
1877	T	28.2	Very low	30.5	Very low	124 Å²	124	135.6 Å²	135.6	76%	0.761	72%	0.722	S	S	*	*				22.7	134.4	123.6	37.3	0	0	0	0	118.9
1878	P	33.1	Very low	30.1	Very low	124 Å²	124	135.3 Å²	135.3	81%	0.805	73%	0.727	S	S	*	*				-140.9	160.5	91.8	40.6	-29.7	0	0	0	116.4
1879	N	25.9	Very low	30.1	Very low	147 Å²	147	134 Å²	134	79%	0.786	72%	0.723	S	S	*	*			trans	-52.2	160.9	153.7	-71.5	-37.2	0	0	0	110.7
1880	N	29.6	Very low	29.2	Very low	139 Å²	139	134.9 Å²	134.9	74%	0.743	73%	0.727	S	S	*	*				176.6	161.8	85.5	-142.9	-17.1	0	0	0	114.6
1881	K	30.6	Very low	29	Very low	175 Å²	175	136.2 Å²	136.2	76%	0.761	73%	0.729	S	S	*	*			trans	80.5	134.3	167.9	-53.2	-179.4	-176	175.5	0	117.3
1882	N	32	Very low	28.8	Very low	113 Å²	113	135.5 Å²	135.5	60%	0.604	73%	0.729	S	S	*	*			cis	-161.1	144.6	-8.7	-112	3.1	0	0	0	111.7
1883	F	30.1	Very low	28.6	Very low	172 Å²	172	134 Å²	134	75%	0.754	73%	0.731	S	S	*	*			trans	43.3	120.6	136.2	-69.5	-121.3	0	0	0	117.9
1884	N	30.4	Very low	28.3	Very low	143 Å²	143	135.2 Å²	135.2	77%	0.765	74%	0.737	S	S	*	*			cis	-161.9	139.9	46	-97.6	-28	0	0	0	115
1885	Q	25.6	Very low	29	Very low	177 Å²	177	134.4 Å²	134.4	83%	0.827	74%	0.739	S	S	*	*			trans	-84.9	176.8	143.6	-86	-178	-10.8	0	0	108.3
1886	P	32.3	Very low	29.2	Very low	107 Å²	107	135.8 Å²	135.8	70%	0.695	74%	0.739	S	S	*	*			cis	-152.7	-155.2	34.4	40.7	-14.9	0	0	0	116.4
1887	L	28.4	Very low	29.3	Very low	146 Å²	146	139.2 Å²	139.2	76%	0.764	74%	0.743	S	S	*	*			trans	76.5	113.4	170.7	-60.2	152.5	0	0	0	114
1888	T	22.6	Very low	29.3	Very low	127 Å²	127	139.1 Å²	139.1	78%	0.779	74%	0.738	S	S	*	*			cis	77.1	146.9	40.6	-44	0	0	0	0	112.9
1889	V	27.1	Very low	29.3	Very low	118 Å²	118	138.5 Å²	138.5	72%	0.715	74%	0.737	S	S	*	*			trans	98.2	75.4	172.4	-168.5	0	0	0	0	117.2
1890	T	24.8	Very low	29.7	Very low	119 Å²	119	137.3 Å²	137.3	73%	0.73	73%	0.734	S	S	*	*			trans	71.5	159.4	132.8	6.5	0	0	0	0	124.6
1891	I	27.5	Very low	29.7	Very low	140 Å²	140	136 Å²	136	72%	0.718	73%	0.731	S	S	*	*			trans	87.8	99.6	148.7	-71.7	157.6	0	0	0	120.2
1892	T	27.1	Very low	29.7	Very low	116 Å²	116	134.1 Å²	134.1	71%	0.712	73%	0.73	S	S	*	*			trans	47.9	132.4	135.8	69.7	0	0	0	0	125.3
1893	S	28.3	Very low	29.6	Very low	101 Å²	101	136.1 Å²	136.1	71%	0.706	74%	0.735	S	S	*	*			trans	58.3	117.1	132.5	66.8	0	0	0	0	123.2
1894	D	24.5	Very low	29.5	Very low	150 Å²	150	134.1 Å²	134.1	80%	0.802	73%	0.732	S	S	*	*				17.9	157.2	103.9	-66.8	-7.2	0	0	0	120.2
1895	P	44.3	Very low	29.5	Very low	108 Å²	108	134 Å²	134	70%	0.701	73%	0.73	S	S	*	*			cis	-145	-131.9	-49.4	42.7	-21.6	0	0	0	111.4
1896	Y	31.6	Very low	29.5	Very low	180 Å²	180	134.9 Å²	134.9	71%	0.706	73%	0.727	S	S	*	*			trans	100.8	151.3	144	-108.2	-68	0	0	0	124.6
1897	Y	31.2	Very low	29.4	Very low	197 Å²	197	139.8 Å²	139.8	77%	0.773	73%	0.734	S	S	*	*			trans	81.4	139.6	166.3	-72.9	-87.2	0	0	0	120.9
1898	N	28.7	Very low	29.3	Very low	123 Å²	123	141.2 Å²	141.2	66%	0.658	73%	0.734	S	S	*	*			cis	114.2	120.1	1	-92.6	-21.8	0	0	0	118
1899	S	33.8	Very low	29.6	Very low	110 Å²	110	144.9 Å²	144.9	77%	0.769	74%	0.735	S	S	*	*			trans	75.6	164.9	143	86.3	0	0	0	0	119.2
1900	V	32.6	Very low	29.6	Very low	122 Å²	122	144.2 Å²	144.2	74%	0.739	74%	0.735	S	S	*	*			cis	-161.6	157.3	-0.7	93	0	0	0	0	115.4
1901	T	31.2	Very low	29.9	Very low	111 Å²	111	147.9 Å²	147.9	68%	0.681	74%	0.744	S	S	*	*			trans	48.4	130.2	160.4	63.4	0	0	0	0	127.2
1902	N	29.7	Very low	30	Very low	137 Å²	137	149.3 Å²	149.3	73%	0.733	75%	0.747	S	S	*	*				82.3	121.5	127.9	-83.2	-29	0	0	0	126.7
1903	H	30.2	Very low	30.1	Very low	155 Å²	155	151.8 Å²	151.8	72%	0.718	75%	0.751	S	S	*	*			trans	83.7	117.2	135.3	-88	63.1	0	0	0	123.3
1904	N	28.3	Very low	30	Very low	129 Å²	129	152.2 Å²	152.2	69%	0.69	75%	0.754	S	S	*	*			trans	73	119.8	144.5	-74.1	-2.2	0	0	0	123.5
1905	I	29.2	Very low	30.7	Very low	141 Å²	141	150.9 Å²	150.9	72%	0.723	75%	0.753	S	S	*	*			trans	82.6	100.8	133.3	-64.8	173.8	0	0	0	118.5
1906	Y	26.8	Very low	30.3	Very low	195 Å²	195	150.9 Å²	150.9	77%	0.765	75%	0.753	S	S	*	*			trans	73	142.9	150.2	-89.5	-86.5	0	0	0	123.6
1907	Y	29.2	Very low	30.5	Very low	211 Å²	211	149.7 Å²	149.7	83%	0.827	76%	0.758	S	S	*	*			trans	73.1	164.3	159.1	-77.8	-61.6	0	0	0	121.9
1908	K	25.6	Very low	30.2	Very low	176 Å²	176	146.3 Å²	146.3	77%	0.765	75%	0.753	S	S	*	*			trans	-96.1	153.6	-155	-78.4	176.5	168.8	175	0	114.6
1909	Y	29.9	Very low	30.2	Very low	204 Å²	204	146.6 Å²	146.6	80%	0.8	76%	0.755	S	S	*	*			trans	69.2	116.6	151	-76.3	-60.6	0	0	0	121.3
1910	S	27.4	Very low	30.1	Very low	103 Å²	103	148.7 Å²	148.7	72%	0.72	76%	0.763	S	S	*	*			trans	53.3	116.3	136	-53.4	0	0	0	0	123
1911	E	30	Very low	29.9	Very low	197 Å²	197	150.8 Å²	150.8	92%	0.921	77%	0.765	S	S	*	*				-175.8	-173.4	117.8	-100.8	177.7	-175.5	0	0	112.5
1912	H	31.4	Very low	29.9	Very low	169 Å²	169	154.5 Å²	154.5	78%	0.782	77%	0.768	S	S	*	*			trans	-133.7	152.7	-153.8	-89.6	-73.8	0	0	0	117.9
1913	Q	28.8	Very low	30	Very low	169 Å²	169	154.3 Å²	154.3	79%	0.79	77%	0.767	S	S	*	*			trans	71.6	124.9	149.6	-72.7	170.5	1.2	0	0	119.5
1914	S	25.2	Very low	29.9	Very low	110 Å²	110	154.7 Å²	154.7	77%	0.769	77%	0.769	S	S	*	*				81.1	162.2	81.6	-53.2	0	0	0	0	113.4
1915	P	38.9	Very low	30.2	Very low	122 Å²	122	155 Å²	155	79%	0.792	77%	0.766	S	S	*	*			cis	-150.4	-134.9	32.8	49.5	-23.9	0	0	0	115.4
1916	P	36.7	Very low	30	Very low	107 Å²	107	155.6 Å²	155.6	70%	0.695	76%	0.763	S	S	*	*			trans	-141.4	-139.1	-136.1	39.3	-10.1	0	0	0	116.8
1917	L	34.8	Very low	30.1	Very low	156 Å²	156	154.1 Å²	154.1	82%	0.817	76%	0.761	S	S	*	*			trans	78.9	165.9	173.8	-79.3	103	0	0	0	119.1
1918	N	26.2	Very low	30	Very low	125 Å²	125	150 Å²	150	67%	0.668	75%	0.753	S	S	*	*				-169.1	160.8	-55.3	-146.4	14.2	0	0	0	111.3
1919	N	27.9	Very low	30	Very low	130 Å²	130	145.5 Å²	145.5	70%	0.695	74%	0.738	S	S	*	*			trans	48.8	114.5	158	-64.7	-1.2	0	0	0	121.7
1920	T	31.9	Very low	30	Very low	153 Å²	153	142.6 Å²	142.6	94%	0.939	74%	0.736	S	S	*	*				-156.4	153	127	-6.3	0	0	0	0	110.2
1921	E	29	Very low	30.1	Very low	167 Å²	167	141.1 Å²	141.1	78%	0.78	72%	0.72	S	S	*	*			trans	-148.5	173	-169.7	-164.3	176.8	-143.2	0	0	110.4
1922	Y	30.8	Very low	30.5	Very low	188 Å²	188	138.2 Å²	138.2	74%	0.737	72%	0.72	S	S	*	*			trans	87	117.7	164.7	-88.1	-85.5	0	0	0	121.7
1923	N	31.6	Very low	30.2	Very low	134 Å²	134	135.5 Å²	135.5	72%	0.717	71%	0.708	S	S	*	*			trans	80.4	140	131.4	-103.2	11.1	0	0	0	125.2
1924	E	28.8	Very low	30.3	Very low	163 Å²	163	133.3 Å²	133.3	76%	0.762	70%	0.7	S	S	*	*			trans	65.2	148.6	151.9	-66.3	-150.1	143.4	0	0	122
1925	H	34.2	Very low	30.6	Very low	136 Å²	136	135.7 Å²	135.7	63%	0.63	70%	0.699	S	S	*	*			trans	59.7	110.4	177.3	-85.6	-129.2	0	0	0	115.5
1926	K	24.8	Very low	30.2	Very low	152 Å²	152	135 Å²	135	66%	0.661	70%	0.697	S	S	*	*				63.6	137.9	72.4	-69.7	-177	-165.8	148.5	0	112.6
1927	F	28.7	Very low	30	Very low	165 Å²	165	134.8 Å²	134.8	72%	0.724	70%	0.698	S	S	*	*			trans	66.3	108.6	176.2	-69.5	-75.7	0	0	0	112.5	D1929	F1927-D1929 WeakPolarHBondContact CD1-OD2 3.43Å
1928	N	27.6	Very low	29.9	Very low	123 Å²	123	135.6 Å²	135.6	66%	0.658	70%	0.695	S	S	*	*			cis	59.4	150	33.6	-146.7	85.9	0	0	0	112.2
1929	D	25.2	Very low	30.2	Very low	82 Å²	82	137.4 Å²	137.4	44%	0.439	70%	0.699	S	S	.	*			trans	69.2	128.8	-175	-41.1	-33.6	0	0	0	112.6	F1927	F1927-D1929 WeakPolarHBondContact CD1-OD2 3.43Å
1930	N	31	Very low	30.3	Very low	144 Å²	144	136.4 Å²	136.4	77%	0.77	70%	0.702	S	S	*	*			cis	-127	135.2	14.1	-78.9	-84.5	0	0	0	111.1
1931	N	27.6	Very low	30.2	Very low	72 Å²	72	138.7 Å²	138.7	39%	0.385	70%	0.702	S	S	.	*				82	139.4	55	-58.7	-20.3	0	0	0	111.8	H1933	N1931-H1933 HydrophobicContact CB-CB 3.65Å; N1931-H1933 VanDerWaalsContact CG-CG 3.43Å; N1931-H1933 WeakPolarHBondContact OD1-CB 3.49Å; N1931-H1933 PolarHBondContact OD1-CE1 3.42Å; N1931-H1933 PolarHBondContact OD1-ND1 2.64Å
1932	C	39.3	Very low	30.5	Very low	135 Å²	135	136 Å²	136	91%	0.912	70%	0.702	S	S	*	*			cis	-76.7	134.1	8.3	-51.5	0	0	0	0	113.9
1933	H	24.6	Very low	30.8	Very low	113 Å²	113	131.7 Å²	131.7	52%	0.523	70%	0.699	S	S	.	*			cis	83.6	142.9	11.1	-137.4	54.8	0	0	0	117.2	N1931	N1931-H1933 HydrophobicContact CB-CB 3.65Å; N1931-H1933 VanDerWaalsContact CG-CG 3.43Å; N1931-H1933 WeakPolarHBondContact OD1-CB 3.49Å; N1931-H1933 PolarHBondContact OD1-CE1 3.42Å; N1931-H1933 PolarHBondContact OD1-ND1 2.64Å
1934	I	31.2	Very low	31.2	Very low	123 Å²	123	132.8 Å²	132.8	63%	0.631	70%	0.704	S	S	*	*			trans	75.1	130.3	155.9	-79.6	169.1	0	0	0	117.6
1935	H	30.8	Very low	31.8	Very low	159 Å²	159	135.2 Å²	135.2	74%	0.736	71%	0.707	S	S	*	*			cis	-157.9	156	-2.9	-111.7	-37.7	0	0	0	112.7
1936	S	31.4	Very low	31.9	Very low	109 Å²	109	132.3 Å²	132.3	76%	0.762	70%	0.702	S	S	*	*			trans	66.4	150.8	150.1	70.7	0	0	0	0	121.1
1937	S	33.3	Very low	32.6	Very low	101 Å²	101	132.9 Å²	132.9	71%	0.706	71%	0.707	S	S	*	*			cis	-169.3	163.9	-21.2	59.5	0	0	0	0	114
1938	K	31.4	Very low	33.2	Very low	174 Å²	174	131.1 Å²	131.1	76%	0.757	71%	0.705	S	S	*	*			trans	85.2	105.3	156.6	-66.6	-173.7	176.8	-179	0	124.6
1939	Q	32.1	Very low	33.8	Very low	163 Å²	163	131.7 Å²	131.7	76%	0.762	71%	0.713	S	S	*	*				71.8	131.4	121.1	-66	175.3	-77.4	0	0	125.7
1940	S	30.5	Very low	34.2	Very low	108 Å²	108	133.1 Å²	133.1	76%	0.755	73%	0.73	S	S	*	*			trans	65.9	141.3	155.1	43.2	0	0	0	0	120.5
1941	Q	30.9	Very low	34.3	Very low	202 Å²	202	135 Å²	135	94%	0.944	73%	0.734	S	S	*	*			cis	-155	170.5	-3.1	-117.9	169.3	-16.3	0	0	111
1942	S	34.3	Very low	34.3	Very low	110 Å²	110	136.9 Å²	136.9	77%	0.769	75%	0.753	S	S	*	*			trans	-103.7	-177.4	-159.7	66.4	0	0	0	0	115.8
1943	S	37.1	Very low	33.8	Very low	98 Å²	98	136 Å²	136	69%	0.685	75%	0.745	S	S	*	*			cis	-177.4	-178.6	4.9	20.4	0	0	0	0	109.3
1944	I	40.5	Very low	33.9	Very low	157 Å²	157	134.7 Å²	134.7	81%	0.805	75%	0.754	S	S	*	*			cis	171.3	145.9	-30.6	-83.8	165	0	0	0	105.8
1945	Y	40.4	Very low	33.9	Very low	214 Å²	214	134.3 Å²	134.3	84%	0.839	76%	0.762	S	S	*	*			cis	-142.2	-130.2	-2.3	-150.9	-115.3	0	0	0	114.3
1946	S	37.7	Very low	34.3	Very low	75 Å²	75	132.4 Å²	132.4	52%	0.524	76%	0.764	S	S	.	*			trans	-159.3	159.2	-161.8	70.8	0	0	0	0	120.6
1947	Q	39	Very low	34.4	Very low	163 Å²	163	132.4 Å²	132.4	76%	0.762	76%	0.761	S	S	*	*			trans	68.7	-171.2	159.1	-62.2	-155.2	83.4	0	0	119.9
1948	N	40.4	Very low	34.4	Very low	128 Å²	128	132.8 Å²	132.8	68%	0.684	76%	0.764	S	S	*	*				-157	-176.7	-74.6	-79.8	-25.8	0	0	0	107.8
1949	T	40.3	Very low	34.3	Very low	135 Å²	135	132.9 Å²	132.9	83%	0.828	77%	0.767	S	S	*	*			cis	-161.5	-169.2	9	-15.2	0	0	0	0	107.3
1950	S	34.2	Very low	34.3	Very low	112 Å²	112	130.1 Å²	130.1	78%	0.783	76%	0.763	S	S	*	*			cis	-153.4	-93.1	-4.5	50.7	0	0	0	0	113.5
1951	Q	33.2	Very low	34.3	Very low	185 Å²	185	131.9 Å²	131.9	86%	0.864	76%	0.764	S	S	*	*			trans	-134.4	135.5	175.8	-69	-176.2	-0.8	0	0	108.9
1952	S	26.7	Very low	34.3	Very low	111 Å²	111	129 Å²	129	78%	0.776	75%	0.75	S	S	*	*			cis	-157.6	-177.8	-1.1	66.4	0	0	0	0	108.1
1953	P	29.6	Very low	34.2	Very low	116 Å²	116	128.1 Å²	128.1	75%	0.753	74%	0.744	S	S	*	*			cis	-120.6	159.8	-31.7	38.4	-24.8	0	0	0	114.1
1954	A	27.8	Very low	33.9	Very low	86 Å²	86	129.7 Å²	129.7	71%	0.711	75%	0.749	S	S	*	*			trans	54.8	88.8	151.5	0	0	0	0	0	123.5
1955	S	31	Very low	33.4	Very low	114 Å²	114	129.4 Å²	129.4	80%	0.797	75%	0.745	S	S	*	*			trans	73.7	170.3	133.3	81.8	0	0	0	0	119.6
1956	P	37.7	Very low	32.8	Very low	119 Å²	119	125.9 Å²	125.9	77%	0.773	74%	0.736	S	S	*	*			cis	-122.8	-97.1	2.5	22.2	4.5	0	0	0	119.3
1957	P	34.8	Very low	32.3	Very low	109 Å²	109	127.3 Å²	127.3	71%	0.708	75%	0.746	S	S	*	*			trans	-138.9	151.2	-135.5	42	-21.4	0	0	0	121.1
1958	S	33.2	Very low	31.8	Very low	110 Å²	110	128.4 Å²	128.4	77%	0.769	75%	0.748	S	S	*	*			trans	-147.2	123.6	153.2	55.3	0	0	0	0	108.7
1959	Q	29.3	Very low	31.3	Very low	175 Å²	175	130 Å²	130	82%	0.818	75%	0.752	S	S	*	*				73.1	142.3	58.1	-67.3	-166.3	6.2	0	0	115
1960	P	32.5	Very low	30.9	Very low	105 Å²	105	132.3 Å²	132.3	68%	0.682	75%	0.753	S	S	*	*			cis	-141.5	172.4	-36.5	40.2	-23.3	0	0	0	116.1
1961	L	30.7	Very low	31.3	Very low	146 Å²	146	131.8 Å²	131.8	76%	0.764	75%	0.747	S	S	*	*			trans	73.4	146.1	160.4	-98.1	75.8	0	0	0	123.6
1962	Q	29.6	Very low	31.2	Very low	142 Å²	142	134.1 Å²	134.1	66%	0.664	75%	0.748	S	S	*	*			trans	-23.4	151.9	161.8	-69.8	163.3	-6.5	0	0	118.3
1963	S	33	Very low	31.3	Very low	90 Å²	90	136.4 Å²	136.4	63%	0.629	75%	0.75	S	S	*	*	S	Bend	cis	-162.9	165.4	1.2	57.3	0	0	0	0	109.6
1964	T	30.2	Very low	31.1	Very low	131 Å²	131	134.4 Å²	134.4	80%	0.804	75%	0.751	S	S	*	*	S	Bend	cis	-139.3	130.6	20	41.7	0	0	0	0	113.7
1965	Q	31.2	Very low	31.2	Very low	151 Å²	151	137.7 Å²	137.7	71%	0.706	76%	0.755	S	S	*	*			cis	-139.3	99.3	-35.3	-74.6	-167.4	-22.7	0	0	110.1
1966	Q	26.9	Very low	31	Very low	141 Å²	141	140.8 Å²	140.8	66%	0.659	76%	0.757	S	S	*	*			trans	64.6	92.4	140.5	-65.3	175.9	-37.4	0	0	124.1
1967	S	26.9	Very low	30.8	Very low	105 Å²	105	139.1 Å²	139.1	73%	0.734	75%	0.748	S	S	*	*				52.3	125.3	111.9	64.7	0	0	0	0	126.6
1968	K	28.9	Very low	30.7	Very low	186 Å²	186	139.8 Å²	139.8	81%	0.809	75%	0.752	S	S	*	*			trans	51.9	128.8	130.3	-73.6	-170.3	175.5	-175.9	0	125.6
1969	Q	30.1	Very low	30.3	Very low	162 Å²	162	140.9 Å²	140.9	76%	0.757	75%	0.748	S	S	*	*			trans	39.5	116.5	131.7	-66.2	175.6	-65.7	0	0	124.6
1970	Q	30.9	Very low	30.2	Very low	182 Å²	182	143.3 Å²	143.3	85%	0.85	75%	0.75	S	S	*	*			trans	70.3	177.5	133.9	-117.2	-178.1	-8.3	0	0	119.7
1971	P	43.9	Very low	29.9	Very low	102 Å²	102	143.4 Å²	143.4	66%	0.662	75%	0.749	S	S	*	*				-126.8	168.8	-114.9	43.8	-28.4	0	0	0	118.4
1972	R	29.9	Very low	29.8	Very low	233 Å²	233	142.2 Å²	142.2	88%	0.879	74%	0.743	S	S	*	*			trans	41.3	139.6	158.8	-71	-173.8	170.7	-176.6	-1.8	118.8
1973	L	30.1	Very low	29.8	Very low	159 Å²	159	144.3 Å²	144.3	83%	0.832	75%	0.745	S	S	*	*			cis	-169	147.3	4.2	-114	165.7	0	0	0	106.2
1974	G	25.5	Very low	29.9	Very low	75 Å²	75	149.4 Å²	149.4	77%	0.773	75%	0.752	S	S	*	*			trans	156.6	119.4	169.1	0	0	0	0	0	117.5
1975	I	28.4	Very low	30	Very low	154 Å²	154	150.4 Å²	150.4	79%	0.79	75%	0.751	S	S	*	*			trans	-82.6	134.4	-168.7	-50.3	164.5	0	0	0	112.7
1976	H	27.6	Very low	29.9	Very low	179 Å²	179	150.3 Å²	150.3	83%	0.829	76%	0.756	S	S	*	*				-179.4	164.4	118.6	-107.3	-82.5	0	0	0	114.1
1977	S	34.4	Very low	29.9	Very low	84 Å²	84	148.3 Å²	148.3	59%	0.587	76%	0.757	S	S	*	*			trans	-137.7	157.7	-163.6	56.4	0	0	0	0	114.5
1978	P	31.5	Very low	30	Very low	123 Å²	123	149.2 Å²	149.2	80%	0.799	76%	0.758	S	S	*	*				-131.1	132.8	125.7	34.8	-25	0	0	0	111.1
1979	I	25.8	Very low	29.8	Very low	133 Å²	133	148.3 Å²	148.3	68%	0.682	76%	0.757	S	S	*	*				87.6	98.2	57.2	-68.5	169	0	0	0	113.6
1980	R	25.6	Very low	29.6	Very low	226 Å²	226	148.8 Å²	148.8	85%	0.853	76%	0.759	S	S	*	*			trans	60.8	168.1	140.7	-62.8	-176.8	170.6	168.3	-3.3	118.4
1981	T	26.3	Very low	29.3	Very low	107 Å²	107	145.9 Å²	145.9	66%	0.656	76%	0.759	S	S	*	*			cis	-154.3	153.3	2.5	-15.2	0	0	0	0	111.4
1982	N	29.8	Very low	28.4	Very low	121 Å²	121	145.2 Å²	145.2	65%	0.647	76%	0.762	S	S	*	*				154.4	145.9	125.5	-78.1	-32.7	0	0	0	110.7
1983	R	29.4	Very low	28.1	Very low	187 Å²	187	142.8 Å²	142.8	71%	0.706	76%	0.759	S	S	*	*			cis	-152.1	150.1	-25.6	-91.1	170.9	-157	179.8	4.4	104.1
1984	Y	34.9	Very low	27.7	Very low	196 Å²	196	142.8 Å²	142.8	77%	0.769	75%	0.752	S	S	*	*				-158.9	150.8	53.7	-92.3	-87.2	0	0	0	112
1985	L	32.5	Very low	27.6	Very low	152 Å²	152	146.8 Å²	146.8	80%	0.796	75%	0.75	S	S	*	*			trans	63.3	119.4	162	-57.2	162	0	0	0	116.3
1986	N	27.6	Very low	27.4	Very low	150 Å²	150	145.6 Å²	145.6	80%	0.802	75%	0.75	S	S	*	*			cis	60.8	143.4	50	-71.5	14	0	0	0	114.5
1987	S	27.6	Very low	27.3	Very low	99 Å²	99	140.3 Å²	140.3	69%	0.692	74%	0.744	S	S	*	*			cis	-172.3	-178.5	-16.9	59	0	0	0	0	107.6
1988	T	28.7	Very low	26.8	Very low	123 Å²	123	143.7 Å²	143.7	76%	0.755	75%	0.752	S	S	*	*			cis	-139	-105.3	8.7	-40.9	0	0	0	0	112.1
1989	E	26.1	Very low	26.7	Very low	167 Å²	167	144.8 Å²	144.8	78%	0.78	75%	0.751	S	S	*	*			trans	-147.8	171	-165.4	-75.4	179	113.8	0	0	113.9
1990	Q	25.3	Very low	26.9	Very low	172 Å²	172	147.7 Å²	147.7	80%	0.804	76%	0.762	S	S	*	*			trans	-5.9	135.6	161.3	-51.8	178.1	13.8	0	0	120.2
1991	S	23.6	Very low	26.8	Very low	122 Å²	122	145 Å²	145	85%	0.853	76%	0.759	S	S	*	*				166.6	167.7	104.7	51.4	0	0	0	0	111.2
1992	A	25.1	Very low	26.8	Very low	88 Å²	88	149.2 Å²	149.2	73%	0.727	77%	0.768	S	S	*	*			trans	-94.7	146.5	-173.3	0	0	0	0	0	112.7
1993	F	23.9	Very low	26.5	Very low	182 Å²	182	150.6 Å²	150.6	80%	0.798	78%	0.775	S	S	*	*				-170.2	-176.4	123.3	-121.7	-105.9	0	0	0	111.8
1994	K	22.2	Very low	26.3	Very low	158 Å²	158	146.3 Å²	146.3	69%	0.687	77%	0.774	S	S	*	*			trans	-42.2	161.9	169.7	-60.2	172.3	-176.5	174.3	0	114
1995	Q	24.4	Very low	25.7	Very low	160 Å²	160	145.5 Å²	145.5	75%	0.748	78%	0.782	S	S	*	*			cis	-162.6	155.6	21.7	-141.2	151.3	-43.8	0	0	113.7
1996	V	22.7	Very low	25.4	Very low	128 Å²	128	143 Å²	143	78%	0.776	78%	0.777	S	S	*	*			trans	10.2	131	142.4	-178	0	0	0	0	119.7	M1998	V1996-M1998 HydrophobicContact CG1-CG 4.31Å
1997	G	26.3	Very low	25.2	Very low	68 Å²	68	141.4 Å²	141.4	70%	0.701	77%	0.768	S	S	*	*			trans	165.9	75.6	163.6	0	0	0	0	0	112.2
1998	M	23.8	Very low	25	Very low	155 Å²	155	140.9 Å²	140.9	76%	0.764	76%	0.758	S	S	*	*				95.5	145.2	78.5	-82.6	-83.1	-75.1	0	0	112.8	V1996	V1996-M1998 HydrophobicContact CG1-CG 4.31Å
1999	N	28.9	Very low	24.9	Very low	147 Å²	147	141.8 Å²	141.8	79%	0.786	76%	0.757	S	S	*	*			trans	72.9	129.6	-177.5	-47.2	-30	0	0	0	114.6
2000	Q	29.7	Very low	24.8	Very low	193 Å²	193	139.2 Å²	139.2	90%	0.902	74%	0.743	S	S	*	*			cis	-124.9	157.3	6.5	-71.4	-175.5	-30	0	0	113.4
2001	E	23.1	Very low	24.8	Very low	169 Å²	169	135 Å²	135	79%	0.79	73%	0.726	S	S	*	*			trans	-88.8	145.2	177.5	-48.9	151.2	110.3	0	0	112.3
2002	K	27.3	Very low	24.9	Very low	197 Å²	197	134.5 Å²	134.5	86%	0.857	72%	0.722	S	S	*	*				178.1	131.2	126.6	-94.5	152.5	-172.4	174.6	0	109
2003	L	22.5	Very low	25	Very low	149 Å²	149	136.5 Å²	136.5	78%	0.78	72%	0.719	S	S	*	*			cis	79.7	135.7	31.5	-143.6	173.3	0	0	0	112.1
2004	S	25.3	Very low	25.5	Very low	98 Å²	98	133.3 Å²	133.3	69%	0.685	72%	0.716	S	S	*	*			trans	71	134.2	-161	76.8	0	0	0	0	114.1
2005	L	23.3	Very low	25.8	Very low	179 Å²	179	132.1 Å²	132.1	94%	0.937	72%	0.718	S	S	*	*			cis	70.2	64.8	-3.4	-132.3	174.2	0	0	0	116.6
2006	S	25.6	Very low	26.1	Very low	99 Å²	99	130.9 Å²	130.9	69%	0.692	72%	0.716	S	S	*	*			trans	-150.9	140.5	150	-158.4	0	0	0	0	105.8
2007	N	23.1	Very low	26.4	Very low	116 Å²	116	130 Å²	130	62%	0.62	71%	0.707	S	S	*	*			cis	75.6	131	32.3	-116.8	10.9	0	0	0	115.8	H88	H88-N2007 PolarHBondContact NE2-OD1 3.41Å
2008	D	23.3	Very low	26.5	Very low	89 Å²	89	135.5 Å²	135.5	48%	0.476	71%	0.712	S	S	.	*			trans	86.8	155.3	165.8	-58	-29.6	0	0	0	121.9	H88 Q89	H88-D2008 PolarHBondContact CE1-N 2.91Å; H88-D2008 IonicContact CE1-OD1 3.52Å; H88-D2008 PolarHBondContact CE1-OD1 3.12Å; Q89-D2008 PolarHBondContact NE2-OD1 3.43Å
2009	I	28.5	Very low	26.8	Very low	142 Å²	142	133 Å²	133	73%	0.728	71%	0.709	S	S	*	*			trans	85.1	87.5	165.1	-54	160	0	0	0	116.7
2010	K	23.9	Very low	26.9	Very low	112 Å²	112	130 Å²	130	49%	0.487	71%	0.706	S	S	.	*				71.2	128.3	92.2	-67.5	179.8	-174.8	167.9	0	118.6	Q89 Q90	Q89-K2010 HydrophobicContact CB-CG 3.62Å; Q89-K2010 WeakPolarHBondContact O-CA 3.43Å; Q90-K2010 HydrophobicContact CB-CG 4.38Å; Q90-K2010 WeakPolarHBondContact O-CB 3.45Å; Q90-K2010 WeakPolarHBondContact O-CG 3.42Å
2011	L	23.7	Very low	26.9	Very low	85 Å²	85	127.5 Å²	127.5	45%	0.445	70%	0.698	S	S	.	*			trans	30.1	142.1	144.6	-94.2	-178.6	0	0	0	121.5	Q90 V92 I2013	Q90-L2011 WeakPolarHBondContact O-CB 3.3Å; Q90-L2011 VanDerWaalsContact O-CD1 3.29Å; Q90-L2011 WeakPolarHBondContact O-CD1 3.46Å; Q90-L2011 WeakPolarHBondContact O-CG 3Å; V92-L2011 HydrophobicContact CG2-CD1 4.08Å; L2011-I2013 HydrophobicContact CD2-CD1 4.49Å; L2011-I2013 HydrophobicContact CD2-CG1 4.34Å
2012	S	27.4	Very low	27.2	Very low	111 Å²	111	125 Å²	125	78%	0.776	69%	0.69	S	S	*	*				-155.4	160.5	79.6	59.9	0	0	0	0	117.1
2013	I	27.2	Very low	27.3	Very low	130 Å²	130	125 Å²	125	67%	0.667	69%	0.686	S	S	*	*			trans	-119.6	131.5	171.6	-73.4	169.6	0	0	0	106.8	L2011	L2011-I2013 HydrophobicContact CD2-CD1 4.49Å; L2011-I2013 HydrophobicContact CD2-CG1 4.34Å
2014	P	33.4	Very low	27.6	Very low	114 Å²	114	124.2 Å²	124.2	74%	0.74	68%	0.682	S	S	*	*				-127.5	146.9	99.5	5.2	17.9	0	0	0	112.3
2015	N	27.6	Very low	27.7	Very low	134 Å²	134	123.6 Å²	123.6	72%	0.717	68%	0.678	S	S	*	*				57.4	129.6	72.6	-72.5	7.9	0	0	0	113.1
2016	D	30.9	Very low	27.8	Very low	133 Å²	133	121.7 Å²	121.7	71%	0.711	67%	0.668	S	S	*	*				-152.1	144.7	53	-107	-36.6	0	0	0	118.2
2017	N	28.9	Very low	27.9	Very low	110 Å²	110	124.6 Å²	124.6	59%	0.588	67%	0.671	S	S	*	*			trans	45	119.7	141	-81.6	-79.8	0	0	0	125.4
2018	K	29.8	Very low	28.2	Very low	183 Å²	183	126.1 Å²	126.1	80%	0.796	68%	0.678	S	S	*	*			trans	72.1	148.5	133.6	-67	169.7	-179	166.3	0	120.3
2019	S	29.4	Very low	28.2	Very low	102 Å²	102	128.5 Å²	128.5	71%	0.713	69%	0.69	S	S	*	*			cis	-172.5	153.5	-12.4	48.8	0	0	0	0	112.4
2020	A	30.8	Very low	28.1	Very low	86 Å²	86	127.8 Å²	127.8	71%	0.711	69%	0.687	S	S	*	*			trans	69.9	148.8	164.3	0	0	0	0	0	117.3
2021	D	29.8	Very low	28.4	Very low	140 Å²	140	130.7 Å²	130.7	75%	0.749	70%	0.702	S	S	*	*			cis	-161	156.4	-12	-116	-0.2	0	0	0	113.3
2022	N	29.8	Very low	28.6	Very low	116 Å²	116	131.2 Å²	131.2	62%	0.62	71%	0.713	S	S	*	*			trans	66.3	124	149.6	-66.6	-38.4	0	0	0	125.4
2023	Y	30	Very low	28.7	Very low	196 Å²	196	133.3 Å²	133.3	77%	0.769	72%	0.715	S	S	*	*			trans	53.1	147	135.6	-72.8	-107.8	0	0	0	122.3
2024	L	27.6	Very low	29	Very low	134 Å²	134	132 Å²	132	70%	0.702	72%	0.717	S	S	*	*			cis	-169.2	153.2	-23.9	-157.7	77.8	0	0	0	111.2
2025	S	27.1	Very low	28.8	Very low	84 Å²	84	134.9 Å²	134.9	59%	0.587	73%	0.725	S	S	*	*			trans	60.2	119.4	148.3	57.1	0	0	0	0	123.8
2026	N	27	Very low	28.8	Very low	139 Å²	139	136.6 Å²	136.6	74%	0.743	76%	0.757	S	S	*	*			trans	66.9	152.1	132.2	-61.9	29.3	0	0	0	119.5
2027	E	26	Very low	28.7	Very low	161 Å²	161	136.8 Å²	136.8	75%	0.752	76%	0.76	S	S	*	*			cis	-157.1	-170.6	7.7	-141.3	165.4	-108.4	0	0	112.9
2028	I	29.5	Very low	28.7	Very low	148 Å²	148	138.2 Å²	138.2	76%	0.759	77%	0.769	S	S	*	*			trans	84.1	88.7	163.6	-43.6	-167.1	0	0	0	119.8
2029	N	24.8	Very low	28.6	Very low	138 Å²	138	135.7 Å²	135.7	74%	0.738	77%	0.767	S	S	*	*				57.5	134.1	117.2	-105.5	-7.6	0	0	0	125.2
2030	I	26.2	Very low	28.6	Very low	127 Å²	127	137.6 Å²	137.6	65%	0.651	77%	0.77	S	S	*	*			trans	73.5	110.4	143.7	-57.8	159.8	0	0	0	118.9
2031	H	29.7	Very low	28.4	Very low	174 Å²	174	140.9 Å²	140.9	81%	0.806	77%	0.774	S	S	*	*				-153.6	159.8	104.1	-122.1	-75.9	0	0	0	115
2032	S	28.4	Very low	28.3	Very low	96 Å²	96	140.9 Å²	140.9	67%	0.671	78%	0.776	S	S	*	*			trans	-71.4	158.5	-178.1	52.8	0	0	0	0	115.2
2033	N	29	Very low	28.2	Very low	155 Å²	155	142.7 Å²	142.7	83%	0.829	79%	0.787	S	S	*	*			trans	-127.3	142.4	162.9	-135.9	2.5	0	0	0	112.1
2034	S	33.1	Very low	28.1	Very low	101 Å²	101	138.6 Å²	138.6	71%	0.706	79%	0.788	S	S	*	*			trans	26.2	133.9	156.7	58.7	0	0	0	0	122.6
2035	I	29.6	Very low	28.1	Very low	175 Å²	175	139 Å²	139	90%	0.897	80%	0.795	S	S	*	*			trans	-57.8	131.6	165	-62.6	158.3	0	0	0	112.2
2036	A	27.5	Very low	28.2	Very low	170 Å²	170	144 Å²	144	100%	1.405	81%	0.814	S	S	*	*			trans	-158	0	151.5	0	0	0	0	0	109.3

Retrieved 2,036 of 2,036 residues in 2121.3 ms (Link to these results)

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